CC(C)[C@@](C)(O)[C@@H]1CN(c2nc(-c3n[nH]c4ncccc34)c(F)cc2Cl)CCN1 CHEMBL2326002 Ki 0.08 nM
CCOc1ccnc2[nH]c(=O)n(-c3nc(N4CCCNCC4)ccc3Cl)c12 CHEMBL4082370 IC50 0.086 nM
Cc1cccc2c(C3=C(c4nc(N5CCN(C)CC5)nc5ccccc45)C(=O)NC3=O)c[nH]c12 CHEMBL2151411 IC50 0.1 nM
CC(C)[C@@](C)(O)[C@@H]1CN(c2nc(-c3n[nH]c4ncccc34)c(F)cc2F)CCN1 CHEMBL2326001 Ki 0.1 nM
CC(C)[C@@](C)(O)[C@@H]1CN(c2nc(-c3n[nH]c4ncccc34)c(F)cc2CO)CCN1 CHEMBL2326000 Ki 0.1 nM
CC(C)[C@@](C)(O)[C@@H]1CN(c2nc(-c3n[nH]c4ncccc34)c(F)cc2O)CCN1 CHEMBL2325998 Ki 0.1 nM
N#Cc1cnc(NCc2ccccc2OC(F)(F)F)nc1NCC12CC3CC(C1)C(N[C@H]1CC[C@H](N)CC1)C(C3)C2 CHEMBL4578497 IC50 0.1 nM
CO[C@@H](CC[C@H](C)[C@H]1O[C@@]23C[C@H](OC(=O)C[C@H]([C@@H](C)O)OC(=O)C[C@](O)(O2)[C@H](C)CC3(C)C)[C@@H]1C)c1cccc(O)c1 CHEMBL2148106 Ki 0.11 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nccc(Cl)c3C(F)(F)F)cnc2N)CC1 CHEMBL3921551 IC50 0.13 nM
Nc1ncc(-c2nc(N3CCOCC3)ccc2C(F)(F)F)nc1C(=O)Nc1ncccc1N1CCC(N)(CO)CC1 CHEMBL3920517 IC50 0.13 nM
CCN1CCC[C@@H](CNc2nc(Nc3cc(OC)cc(-n4nnnc4C)c3)ncc2F)C1 CHEMBL3586039 IC50 0.14 nM
CO[C@@H](CC[C@H](C)[C@H]1O[C@@]23C[C@H](OC(=O)C[C@H]([C@@H](C)O)OC(=O)C[C@](O)(O2)[C@H](C)CC3(C)C)[C@@H]1C)c1cc(O)ccc1Br CHEMBL1256416 Ki 0.16 nM
Nc1ncc(-c2cc(N3CCOCC3)cc(C(F)(F)F)c2)nc1C(=O)Nc1ncccc1N1CCC(N)CC1 CHEMBL3893533 IC50 0.16 nM
CC(C)(C)OC(=O)N1CCN(c2ccc([N+](=O)[O-])c(-n3c(=O)[nH]c4ncccc43)n2)C(c2ccccc2)C1 CHEMBL4065996 IC50 0.18 nM
CC(C)[C@@](C)(O)[C@@H]1CN(c2ccc(F)c(-c3n[nH]c4ncccc34)n2)CCN1 CHEMBL2326007 Ki 0.2 nM
C[C@@H]1[C@@H]([C@@H](C)CCCc2cccc(O)c2)O[C@@]23C[C@@H]1OC(=O)C[C@H]([C@@H](C)O)OC(=O)C[C@](O)(O2)[C@H](C)CC3(C)C CHEMBL2418196 Ki 0.2 nM
Nc1ncc(-c2nc(N3CCOCC3)cc3ccccc23)nc1C(=O)Nc1ncccc1N1CCC(N)CC1 CHEMBL3966595 IC50 0.2 nM
C#CCC(C)(CN)c1cccc(-c2ccnc3[nH]ncc23)c1 CHEMBL4469412 Ki 0.2 nM
CN1CCN(c2nc(C3=C(c4c[nH]c5ccccc45)C(=O)NC3=O)c3ccccc3n2)CC1 CHEMBL565612 IC50 0.22 nM
Nc1ncc(-c2cccc3[nH]ccc23)nc1C(=O)Nc1ncccc1N1CCC(N)CC1 CHEMBL3982497 IC50 0.23 nM
CC(C)Sc1ncccc1CNc1ncc(C#N)c(NCC23CC4CC(C2)C(NC[C@H]2CC[C@H](O)CC2)C(C4)C3)n1 CHEMBL4547465 IC50 0.23 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nc(N)ncc3Cl)cnc2N)CC1 CHEMBL3907088 IC50 0.24 nM
C[C@H](c1ccccc1)N1c2cc(-n3c(=O)[nH]c4ncccc43)ccc2C(=O)NC1(C)C CHEMBL3798011 IC50 0.25 nM
Nc1ncc(-c2ccccc2)nc1C(=O)Nc1ccccc1N1CCC(N)CC1 CHEMBL3943813 IC50 0.25 nM
Nc1ncc(-c2nc(N3CCOCC3)ncc2C(F)(F)F)nc1C(=O)Nc1ncccc1N1CCC(N)CC1 CHEMBL3984070 IC50 0.27 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nc(C(N)=O)ncc3F)cnc2N)CC1 CHEMBL3937993 IC50 0.27 nM
Cc1c(Nc2c(C#N)cncc2-c2cc3cc(CN4CCN(C)CC4)ccc3o2)ccc2[nH]ccc12 CHEMBL571581 IC50 0.28 nM
CCOCC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3ncccc3OC(F)(F)F)cnc2N)CC1 CHEMBL3987185 IC50 0.29 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nc(N4CCOCC4)cc4ccccc34)cnc2N)CC1 CHEMBL3892099 IC50 0.3 nM
CCC(C)(CN)c1cccc(-c2ccnc3[nH]nc(Cl)c23)c1 CHEMBL4528271 Ki 0.3 nM
O=C1NC(=O)C(c2c[nH]c3ccccc23)=C1c1nc(N2CCNCC2)nc2ccccc12 CHEMBL1996510 pKi 0.3162 nM
Cc1c(Nc2c(C#N)cncc2/C=C/c2cccc(CN3CCNCC3)n2)ccc2[nH]ccc12 CHEMBL1082225 IC50 0.32 nM
COc1cc(Nc2ncc(F)c(NC[C@@H]3CCCN(C)C3)n2)cc(-n2nnnc2C)c1 CHEMBL3586038 IC50 0.32 nM
CCOc1ccnc(-c2cnc(N)c(C(=O)Nc3ncccc3N3CCC(C)(N)CC3)n2)c1C(F)(F)F CHEMBL3967601 IC50 0.33 nM
Nc1ncc(-c2ccccc2F)nc1C(=O)Nc1cnccc1N1CCC(N)CC1 CHEMBL3895998 IC50 0.33 nM
Cc1cc2c(-c3cnc(N)c(C(=O)Nc4ncccc4N4CCC(N)CC4)n3)cccc2[nH]1 CHEMBL3969856 IC50 0.36 nM
Nc1ncc(-c2nc(N3CCOCC3)ccc2C(F)(F)F)nc1C(=O)Nc1ncccc1N1CCC(N)CC1 CHEMBL3966643 IC50 0.36 nM
N#Cc1cnc(NCc2ccccc2OC(F)(F)F)nc1NCC12CC3CC(C1)C(N[C@H]1CC[C@H](O)CC1)C(C3)C2 CHEMBL4540382 IC50 0.38 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3ncccc3C(F)(F)F)cnc2N)CC1 CHEMBL3982723 IC50 0.4 nM
CCC(C)(CN)c1cccc(-c2ccnc3[nH]nc(C(F)(F)F)c23)c1 CHEMBL4569479 Ki 0.4 nM
N#Cc1cnc(NCc2ccccc2OC(F)(F)F)nc1NCC12CC3CC(C1)C(NC[C@H]1CC[C@H](O)CC1)C(C3)C2 CHEMBL4580751 IC50 0.42 nM
Nc1ncc(-c2nc(N3CCOCC3)nc3ccc(F)cc23)nc1C(=O)Nc1ncccc1N1CCC(N)CC1 CHEMBL3958917 IC50 0.43 nM
Cc1ncc(C#N)c(Nc2ccc3[nH]ccc3c2C)c1/C=C/c1cccc(S(=O)(=O)N2CCN(C)CC2)c1 CHEMBL1080995 IC50 0.44 nM
CSc1ncccc1CNc1ncc(C#N)c(NCC23CC4CC(C2)C(NC[C@H]2CC[C@H](O)CC2)C(C4)C3)n1 CHEMBL4575526 IC50 0.44 nM
COc1ccnc(-c2cnc(N)c(C(=O)Nc3ncccc3N3CCC(C)(N)CC3)n2)c1C(F)(F)F CHEMBL3899197 IC50 0.45 nM
COCCN1CCC[C@@H](CNc2nc(Nc3cc(OC)cc(-n4nnnc4C)c3)ncc2F)C1 CHEMBL3586040 IC50 0.46 nM
CC1(C)NC(=O)c2ccc(-n3c(=O)[nH]c4ncccc43)cc2N1Cc1ccccc1 CHEMBL3798679 IC50 0.46 nM
CCSc1ncccc1CNc1ncc(C#N)c(NCC23CC4CC(C2)C(NC[C@H]2CC[C@H](O)CC2)C(C4)C3)n1 CHEMBL4524977 IC50 0.46 nM
CCN1CCN(Cc2ccc3oc(-c4cncc(C#N)c4Nc4ccc5[nH]ccc5c4C)cc3c2)CC1 CHEMBL570713 IC50 0.48 nM
Cc1c(Nc2c(C#N)cncc2/C=C/c2cccc(S(=O)(=O)N3CCN(C)CC3)c2)ccc2[nH]ccc12 CHEMBL1080994 IC50 0.49 nM
C[C@H]1[C@@H]2C[C@@]3(O[C@H](CCC3(C)C)CC(=O)O[C@@H](CO)CC(=O)O2)O[C@@H]1CCCCc1cccc(O)c1 CHEMBL2148108 Ki 0.54 nM
N#Cc1cnc(NCc2ccccc2C(F)(F)F)nc1NCC12CC3CC(C1)C(NC[C@H]1CC[C@H](O)CC1)C(C3)C2 CHEMBL4594002 IC50 0.57 nM
CC(C)Oc1ncccc1CNc1ncc(C#N)c(NCC23CC4CC(C2)C(NC[C@H]2CC[C@H](O)CC2)C(C4)C3)n1 CHEMBL4439095 IC50 0.59 nM
CC(C)C[C@H]1CN(c2ccc(-c3ccccc3)c(C(=O)c3cccnc3N)n2)CCN1 CHEMBL2046649 Ki 0.6 nM
CN1CCN(c2nc(C3=C(c4c[nH]c5ccccc45)C(=O)NC3=O)c3cc(F)ccc3n2)CC1 CHEMBL2153750 IC50 0.6 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nccc(C#N)c3C(F)(F)F)cnc2N)CC1 CHEMBL3889877 IC50 0.63 nM
Cc1c(Nc2c(C#N)cncc2/C=C/c2cccc(CN3CCN(CCO)CC3)n2)ccc2[nH]ccc12 CHEMBL1091481 IC50 0.65 nM
N#Cc1cnc(NCc2ccccc2OC(F)(F)F)nc1NCC12CC3CC(C1)C(N[C@H]1CC[C@@H](O)CC1)C(C3)C2 CHEMBL4529215 IC50 0.66 nM
Cc1c(Nc2c(C#N)cncc2-c2cc3cc(CN4CCN(C)CC4)ccc3s2)ccc2[nH]ccc12 CHEMBL570277 IC50 0.67 nM
Nc1ncc(-c2cccc3[nH]ncc23)nc1C(=O)Nc1ncccc1N1CCC(N)CC1 CHEMBL3957715 IC50 0.67 nM
COc1cc(Nc2ncc(F)c(NCC3CCN(C)CC3)n2)cc(-n2nnnc2C)c1 CHEMBL3586036 IC50 0.68 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nc(N4CCOCC4)ncc3F)cnc2N)CC1 CHEMBL3945647 IC50 0.68 nM
Cn1ccc2c(-c3cnc(N)c(C(=O)Nc4ncccc4N4CCC(N)CC4)n3)cccc21 CHEMBL3983009 IC50 0.68 nM
COc1ccc(C(F)(F)F)c(-c2cnc(N)c(C(=O)Nc3ncccc3N3CCC(C)(N)CC3)n2)n1 CHEMBL3981769 IC50 0.69 nM
N#Cc1cnc(NCc2ccccc2OC(F)(F)F)nc1NC[C@]12C[C@@H]3C[C@H](C1)[C@@H](NCCO)[C@@H](C3)C2 CHEMBL4289707 IC50 0.7 nM
N#Cc1cnc(NCc2ccccc2OC(F)(F)F)nc1NCC12CC3CC(C1)C(NCCO)C(C3)C2 CHEMBL4526554 IC50 0.7 nM
CCC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3ncccc3F)cnc2N)CC1 CHEMBL3975025 IC50 0.71 nM
CCCC(=O)O[C@@H]1[C@@H](C)[C@@]2(O)[C@@H](C=C(CO)C[C@]3(O)C(=O)C(C)=C[C@@H]23)[C@@H]2C(C)(C)[C@]12OC(=O)CCC CHEMBL27768 Kd 0.72 nM
CCCC(=O)O[C@@H]1[C@@H](C)[C@]2(O)[C@@H]3C=C(C)C(=O)[C@H]3CC(CO)=C[C@H]2[C@@H]2C(C)(C)[C@]12OC(=O)CCC CHEMBL265998 Ki 0.73 nM
CCOCC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3ncccc3C(F)(F)F)cnc2N)CC1 CHEMBL3914762 IC50 0.79 nM
NC1CCC(Nc2nc(Cl)cc(-c3c[nH]c4ncccc34)n2)CC1 CHEMBL1973720 pKi 0.7943 nM
Cc1c(Nc2c(C#N)cncc2/C=C/c2cccc(CN3CCC(N(C)C)CC3)n2)ccc2[nH]ccc12 CHEMBL1088737 IC50 0.84 nM
Nc1ncc(-c2ccccc2)nc1C(=O)Nc1cnccc1N1CCC(N)CC1 CHEMBL3963605 IC50 0.84 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nc(N4CCC(F)(F)CC4)ncc3F)cnc2N)CC1 CHEMBL3970090 IC50 0.85 nM
CC(C)Oc1ccnc(-c2cnc(N)c(C(=O)Nc3ncccc3N3CCC(C)(N)CC3)n2)c1C#N CHEMBL3935341 IC50 0.86 nM
CN(C)c1ccc(C(F)(F)F)c(-c2cnc(N)c(C(=O)Nc3ncccc3N3CCC(N)CC3)n2)n1 CHEMBL3943147 IC50 0.87 nM
CN1CCCCOc2ccnc3[nH]c(=O)n(c23)-c2nc1ccc2Cl CHEMBL4092652 IC50 0.87 nM
Cc1c(Nc2c(C#N)cncc2/C=C/CCN2CCC(N)CC2)ccc2[nH]ccc12 CHEMBL593883 IC50 0.88 nM
Nc1ncc(-c2cc(N3CCOCC3)ccc2C(F)(F)F)nc1C(=O)Nc1ncccc1N1CCC(N)CC1 CHEMBL3980746 IC50 0.88 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3ncccc3Cl)cnc2N)CC1 CHEMBL3892736 IC50 0.9 nM
CSc1ccccc1CNc1ncc(C#N)c(NCC23CC4CC(C2)C(NC[C@H]2CC[C@H](O)CC2)C(C4)C3)n1 CHEMBL4466775 IC50 0.94 nM
Nc1ncc(-c2cccc3[nH]c(C(F)(F)F)cc23)nc1C(=O)Nc1ncccc1N1CCC(N)CC1 CHEMBL3951893 IC50 0.99 nM
CC(C)[C@@](C)(O)[C@@H]1CN(c2nc(-c3n[nH]c4ncccc34)c(F)cc2C#N)CCN1 CHEMBL2325999 Ki 1.0 nM
CC(C)[C@](C)(O)[C@@H]1CN(c2ccc(F)c(-c3n[nH]c4ncccc34)n2)CCN1 CHEMBL2326009 Ki 1.0 nM
CN(c1ncccc1CNc1nc(Nc2ccc3c(c2)CC(=O)N3)ncc1C(F)(F)F)S(C)(=O)=O CHEMBL1084546 Kd apparent 1.0 nM
Cc1c(Nc2c(C#N)cncc2/C=C/c2cccc(CN3CCN(C)CC3)n2)ccc2[nH]ccc12 CHEMBL1084411 IC50 1.1 nM
CCC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3ncccc3C(F)(F)F)cnc2N)CC1 CHEMBL3920740 IC50 1.1 nM
Cc1c(Nc2c(C#N)cncc2/C=C/c2cccc(CN3CCOCC3)c2)ccc2[nH]ccc12 CHEMBL1086419 IC50 1.2 nM
CN1CCN(c2nc(C3=C(c4c[nH]c5ccccc45)C(=O)NC3=O)c3cc(Cl)ccc3n2)CC1 CHEMBL2153751 IC50 1.2 nM
Cn1cc(C2=C(c3nc(N4CCNCC4)nc4ccccc34)C(=O)NC2=O)c2ccccc21 CHEMBL2151415 IC50 1.2 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nc(C4CC(F)(F)C4)ccc3C(F)(F)F)cnc2N)CC1 CHEMBL3970381 IC50 1.2 nM
COc1ccnc(-c2cnc(N)c(C(=O)Nc3ncccc3N3CCC(C)(N)CC3)n2)c1F CHEMBL3891166 IC50 1.2 nM
COCC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3ncccc3F)cnc2N)CC1 CHEMBL3919244 IC50 1.2 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3ncccc3C#N)cnc2N)CC1 CHEMBL3942560 IC50 1.2 nM
Nc1ncc(-c2ncccc2OC(F)(F)F)nc1C(=O)Nc1ncccc1N1CC[C@@H](N)[C@@H](F)C1 CHEMBL3960459 IC50 1.2 nM
Cc1c(Nc2c(C#N)cncc2-c2coc(CN3CCC(N(C)C)CC3)c2)ccc2[nH]ccc12 CHEMBL567103 IC50 1.3 nM
Cc1c(Nc2c(C#N)cncc2-c2cc3cc(CN4CCCCC4)ccc3o2)ccc2[nH]ccc12 CHEMBL569108 IC50 1.3 nM
Cc1c(Nc2c(C#N)cncc2/C=C/CCN2CC[C@H](N)C2)ccc2[nH]ccc12 CHEMBL606148 IC50 1.3 nM
Cc1c(Nc2c(C#N)cncc2/C=C/c2ccc(CN3CCC(N(C)C)CC3)cc2)ccc2[nH]ccc12 CHEMBL1088056 IC50 1.3 nM
Nc1ncc(-c2ncccc2OC(F)(F)F)nc1C(=O)Nc1ncccc1N1CCC(N)CC1 CHEMBL3915489 IC50 1.3 nM
COCC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3ncccc3C(F)(F)F)cnc2N)CC1 CHEMBL3961086 IC50 1.3 nM
Nc1ncc(-c2ncccc2C(F)(F)F)nc1C(=O)Nc1ncccc1N1CCC(N)(CCO)CC1 CHEMBL3935905 IC50 1.3 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nccc4ccc(Cl)cc34)cnc2N)CC1 CHEMBL3968031 IC50 1.3 nM
Nc1ncc(-c2nc(N3CCC3)ccc2C(F)(F)F)nc1C(=O)Nc1ncccc1N1CCC(N)CC1 CHEMBL3957149 IC50 1.3 nM
N#Cc1cnc(NCc2ccccc2OC(F)(F)F)nc1NC[C@]12C[C@@H]3C[C@H](C1)[C@@H](N)[C@@H](C3)C2 CHEMBL4283768 IC50 1.3 nM
CC1(C)[C@@H](O)C[C@H]1Nc1nc(NCc2cncnc2OCC(F)F)ncc1C#N CHEMBL4849510 IC50 1.3 nM
CCCCCCn1cc2c3c(cccc31)N(C)[C@@H](C(C)C)C(=O)N[C@H](CO)C2 CHEMBL399981 Ki 1.4 nM
Cc1c(Nc2c(C#N)cncc2-c2cc3cc(CNC4CCCCC4)ccc3o2)ccc2[nH]ccc12 CHEMBL569590 IC50 1.4 nM
Cc1c(Nc2c(C#N)cncc2/C=C/c2cccc(CN3CCN(C)CC3)c2)ccc2[nH]ccc12 CHEMBL1085671 IC50 1.4 nM
N#Cc1cnc(NCc2ccccc2Cl)nc1NCC12CC3CC(C1)C(NC[C@H]1CC[C@H](O)CC1)C(C3)C2 CHEMBL4464921 IC50 1.4 nM
CC1(C)[C@@H](C(N)=O)C[C@H]1Nc1cc(NCc2cnccc2C(F)(F)F)ncc1C#N CHEMBL4853353 IC50 1.4 nM
CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)NC4 CHEMBL388978 IC50 1.44 nM
Cc1c(Nc2c(C#N)cncc2-c2cc3cc(CNCC(O)CO)ccc3o2)ccc2[nH]ccc12 CHEMBL585753 IC50 1.5 nM
Cc1c(Nc2c(C#N)cncc2/C=C/c2cccc(CN3CCC(N(C)C)CC3)c2)ccc2[nH]ccc12 CHEMBL1095368 IC50 1.5 nM
Cc1c(Nc2c(C#N)cncc2/C=C/c2cccc(CN3CCN(CCO)CC3)c2)ccc2[nH]ccc12 CHEMBL1095682 IC50 1.5 nM
Cc1c(Nc2c(C#N)cncc2/C=C/c2cccc(CN3CCOCC3)n2)ccc2[nH]ccc12 CHEMBL1093081 IC50 1.5 nM
COc1cc(Nc2ncc(F)c(NC3CC(C)(C)N(C)C(C)(C)C3)n2)cc(-n2nnnc2C)c1 CHEMBL3586034 IC50 1.5 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nccc4ccc(F)cc34)cnc2N)CC1 CHEMBL3896330 IC50 1.5 nM
Nc1ncc(-c2ncccc2F)nc1C(=O)Nc1ncccc1N1CCC(N)CC1 CHEMBL3950697 IC50 1.5 nM
Nc1ncc(-c2cccc(N3CCOCC3)n2)nc1C(=O)Nc1ncccc1N1CCC(N)CC1 CHEMBL3976541 IC50 1.5 nM
Nc1ncc(-c2cccc(N3CCOCC3)c2)nc1C(=O)Nc1ncccc1N1CCC(N)CC1 CHEMBL3932204 IC50 1.5 nM
COc1ccc(-c2cnc(N)c(C(=O)Nc3cnccc3N3CCC(N)CC3)n2)cc1 CHEMBL3942619 IC50 1.5 nM
CN(C)CC1CCn2cc(c3ccccc32)C2=C(C(=O)NC2=O)c2cn(c3ccccc23)CCO1 CHEMBL360847 pKi 1.585 nM
Cc1c(Nc2c(C#N)cnc3sc(/C=C/C(=O)N(C)C)cc23)ccc2[nH]ccc12 CHEMBL513913 IC50 1.6 nM
Cc1c(Nc2c(C#N)cncc2-c2cc3cc(CNCCO)ccc3o2)ccc2[nH]ccc12 CHEMBL571785 IC50 1.6 nM
Cn1ncc2c(-c3cnc(N)c(C(=O)Nc4ncccc4N4CCC(N)CC4)n3)ncnc21 CHEMBL3967547 IC50 1.6 nM
Cc1c(Nc2c(C#N)cncc2-c2cc3ccccc3o2)ccc2[nH]ccc12 CHEMBL570247 IC50 1.7 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nc(N4CCOCC4)nc4ccccc34)cnc2N)CC1 CHEMBL3984009 IC50 1.7 nM
Cc1c(Nc2c(C#N)cncc2/C=C/CCN2CCC[C@@H](N)C2)ccc2[nH]ccc12 CHEMBL606245 IC50 1.8 nM
Cc1nc(-c2cnc(N)c(C(=O)Nc3ncccc3N3CCC(C)(N)CC3)n2)c2cc(F)ccc2n1 CHEMBL3959314 IC50 1.8 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nccc(OC(F)(F)F)c3C#N)cnc2N)CC1 CHEMBL3919287 IC50 1.8 nM
Cc1c(Nc2c(C#N)cncc2/C=C/c2ccc(CN3CCN(C)CC3)cn2)ccc2[nH]ccc12 CHEMBL1084410 IC50 1.9 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nc(C#N)ncc3C(F)(F)F)cnc2N)CC1 CHEMBL3977690 IC50 1.9 nM
N#Cc1cnc(NCc2ccccc2OC(F)(F)F)nc1NC[C@]12C[C@@H]3C[C@H](C1)[C@@H](NCC(N)=O)[C@@H](C3)C2 CHEMBL4289064 IC50 1.9 nM
N#Cc1cnc(NCc2ccccc2OC(F)(F)F)nc1NCC12CC3CC(C1)C(NC1CCCCC1)C(C3)C2 CHEMBL4585918 IC50 1.9 nM
COc1ncccc1CNc1ncc(C#N)c(NCC23CC4CC(C2)C(NC[C@H]2CC[C@H](O)CC2)C(C4)C3)n1 CHEMBL4441229 IC50 1.9 nM
CNC1CC2OC(C)(C1OC)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)NC4 CHEMBL1980995 pKi 1.995 nM
CCn1c(-c2nonc2N)nc2c(C#CC(C)(C)O)ncc(OC[C@H]3CCCNC3)c21 CHEMBL494089 IC50 2.0 nM
CCN(CC)C(=O)/C=C/c1cc2c(Nc3ccc4[nH]ccc4c3C)c(C#N)cnc2s1 CHEMBL475918 IC50 2.0 nM
CC(C)C[C@H]1CN(c2ccc(Cl)c(C(=O)c3cccnc3N)n2)CCN1 CHEMBL2046644 Ki 2.0 nM
CC(C)C[C@H]1CN(c2cccc(-c3n[nH]c4ncccc34)n2)CCN1 CHEMBL2326019 Ki 2.0 nM
C[C@@H]1C(=O)NN=C2COc3cc(-c4c(F)cccc4F)c([C@@H]4CCN(C)C[C@@H]4C)cc3N21 CHEMBL3355134 IC50 2.0 nM
Cc1ccc(-c2cc3c(cc2[C@@H]2CCN(C)C[C@@H]2C)N2C(=NNC(=O)[C@H]2C)CO3)c(F)c1 CHEMBL3355137 IC50 2.0 nM
COc1ccc(-c2cc3c(cc2[C@@H]2CCN(C)C[C@@H]2C)N2C(=NNC(=O)[C@H]2C)CO3)c(F)c1 CHEMBL3355138 IC50 2.0 nM
Nc1ncc(-c2ncccc2C(F)(F)F)nc1C(=O)Nc1ncccc1N1CCC(N)(CO)CC1 CHEMBL3968672 IC50 2.0 nM
CC1CN(c2ccc(C(F)(F)F)c(-c3cnc(N)c(C(=O)Nc4ncccc4N4CCC(C)(N)CC4)n3)n2)CCO1 CHEMBL3939304 IC50 2.0 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nc(NCCO)ccc3C(F)(F)F)cnc2N)CC1 CHEMBL3922907 IC50 2.0 nM
NCC1(c2cccc(-c3ccnc4[nH]nc(C(F)(F)F)c34)c2)CCC1 CHEMBL4589844 Ki 2.0 nM
Cc1c(Nc2c(C#N)cncc2/C=C/c2cccc(CN3CCC(O)CC3)n2)ccc2[nH]ccc12 CHEMBL1088738 IC50 2.1 nM
CN1CCN(c2cc3ccccc3c(C3=C(c4c[nH]c5ccccc45)C(=O)NC3=O)n2)CC1 CHEMBL2153748 IC50 2.1 nM
Cc1nnnn1-c1cccc(Nc2ncc(F)c(NC[C@@H]3CCCN(C)C3)n2)c1 CHEMBL3586043 IC50 2.1 nM
Nc1ncc(-c2ncccc2OC(F)(F)F)nc1C(=O)Nc1ncccc1N1CCC(N)(CO)CC1 CHEMBL3901073 IC50 2.1 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nc(C4CC4)ccc3C(F)(F)F)cnc2N)CC1 CHEMBL3908251 IC50 2.1 nM
CCC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3ncccc3OC(F)(F)F)cnc2N)CC1 CHEMBL3905583 IC50 2.1 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nc(C4=CCOCC4)ncc3C(F)(F)F)cnc2N)CC1 CHEMBL3958761 IC50 2.1 nM
Cc1c(Nc2c(C#N)cncc2/C=C/CCN2CCN(C)CC2)ccc2[nH]ccc12 CHEMBL595521 IC50 2.2 nM
Nc1ncc(-c2ncccc2OC(F)(F)F)nc1C(=O)Nc1ncccc1N1CCC(N)C(F)C1 CHEMBL3946659 IC50 2.2 nM
Nc1ncc(-c2ccnc(N3CCOCC3)n2)nc1C(=O)Nc1ncccc1N1CCC(N)CC1 CHEMBL3975977 IC50 2.2 nM
CC(C)(F)c1ncncc1CNc1ncc(C#N)c(N[C@@H]2C[C@H](O)C2(C)C)n1 CHEMBL4854104 IC50 2.2 nM
Cc1c(Nc2c(C#N)cncc2-c2cc3cc(CNCCCO)ccc3o2)ccc2[nH]ccc12 CHEMBL583903 IC50 2.3 nM
Cc1c(Nc2c(C#N)cncc2-c2cc3cc(CN4CCN(CCN(C)C)CC4)ccc3o2)ccc2[nH]ccc12 CHEMBL569822 IC50 2.4 nM
Cc1c(Nc2c(C#N)cncc2-c2coc(CN3CCN(C(C)C)CC3)c2)ccc2[nH]ccc12 CHEMBL568371 IC50 2.4 nM
Cc1ncc(C#N)c(Nc2ccc3[nH]ccc3c2C)c1/C=C/c1cccc(S(=O)(=O)N2CCCC2)c1 CHEMBL1080103 IC50 2.4 nM
CN(C)C[C@@H]1CCn2cc(c3ccccc32)C2=C(C(=O)NC2=O)c2cn(c3ccccc23)CCO1 CHEMBL91829 Kd 2.5 nM
Cc1c(Nc2c(C#N)cncc2-c2cc3cc(CN4CCCCC4)ccc3s2)ccc2[nH]ccc12 CHEMBL570047 IC50 2.5 nM
COCc1ccnc(-c2cnc(N)c(C(=O)Nc3ncccc3N3CCC(C)(N)CC3)n2)c1C(F)(F)F CHEMBL3949255 IC50 2.6 nM
Nc1ncc(-c2nc(C(F)(F)F)ccc2C(F)(F)F)nc1C(=O)Nc1ncccc1N1CCC(N)CC1 CHEMBL3909775 IC50 2.7 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3cc(N4CCOCC4)ccc3C(F)(F)F)cnc2N)CC1 CHEMBL3970893 IC50 2.7 nM
N#Cc1cnc(NCc2ccccc2C2CC2)nc1NC[C@]12C[C@@H]3C[C@H](C1)[C@@H](N)[C@@H](C3)C2 CHEMBL4294341 IC50 2.7 nM
Cc1c(Nc2c(C#N)cncc2/C=C/CCCN2CCNCC2)ccc2[nH]ccc12 CHEMBL593162 IC50 2.8 nM
Cc1c(Nc2c(C#N)cncc2/C=C/c2ccc(CN3CCC(N(C)C)CC3)cn2)ccc2[nH]ccc12 CHEMBL1097696 IC50 2.8 nM
Nc1ncc(-c2ncccc2C(F)(F)F)nc1C(=O)Nc1ncccc1N1CCC(N)CC1 CHEMBL3890986 IC50 2.8 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3ncccc3OC(F)(F)F)cnc2N)CC1 CHEMBL3954062 IC50 2.8 nM
Cc1c(Nc2c(C#N)cncc2-c2cc3cc(CN4CCCC4)ccc3o2)ccc2[nH]ccc12 CHEMBL569796 IC50 2.9 nM
Cc1c(Nc2c(C#N)cncc2/C=C/c2cccc(CN3CCC(O)CC3)c2)ccc2[nH]ccc12 CHEMBL1095369 IC50 2.9 nM
C[C@@H]1CC(C)(C)[C@@]23C[C@@H](C[C@@H](CCCCc4cccc(O)c4)O2)OC(=O)C[C@H](CO)OC(=O)C[C@@H]1O3 CHEMBL2148107 Ki 2.9 nM
Cc1cccc2nc(N3CCN(C)CC3)nc(C3=C(c4c[nH]c5ccccc45)C(=O)NC3=O)c12 CHEMBL2153749 IC50 2.9 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nc(N4CCOCC4)ccc3C(F)(F)F)cnc2N)CC1 CHEMBL3968875 IC50 2.9 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3ncnc4ccc(F)cc34)cnc2N)CC1 CHEMBL3916984 IC50 2.9 nM
Nc1ncc(-c2ncnc3[nH]cc(F)c23)nc1C(=O)Nc1ncccc1N1CCC(N)CC1 CHEMBL3904204 IC50 2.9 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nccc(CO)c3C(F)(F)F)cnc2N)CC1 CHEMBL3926882 IC50 2.9 nM
NCC1CCCC(CNc2nc(NCc3ccccc3Cl)ncc2[N+](=O)[O-])C1 CHEMBL246365 IC50 3.0 nM
Cc1c(Nc2c(C#N)cncc2-c2cccc(CN3CCN(C)CC3)c2)ccc2[nH]ccc12 CHEMBL585307 IC50 3.0 nM
Cc1c(Nc2c(C#N)cncc2/C=C/c2cccc(S(=O)(=O)N3CCCCC3)c2)ccc2[nH]ccc12 CHEMBL1081359 IC50 3.0 nM
CC(C)C[C@H]1CN(c2cccc(C(=O)c3cccnc3N)n2)CCN1 CHEMBL2046640 Ki 3.0 nM
CC(C)C[C@H]1CN(c2ccc(C(F)(F)F)c(C(=O)c3cccnc3N)n2)CCN1 CHEMBL2046643 Ki 3.0 nM
C[C@@H]1C(=O)NN=C2COc3cc(-c4ccccc4F)c([C@@H]4CCN(C)C[C@@H]4C)cc3N21 CHEMBL3355127 IC50 3.0 nM
C[C@@H]1C(=O)NN=C2COc3cc(-c4ccccc4F)c(C4CCN(C)CC4(C)C)cc3N21 CHEMBL3355125 IC50 3.0 nM
C[C@@H]1C(=O)NN=C2COc3cc(-c4ccccc4F)c([C@@H](C)C4(C)CN(C)C4)cc3N21 CHEMBL3355119 IC50 3.0 nM
CN1CCC[C@@H](CNc2nc(Nc3cccc(-n4cc(Cl)cn4)c3)ncc2F)C1 CHEMBL3586048 IC50 3.0 nM
CC(C)(C#N)c1cccc(-c2ccnc3[nH]ccc23)n1 CHEMBL4453941 Ki 3.0 nM
CCC(C)(CN)c1cccc(-c2ccnc3[nH]ncc23)c1 CHEMBL4461370 Ki 3.0 nM
Cc1cc(-c2ccnc3[nH]nc(C(F)(F)F)c23)cc(C2(CN)CCC2)c1 CHEMBL4590477 Ki 3.0 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nc(N4CCOCC4)ncc3C(F)(F)F)cnc2N)CC1 CHEMBL3893839 IC50 3.1 nM
Nc1ncc(-c2cc3ccccc3c(N3CCOCC3)n2)nc1C(=O)Nc1ncccc1N1CCC(N)(CO)CC1 CHEMBL3912038 IC50 3.1 nM
N#Cc1cnc(NCc2ccccc2OC(F)(F)F)nc1NC[C@]12C[C@@H]3C[C@H](C1)[C@@H](NCC(=O)O)[C@@H](C3)C2 CHEMBL4281174 IC50 3.1 nM
NC(COc1cncc(-c2ccc3cnccc3c2)c1)Cc1c[nH]c2ccccc12 CHEMBL1981133 pKi 3.162 nM
COCCNCc1ccc(/C=C/c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)nc1 CHEMBL1090055 IC50 3.2 nM
CN(C)CCOc1cc(C2=C(c3c[nH]c4ccccc34)C(=O)NC2=O)c2ccccc2c1 CHEMBL565632 IC50 3.3 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nccc(C#N)c3F)cnc2N)CC1 CHEMBL3943631 IC50 3.4 nM
Cc1c(Nc2c(C#N)cnc3sc(/C=C/C(=O)N4CCCC4)c(C)c23)ccc2[nH]ccc12 CHEMBL479057 IC50 3.5 nM
Cc1c(Nc2c(C#N)cncc2-c2coc(CN3CCN(C4CCCC4)CC3)c2)ccc2[nH]ccc12 CHEMBL568581 IC50 3.5 nM
Cc1c(Nc2c(C#N)cncc2/C=C/CCN2CC[C@@H](N)C2)ccc2[nH]ccc12 CHEMBL595733 IC50 3.5 nM
Cc1c(Nc2c(C#N)cncc2/C=C/c2ccc(OCCN3CCN(C)CC3)cc2)ccc2[nH]ccc12 CHEMBL568457 IC50 3.6 nM
Cc1c(Nc2c(C#N)cncc2/C=C/CCN2CCCNCC2)ccc2[nH]ccc12 CHEMBL606133 IC50 3.6 nM
Cc1c(Nc2c(C#N)cncc2/C=C/CN2CCC(N)CC2)ccc2[nH]ccc12 CHEMBL593163 IC50 3.6 nM
Cc1c(Nc2c(C#N)cncc2/C=C/c2ccc(CN3CCN(C)CC3)cc2)ccc2[nH]ccc12 CHEMBL1082226 IC50 3.6 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3ncccc3F)cnc2N)CC1 CHEMBL3896642 IC50 3.6 nM
Nc1ncc(-c2nc(N3CCOCC3)ccc2C(F)(F)F)nc1C(=O)Nc1ncccc1N1C[C@H]2CC[C@@H](C1)[C@@H]2N CHEMBL3928145 IC50 3.6 nM
Nc1ncc(-c2ncccc2C(F)(F)F)nc1C(=O)Nc1ncccc1N1CCC(N)(COC(F)F)CC1 CHEMBL3971305 IC50 3.6 nM
N#Cc1cccnc1-c1cnc(N)c(C(=O)Nc2ncccc2N2CCC(N)(CO)CC2)n1 CHEMBL3928682 IC50 3.6 nM
Cc1c(Nc2c(C#N)cnc3sc(/C=C/C(=O)N4CCCC4)cc23)ccc2[nH]ccc12 CHEMBL477817 IC50 3.8 nM
CC(C)n1cc(C2=C(c3nc(N4CCN(C)CC4)nc4ccccc34)C(=O)NC2=O)c2ccccc21 CHEMBL2151413 IC50 3.8 nM
CN(C)c1ccc(C(F)(F)F)c(-c2cnc(N)c(C(=O)Nc3ncccc3N3CCC(C)(N)CC3)n2)n1 CHEMBL3919379 IC50 3.8 nM
C[C@H]1COCCN1c1ccc(C(F)(F)F)c(-c2cnc(N)c(C(=O)Nc3ncccc3N3CCC(C)(N)CC3)n2)n1 CHEMBL3893246 IC50 3.8 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nc(C#N)ccc3F)cnc2N)CC1 CHEMBL3918138 IC50 3.9 nM
C[C@H](CO)Nc1ccc(C(F)(F)F)c(-c2cnc(N)c(C(=O)Nc3ncccc3N3CCC(C)(N)CC3)n2)n1 CHEMBL4109540 IC50 3.9 nM
N#Cc1cnc(Nc2cccc(Br)c2)nc1NC[C@]12C[C@@H]3C[C@H](C1)[C@@H](N)[C@@H](C3)C2 CHEMBL4287302 IC50 3.9 nM
NC(COc1cncc(-c2ccc3c(c2)C(=Cc2ccc[nH]2)C(=O)N3)c1)Cc1ccccc1 CHEMBL1980407 pKi 3.981 nM
Cc1c(Nc2c(C#N)cncc2/C=C/CCN2CCNCC2)ccc2[nH]ccc12 CHEMBL603418 IC50 4.0 nM
Cc1c(Nc2c(C#N)cncc2/C=C/c2ccc(CN3CCOCC3)cc2)ccc2[nH]ccc12 CHEMBL1088054 IC50 4.0 nM
CC1(C)CC[C@@H]2CC(=O)O[C@@H](CO)CC(=O)O[C@@H]3C[C@@H](CCCCc4cccc(O)c4)O[C@@]1(C3)O2 CHEMBL1258348 Ki 4.0 nM
CC(C)[C@H]1CN(c2cccc(C(=O)c3cccnc3N)n2)CCN1 CHEMBL2046637 Ki 4.0 nM
CC(C)C[C@H]1CN(c2ccc(F)c(-c3n[nH]c4ncccc34)n2)CCN1 CHEMBL2326003 Ki 4.0 nM
C[C@@H]1C(=O)NN=C2COc3cc(-c4ccccc4F)c([C@@H]4CCNC[C@@H]4C)cc3N21 CHEMBL3355123 IC50 4.0 nM
C[C@@H]1C(=O)NN=C2COc3cc(-c4ccccc4F)c(N(C)C4(C)CN(C)C4)cc3N21 CHEMBL3355118 IC50 4.0 nM
C[C@@H]1C(=O)NN=C2COc3cc(-c4ccccc4)c(N(C)C4(C)CN(C)C4)cc3N21 CHEMBL3355117 IC50 4.0 nM
COc1cc(Nc2ncc(F)c(NCC3CC(C)(C)N(C)C(C)(C)C3)n2)cc(-n2nnnc2C)c1 CHEMBL3586035 IC50 4.0 nM
Nc1ncc(-c2ncccc2F)nc1C(=O)Nc1ncccc1N1CCC(N)(CCO)CC1 CHEMBL3933423 IC50 4.0 nM
CC1(C)CC(Nc2cc(NCc3cnccc3C(F)(F)F)ncc2C#N)CC(C)(C)N1 CHEMBL4854326 IC50 4.0 nM
CC1(C)[C@@H](O)C[C@H]1Nc1nc(NCc2cnccc2C(F)(F)F)ncc1C#N CHEMBL4859091 IC50 4.0 nM
Cc1c(Nc2c(C#N)cncc2/C=C/c2ccc(CN3CCCCC3)cc2)ccc2[nH]ccc12 CHEMBL1088055 IC50 4.1 nM
COc1ccnc(-c2cnc(N)c(C(=O)Nc3ncccc3N3CCC(N)(CC#N)CC3)n2)c1C#N CHEMBL3928668 IC50 4.1 nM
COCCNCc1cccc(/C=C/c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)n1 CHEMBL1091482 IC50 4.2 nM
Cc1c(Nc2c(C#N)cncc2/C=C/c2cccc(CN3CCCCC3)n2)ccc2[nH]ccc12 CHEMBL1093082 IC50 4.3 nM
Cc1ncc(C#N)c(Nc2ccc3[nH]ccc3c2C)c1/C=C/c1ccc(CS(=O)(=O)N2CCN(C)CC2)cc1 CHEMBL1079426 IC50 4.3 nM
CC1(C)NC(=O)c2ccc(-n3c(=O)[nH]c4ncccc43)cc2N1CC1CCCC1 CHEMBL3800310 IC50 4.3 nM
Cc1ncc(C#N)c(Nc2ccc3[nH]ccc3c2C)c1/C=C/c1cccc(CS(=O)(=O)N2CCN(C)CC2)c1 CHEMBL1079427 IC50 4.4 nM
Cc1c(Nc2c(C#N)cncc2-c2ccc(OCCN3CCCC3)cc2)ccc2[nH]ccc12 CHEMBL494412 IC50 4.5 nM
C#Cc1cccc(-c2ccc(CN3CCN(C)CC3)o2)c1Cc1ccc2c(c1C)C=CC2 CHEMBL570865 IC50 4.5 nM
Cc1ccnc(-c2cnc(N)c(C(=O)Nc3ncccc3N3CCC(C)(N)CC3)n2)c1F CHEMBL3935812 IC50 4.6 nM
N#Cc1cnc(Nc2cccc(Br)c2)nc1NC[C@H]1CC[C@H](N)CC1 CHEMBL4294119 IC50 4.6 nM
Cc1c(Nc2c(C#N)cncc2/C=C/c2cccc(OCCN3CCN(C)CC3)c2)ccc2[nH]ccc12 CHEMBL567124 IC50 4.7 nM
Cc1c(Nc2c(C#N)cncc2/C=C/c2cccc(OCCN3CCCC3)c2)ccc2[nH]ccc12 CHEMBL565353 IC50 4.7 nM
Cc1c(Nc2c(C#N)cncc2/C=C/c2ccc(CN3CCN(CCO)CC3)cc2)ccc2[nH]ccc12 CHEMBL1083522 IC50 4.7 nM
COc1ccnc(-c2cnc(N)c(C(=O)Nc3ncccc3N3CCC(C)(N)CC3)n2)c1C#N CHEMBL3933598 IC50 4.7 nM
CN1CCN(c2cc(C3=C(c4c[nH]c5ccccc45)C(=O)NC3=O)c3ccccc3c2)CC1 CHEMBL568580 IC50 4.8 nM
Cc1ncc(C#N)c(Nc2ccc3[nH]ccc3c2C)c1/C=C/c1cccc(S(=O)(=O)N2CCCCC2)c1 CHEMBL1079566 IC50 4.8 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nc(N4C5CCC4COC5)ccc3C(F)(F)F)cnc2N)CC1 CHEMBL3915095 IC50 4.8 nM
C#Cc1cccc(-c2csc(CN3CCN(C)CC3)c2)c1Cc1ccc2c(c1C)C=CC2 CHEMBL567082 IC50 4.9 nM
Cc1c(Nc2c(C#N)cncc2/C=C/CCN2CCC(N(C)C)CC2)ccc2[nH]ccc12 CHEMBL596397 IC50 4.9 nM
Cc1c(Nc2c(C#N)cncc2/C=C/c2cccc(CN3CCCCC3)c2)ccc2[nH]ccc12 CHEMBL1086420 IC50 4.9 nM
COCCNCc1cccc(/C=C/c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)c1 CHEMBL1099371 IC50 4.9 nM
NCC1CCC(CNc2nc(NCc3ccccc3Br)ncc2[N+](=O)[O-])CC1 CHEMBL246175 IC50 5.0 nM
CSc1ccccc1CNc1ncc([N+](=O)[O-])c(NCC2CCC(CN)CC2)n1 CHEMBL392642 IC50 5.0 nM
Cc1c(Nc2c(C#N)cncc2-c2ccc(CN3CCN(C)CC3)cc2)ccc2[nH]ccc12 CHEMBL567299 IC50 5.0 nM
CC(C)C[C@H]1CN(c2ccc(F)c(-c3n[nH]c4ncccc34)n2)C[C@@H](C)N1 CHEMBL2326004 Ki 5.0 nM
c1ccc([C@@H]2CN(c3cccc(-c4n[nH]c5ncccc45)n3)CCN2)cc1 CHEMBL2326020 Ki 5.0 nM
CC(C)C[C@@H]1CN(c2cccc(-c3n[nH]c4ncccc34)n2)CCN1 CHEMBL2326018 Ki 5.0 nM
CCN1CC[C@@H](c2cc3c(cc2-c2ccccc2F)OCC2=NNC(=O)[C@@H](C)N23)[C@@H](C)C1 CHEMBL3355126 IC50 5.0 nM
C[C@@H]1C(=O)NN=C2COc3cc(-c4ccc5c(c4)OCCO5)c([C@@H]4CCN(C)C[C@@H]4C)cc3N21 CHEMBL3355136 IC50 5.0 nM
CCC(C)(CN)c1cc(C)cc(-c2ccnc3[nH]ncc23)c1 CHEMBL4522851 Ki 5.0 nM
Cc1ccc2nc(N3CCN(C)CC3)nc(C3=C(c4c[nH]c5ccccc45)C(=O)NC3=O)c2c1 CHEMBL2153752 IC50 5.1 nM
Cc1c(Nc2c(C#N)cncc2/C=C/CCCN2CCC(N)CC2)ccc2[nH]ccc12 CHEMBL605318 IC50 5.2 nM
COCCNCc1ccc(/C=C/c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)cc1 CHEMBL1086178 IC50 5.2 nM
COc1cc(Nc2ncc(F)c(NC[C@H]3CCCN(C)C3)n2)cc(-n2nnnc2C)c1 CHEMBL3586037 IC50 5.2 nM
N#Cc1cnc(NCc2ccccc2C(F)(F)F)nc1NC[C@]12C[C@@H]3C[C@H](C1)[C@@H](N)[C@@H](C3)C2 CHEMBL4287122 IC50 5.2 nM
COc1ccc(-c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2F)cc1OC CHEMBL466036 IC50 5.3 nM
Cc1c(Nc2c(C#N)cncc2-c2cc3cc(CN4CCNCC4)ccc3o2)ccc2[nH]ccc12 CHEMBL583906 IC50 5.3 nM
CCOc1ccnc(-c2cnc(N)c(C(=O)Nc3ncccc3N3CCC(C)(N)CC3)n2)c1F CHEMBL3912781 IC50 5.3 nM
Cc1c(Nc2c(C#N)cncc2/C=C/c2ccc(S(N)(=O)=O)cc2)ccc2[nH]ccc12 CHEMBL1080801 IC50 5.4 nM
CCOc1ccccc1CNc1ncc(C#N)c(NC[C@]23C[C@@H]4C[C@H](C2)[C@@H](N)[C@@H](C4)C3)n1 CHEMBL4279198 IC50 5.4 nM
N#Cc1cnc(NCc2ccccc2Cl)nc1NC[C@]12C[C@@H]3C[C@H](C1)[C@@H](N)[C@@H](C3)C2 CHEMBL4286045 IC50 5.4 nM
Cc1c(Nc2c(C#N)cncc2/C=C/c2ccc(CN3CCC(O)CC3)cc2)ccc2[nH]ccc12 CHEMBL1087425 IC50 5.5 nM
COc1ccc(-c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)cc1 CHEMBL466654 IC50 5.6 nM
Cc1c(Nc2c(C#N)cncc2/C=C/CCN2CCC(CN)CC2)ccc2[nH]ccc12 CHEMBL596398 IC50 5.7 nM
CN1CCN(c2nc(C3=C(c4cn(C)c5ccccc45)C(=O)NC3=O)c3ccccc3n2)CC1 CHEMBL2151412 IC50 5.8 nM
Cc1c(Nc2c(C#N)cncc2-c2ccc(OCCNCCN(C)C)cc2)ccc2[nH]ccc12 CHEMBL494166 IC50 5.9 nM
N#Cc1cnc(NCc2ccccc2Br)nc1NC[C@]12C[C@@H]3C[C@H](C1)[C@@H](N)[C@@H](C3)C2 CHEMBL4281351 IC50 5.9 nM
NCC1CCC(CNc2nc(NCc3ccccc3SC(F)(F)F)ncc2[N+](=O)[O-])CC1 CHEMBL246174 IC50 6.0 nM
Cc1c(Nc2c(C#N)cncc2/C=C/CCN2CCC(O)CC2)ccc2[nH]ccc12 CHEMBL593890 IC50 6.0 nM
Cc1c(Nc2c(C#N)cncc2/C=C/c2cccc(S(=O)(=O)N3CCCC3)c2)ccc2[nH]ccc12 CHEMBL1081358 IC50 6.0 nM
Cc1c(Nc2c(C#N)cncc2/C=C/c2ccc(S(=O)(=O)N3CCCC3)cc2)ccc2[nH]ccc12 CHEMBL1079611 IC50 6.0 nM
Nc1ncccc1C(=O)c1cccc(N2CCN[C@@H](c3ccccc3)C2)n1 CHEMBL2046642 Ki 6.0 nM
Nc1ncc(-c2nc(N3CCOCC3)ccc2C(F)(F)F)nc1C(=O)Nc1ncccc1N1C[C@@H]2CO[C@H](C1)[C@H]2N CHEMBL4115475 IC50 6.0 nM
Nc1ncc(-c2ccccc2F)nc1C(=O)Nc1cnccc1N1CCNCC1 CHEMBL3957649 IC50 6.0 nM
FC(F)(F)c1ccc(CNc2ccc(Cc3c[nH]c4ncc(Cl)cc34)cn2)cn1 CHEMBL3813873 Kd apparent 6.0 nM
NCC1(c2cccc(-c3ccnc4[nH]nc(C(F)(F)F)c34)c2)COC1 CHEMBL4461649 Ki 6.0 nM
CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)NC4=O CHEMBL4763675 IC50 6.0 nM
CC1(C)C[C@H](Nc2nc(NCc3cnccc3C(F)(F)F)ncc2C#N)CC[C@@H]1O CHEMBL4851695 IC50 6.0 nM
Cc1c(Nc2c(C#N)cncc2-c2cc3cc(CN4CC[N+](C)([O-])CC4)ccc3o2)ccc2[nH]ccc12 CHEMBL570924 IC50 6.1 nM
Cc1c(Nc2c(C#N)cncc2-c2ccc(CN3CCN(C)CC3)s2)ccc2[nH]ccc12 CHEMBL567300 IC50 6.1 nM
Cc1c(Nc2c(C#N)cncc2/C=C/c2ccc(CN3CCN(CCO)CC3)cn2)ccc2[nH]ccc12 CHEMBL1089724 IC50 6.2 nM
Cc1c(Nc2c(C#N)cncc2/C=C/c2cccc(CS(=O)(=O)N3CCN(C)CC3)c2)ccc2[nH]ccc12 CHEMBL1081921 IC50 6.2 nM
COc1ccc(-c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)cc1OC CHEMBL494595 IC50 6.3 nM
N#Cc1ccc(N2CCNCC2c2ccccc2)nc1-n1c(=O)[nH]c2ncccc21 CHEMBL4100381 IC50 6.3 nM
Cc1c(Nc2c(C#N)cncc2-c2cc3cc(CN(C)C)ccc3o2)ccc2[nH]ccc12 CHEMBL571784 IC50 6.4 nM
Cc1c(Nc2c(C#N)cncc2/C=C/CCCN2CCN(C)CC2)ccc2[nH]ccc12 CHEMBL603217 IC50 6.4 nM
Cc1ccccc1CNc1ncc(C#N)c(NC[C@]23C[C@@H]4C[C@H](C2)[C@@H](N)[C@@H](C4)C3)n1 CHEMBL4290543 IC50 6.4 nM
CCCCCCCC(=O)O[C@H]1/C(=C/C(=O)OC)CC2C[C@H]([C@@H](C)O)OC(=O)C[C@H](O)C[C@@H]3CCC[C@H](C[C@@H]4CCO[C@H](/C=C/C(C)(C)[C@]1(O)O2)O4)O3 CHEMBL46252 Ki 6.6 nM
COc1cnc(-c2cnc(N)c(C(=O)Nc3ncccc3N3CCC(C)(N)CC3)n2)c(C(F)(F)F)c1 CHEMBL3928191 IC50 6.6 nM
CN(C)CCCn1cc(C2=C(c3c[nH]c4ccccc34)C(=O)NC2=O)c2ccccc21 CHEMBL7463 IC50 6.7 nM
CN1CCCOc2ccnc3[nH]c(=O)n(c23)-c2nc1ccc2Cl CHEMBL4093591 IC50 6.7 nM
Cc1c(Nc2c(C#N)cncc2/C=C/CCN2CCC[C@H](N)C2)ccc2[nH]ccc12 CHEMBL595955 IC50 6.8 nM
Cc1c(Nc2c(C#N)cncc2-c2cccc(CN(C)C)c2)ccc2[nH]ccc12 CHEMBL567930 IC50 6.9 nM
NCC1CCC(CNc2nc(NCc3cc(Cl)ccc3Cl)ncc2[N+](=O)[O-])CC1 CHEMBL246386 IC50 7.0 nM
COc1cccc(/C=C/c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)c1 CHEMBL567363 IC50 7.0 nM
CC(C)C[C@H]1CN(c2ccc(OC(F)F)c(C(=O)c3cccnc3N)n2)CCN1 CHEMBL2046646 Ki 7.0 nM
CN1CCN(c2nc(C3=C(c4c[nH]c5c(Cl)cccc45)C(=O)NC3=O)c3ccccc3n2)CC1 CHEMBL2151410 IC50 7.0 nM
COc1cccc(-c2cc3c(cc2[C@@H]2CCN(C)C[C@@H]2C)N2C(=NNC(=O)[C@H]2C)CO3)c1 CHEMBL3355132 IC50 7.0 nM
CCS(=O)(=O)c1cc(Nc2ncc(F)c(N(Cc3ccccc3C#N)c3cc(CO)ccc3C)n2)ccc1N1CCN(C)CC1 CHEMBL3923175 IC50 7.0 nM
N#Cc1cnc(NCc2cnccc2C(F)(F)F)cc1N[C@H]1CC[C@@H](C(N)=O)CC1 CHEMBL4870774 IC50 7.0 nM
CC1(C)C[C@H](Nc2cc(NCc3cnccc3C(F)(F)F)ncc2C#N)CC[C@@H]1O CHEMBL4861883 IC50 7.0 nM
Cc1c(Nc2c(C#N)cncc2-c2ccc(OCCN3CCN(C)CC3)cc2)ccc2[nH]ccc12 CHEMBL467069 IC50 7.4 nM
Cc1c(Nc2c(C#N)cncc2/C=C/CCN2CC[C@@H](O)C2)ccc2[nH]ccc12 CHEMBL595724 IC50 7.4 nM
Nc1ncc(-c2ncnc3sccc23)nc1C(=O)Nc1ncccc1N1CCC(N)CC1 CHEMBL3924825 IC50 7.4 nM
Cc1c(Nc2c(C#N)cnc3sc(-c4cccc(CN(C)C)c4)cc23)ccc2[nH]ccc12 CHEMBL402818 IC50 7.5 nM
Cc1c(Nc2c(C#N)cncc2-c2ccc(CN3CCSCC3)o2)ccc2[nH]ccc12 CHEMBL585323 IC50 7.5 nM
Cc1c(Nc2c(C#N)cncc2/C=C/c2ccccc2OCCN2CCN(C)CC2)ccc2[nH]ccc12 CHEMBL567952 IC50 7.6 nM
C[C@@H]1COCCN1c1ccc(C(F)(F)F)c(-c2cnc(N)c(C(=O)Nc3ncccc3N3CCC(C)(N)CC3)n2)n1 CHEMBL4113858 IC50 7.7 nM
Cc1c(Nc2c(C#N)cncc2-c2ccc(CN3CCOCC3)o2)ccc2[nH]ccc12 CHEMBL585858 IC50 7.8 nM
CN1CCN(c2nc(C3=C(c4c[nH]c5ccccc45)C(=O)NC3=O)c3ccc(F)cc3n2)CC1 CHEMBL2153755 IC50 7.8 nM
Cc1c(Nc2c(C#N)cncc2/C=C/c2ccc(CS(=O)(=O)N3CCN(C)CC3)cc2)ccc2[nH]ccc12 CHEMBL1081920 IC50 7.9 nM
Nc1ncc(-c2ncnc3c2CCCC3)nc1C(=O)Nc1ncccc1N1CCC(N)CC1 CHEMBL3909349 IC50 7.9 nM
CC(N)C1CCC(C(=O)Nc2ccnc3[nH]ccc23)CC1 CHEMBL2002992 pKi 7.943 nM
CN(C)C1CCC(Nc2nc(Cl)cc(-c3c[nH]c4ncccc34)n2)CC1 CHEMBL1969151 pKi 7.943 nM
NCC1CCC(CNc2nc(NCc3cccc(Cl)c3Cl)ncc2[N+](=O)[O-])CC1 CHEMBL246183 IC50 8.0 nM
Cc1ccccc1-c1cc2c(cc1[C@@H]1CCN(C)C[C@@H]1C)N1C(=NNC(=O)[C@H]1C)CO2 CHEMBL3355130 IC50 8.0 nM
Cc1cc(-c2ccnc3[nH]nc(C(F)(F)F)c23)cc(C2(CN)COC2)c1 CHEMBL4587816 Ki 8.0 nM
CC(F)(F)COc1ncncc1CNc1ncc(C#N)c(N[C@@H]2CC[C@H](O)C(C)(C)C2)n1 CHEMBL4873647 IC50 8.0 nM
CC1(C)CC[C@@H]2CC(=O)O[C@@H](CO)CC(=O)O[C@@H]3C[C@@H](CCCCc4ccccc4)O[C@@]1(C3)O2 CHEMBL1258117 Ki 8.1 nM
COc1ccccc1/C=C/c1cncc(C#N)c1Nc1ccc2[nH]ccc2c1C CHEMBL568407 IC50 8.2 nM
Cc1c(Nc2c(C#N)cncc2/C=C/c2ccccc2)ccc2[nH]ccc12 CHEMBL585192 IC50 8.3 nM
CN1CCN(c2nc(C3=C(c4c[nH]c5ccc(Cl)cc45)C(=O)NC3=O)c3ccccc3n2)CC1 CHEMBL2151408 IC50 8.3 nM
Cc1c(Nc2c(C#N)cncc2-c2ccc(CN(C)C)cc2)ccc2[nH]ccc12 CHEMBL585697 IC50 8.4 nM
COc1ccnc(-c2cnc(N)c(C(=O)Nc3ncccc3N3CCC(N)(CO)CC3)n2)c1C#N CHEMBL3925357 IC50 8.6 nM
CC(C)[C@H]1C(=O)N[C@H](CO)Cc2c[nH]c3cccc(c23)N1C CHEMBL27266 Ki 8.7 nM
COc1ccc(CN(C)C)cc1-c1cc2c(Nc3ccc4[nH]ccc4c3C)c(C#N)cnc2s1 CHEMBL516913 IC50 8.7 nM
CCN(CC)S(=O)(=O)c1ccc(/C=C/c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)cc1 CHEMBL1079903 IC50 8.7 nM
Cc1c(Nc2c(C#N)cncc2/C=C/CCN2CC(N)C2)ccc2[nH]ccc12 CHEMBL596172 IC50 8.9 nM
Cc1c(Nc2c(C#N)cncc2-c2ccc(CN3CCOCC3)cc2)ccc2[nH]ccc12 CHEMBL586046 IC50 9.0 nM
CC(C)C[C@@H]1CN(c2ccc(F)c(-c3n[nH]c4ncccc34)n2)CCN1 CHEMBL2326021 Ki 9.0 nM
NCC1(c2cccc(-c3ccnc4[nH]ncc34)c2)CCOCC1 CHEMBL4435004 Ki 9.0 nM
NCC1(c2cccc(-c3ccnc4[nH]nc(C(F)(F)F)c34)c2)CCOCC1 CHEMBL4457150 Ki 9.0 nM
Cc1c(Nc2c(C#N)cncc2/C=C/c2ccc(OCCN3CCCC3)cc2)ccc2[nH]ccc12 CHEMBL579260 IC50 9.1 nM
CCOc1ccc(CN(C)C)cc1-c1cc2c(Nc3ccc4[nH]ccc4c3C)c(C#N)cnc2s1 CHEMBL479470 IC50 9.2 nM
CNC1CCN(CC/C=C/c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)CC1 CHEMBL606146 IC50 9.3 nM
Cc1ncc(C#N)c(Nc2ccc3[nH]ccc3c2C)c1/C=C/c1ccc(S(=O)(=O)N2CCN(C)CC2)cc1 CHEMBL1079567 IC50 9.3 nM
CN1CCN(c2nc(C3=C(c4c[nH]c5cc(Cl)ccc45)C(=O)NC3=O)c3ccccc3n2)CC1 CHEMBL2151409 IC50 9.8 nM
Cc1c(Nc2c(C#N)cncc2/C=C/c2ccccc2CN2CCN(C)CC2)ccc2[nH]ccc12 CHEMBL1084409 IC50 9.9 nM
Cc1c(Nc2c(C#N)cncc2/C=C/CN2CCNCC2)ccc2[nH]ccc12 CHEMBL593619 IC50 10.0 nM
COC(C)(C(C)C)C1CN(c2ccc(F)c(-c3n[nH]c4ncccc34)n2)CCN1 CHEMBL2326011 Ki 10.0 nM
COc1ccc(-c2cc3c(cc2[C@@H]2CCN(C)C[C@@H]2C)N2C(=NNC(=O)[C@H]2C)CO3)cc1 CHEMBL3355133 IC50 10.0 nM
CN1CCC[C@@H](CNc2nc(Nc3cccc(-n4ccnn4)c3)ncc2F)C1 CHEMBL3586044 IC50 10.0 nM
COc1ccc(-c2cncc(C#N)c2Nc2cc3cc[nH]c3cc2C)cc1OC CHEMBL494165 IC50 10.5 nM
COc1ccc(-c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2OC)cc1OC CHEMBL509448 IC50 10.6 nM
NCC1CCC(CNc2nc(NCc3ccccc3[N+](=O)[O-])ncc2[N+](=O)[O-])CC1 CHEMBL396929 IC50 11.0 nM
Cc1c(Nc2c(C#N)cncc2-c2ccc(OCCN3CCC(N4CCCC4)CC3)cc2)ccc2[nH]ccc12 CHEMBL493999 IC50 11.0 nM
Cc1c(Nc2c(C#N)cncc2/C=C/CCN2CCN(S(=O)(=O)C(C)C)CC2)ccc2[nH]ccc12 CHEMBL605534 IC50 11.0 nM
Cc1c(Nc2c(C#N)cncc2/C=C/CCCN2CCC(O)CC2)ccc2[nH]ccc12 CHEMBL595989 IC50 11.0 nM
Cc1c(Nc2c(C#N)cncc2/C=C/c2ccc(S(=O)(=O)N(C)C)cc2)ccc2[nH]ccc12 CHEMBL1080802 IC50 11.0 nM
NCC1CCC(CNc2nc(NCc3ccccc3C(F)(F)F)ncc2[N+](=O)[O-])CC1 CHEMBL247979 IC50 12.0 nM
CCCCCCn1cc2c3c(cccc31)N(C)[C@@H](C(C)C)C(=O)N[C@H](CO)CC2 CHEMBL401369 Ki 12.0 nM
COc1c(CN(C)C)cccc1-c1cc2c(Nc3ccc4[nH]ccc4c3C)c(C#N)cnc2s1 CHEMBL480223 IC50 12.0 nM
Cc1c(Nc2c(C#N)cnc3sc(/C=C/C(N)=O)cc23)ccc2[nH]ccc12 CHEMBL477617 IC50 12.0 nM
Cc1c(Nc2c(C#N)cncc2-c2coc(CN3CCN(C)CC3)c2)ccc2[nH]ccc12 CHEMBL568547 IC50 12.0 nM
Cc1c(Nc2c(C#N)cncc2/C=C/CCN2CCN(S(C)(=O)=O)CC2)ccc2[nH]ccc12 CHEMBL595734 IC50 12.0 nM
CCS(=O)(=O)N1CCN(CC/C=C/c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)CC1 CHEMBL592934 IC50 12.0 nM
Cc1c(Nc2c(C#N)cncc2/C=C/c2ccc(S(=O)(=O)N3CCCCC3)cc2)ccc2[nH]ccc12 CHEMBL1079612 IC50 12.0 nM
Cc1n[nH]c2ccc(-c3cncc(OC[C@@H](N)Cc4ccccc4)c3)cc12 CHEMBL379218 Kd 12.0 nM
CC[C@@H]1CN(c2cccc(-c3n[nH]c4ncccc34)n2)CCN1 CHEMBL2326016 Ki 12.0 nM
CC1(C)NC(=O)c2ccc(-n3c(=O)[nH]c4ncccc43)cc2N1c1ccccc1 CHEMBL3798266 IC50 12.0 nM
COCC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3ncccc3OC(F)(F)F)cnc2N)CC1 CHEMBL3932525 IC50 12.0 nM
CN(C)Cc1ccc2c(C3=C(c4c[nH]c5ccccc45)C(=O)NC3=O)c(Cl)ccc2c1 CHEMBL4085837 IC50 12.0 nM
CC(C)(CN)c1cccc(-c2ccnc3[nH]ncc23)c1 CHEMBL4541215 Ki 12.0 nM
CC1(C)C[C@H](Nc2cc(NCc3cnccc3C(F)(F)F)ncc2C#N)CC(C)(C)[C@@H]1O CHEMBL4867906 IC50 12.0 nM
Cc1ccccc1-c1c(-c2ccc3[nH]nc(N)c3c2)nnn1Cc1ccccc1 CHEMBL2000029 pKi 12.59 nM
Cc1cccc(CNc2ncc([N+](=O)[O-])c(NCC3CCC(CN)CC3)n2)c1C CHEMBL245912 IC50 13.0 nM
COc1ccc(-c2cncc(C#N)c2Nc2cccc3[nH]ccc23)cc1OC CHEMBL513485 IC50 13.0 nM
Cc1c(Nc2c(C#N)cncc2-c2cc3cc(CN4CCN(c5ccccn5)CC4)ccc3o2)ccc2[nH]ccc12 CHEMBL571281 IC50 13.0 nM
N#Cc1cncc(/C=C/c2ccccc2)c1Nc1cccc2c1CC=N2 CHEMBL576232 IC50 13.0 nM
COc1ccc(/C=C/c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)cc1 CHEMBL566263 IC50 13.0 nM
Cc1c(Nc2c(C#N)cncc2/C=C/c2ccccc2OCCN2CCCC2)ccc2[nH]ccc12 CHEMBL583879 IC50 13.0 nM
Cc1c(Nc2c(C#N)cncc2-c2cc3cc(CN4CCOCC4)ccc3o2)ccc2[nH]ccc12 CHEMBL576278 IC50 13.0 nM
CCCCCCCCCCc1ccc2c(c1)C[C@@H](CO)NC(=O)[C@H](C(C)C)N2C CHEMBL28205 Ki 13.2 nM
Cc1c(Nc2c(C#N)cnc3sc(-c4ccc(CN(C)C)cc4)cc23)ccc2[nH]ccc12 CHEMBL471795 IC50 14.0 nM
Cc1c(Nc2c(C#N)cncc2-c2ccc(OCCN3CCN(CCO)CC3)cc2)ccc2[nH]ccc12 CHEMBL522344 IC50 14.0 nM
CN1CCN(CCOc2ccc(-c3cncc(C#N)c3Nc3cccc4[nH]ccc34)cc2)CC1 CHEMBL493987 IC50 14.0 nM
Cc1c(Nc2c(C#N)cncc2/C=C/c2cc(CN3CCN(C)CC3)ccn2)ccc2[nH]ccc12 CHEMBL1082544 IC50 14.0 nM
Cc1c(Nc2c(C#N)cncc2/C=C/c2ccc(CN3CCCCC3)cn2)ccc2[nH]ccc12 CHEMBL1097695 IC50 14.0 nM
C[C@@H]1C(=O)NN=C2COc3cc(-c4cccc(F)c4)c([C@@H]4CCN(C)C[C@@H]4C)cc3N21 CHEMBL3355128 IC50 14.0 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3ncccc3C(F)(F)F)cnc2N)CC1F CHEMBL3896683 IC50 14.0 nM
O=c1[nH]c2nccc3c2n1-c1nc(ccc1Cl)OCCCCO3 CHEMBL4099368 IC50 14.0 nM
N#Cc1cnc(Nc2cccc(Br)c2)nc1NC[C@H]1CC[C@H](CN)CC1 CHEMBL4286223 IC50 14.0 nM
CC(C)(C#N)c1cccc(-c2ccnc3[nH]ncc23)n1 CHEMBL4539521 Ki 14.0 nM
CCc1cc(-c2ccnc3[nH]ncc23)cc(C(C)(CC)CN)c1 CHEMBL4567363 Ki 14.0 nM
NCC1CCC(CNc2nc(NCc3ccccc3C(F)F)ncc2[N+](=O)[O-])CC1 CHEMBL245977 IC50 15.0 nM
CCNC(=O)/C=C/c1cc2c(Nc3ccc4[nH]ccc4c3C)c(C#N)cnc2s1 CHEMBL514041 IC50 15.0 nM
Cc1c(Nc2c(C#N)cncc2-c2cc3cc(CN4CCN(S(C)(=O)=O)CC4)ccc3o2)ccc2[nH]ccc12 CHEMBL568923 IC50 15.0 nM
CC(C)[C@H]1CN(c2cccc(-c3n[nH]c4ncccc34)n2)CCN1 CHEMBL2326017 Ki 15.0 nM
Nc1ncc(-c2ncccc2OC(F)(F)F)nc1C(=O)Nc1ncccc1N1CCC(N)(COC(F)F)CC1 CHEMBL3981979 IC50 15.0 nM
OC1CCC(Nc2nc(Cl)cc(-c3c[nH]c4ncccc34)n2)CC1 CHEMBL1986943 pKi 15.85 nM
COc1ccc(CN(C)C)c(-c2cc3c(Nc4ccc5[nH]ccc5c4C)c(C#N)cnc3s2)c1 CHEMBL479835 IC50 16.0 nM
Cc1c(Nc2c(C#N)cnc3sc(-c4csc(CN(C)C)c4)cc23)ccc2[nH]ccc12 CHEMBL480838 IC50 16.0 nM
Cc1c(Nc2c(C#N)cncc2/C=C/CCN2CCC(NS(C)(=O)=O)CC2)ccc2[nH]ccc12 CHEMBL595048 IC50 16.0 nM
Cc1c(Nc2c(C#N)cncc2/C=C/CCN2CCOCC2)ccc2[nH]ccc12 CHEMBL595732 IC50 16.0 nM
C[C@@H]1CN(C)CC[C@@H]1c1cc2c(cc1-c1ccccc1F)OCC1=NNC(=O)[C@@H](C)N12 CHEMBL3355124 IC50 16.0 nM
Nc1ncc(-c2csc(N3CCOCC3)n2)nc1C(=O)Nc1ncccc1N1CCC(N)CC1 CHEMBL3914252 IC50 16.0 nM
CCOc1ccnc(-c2cnc(N)c(C(=O)Nc3ncccc3N3CCC(C)(N)CC3)n2)c1C#N CHEMBL3927615 IC50 16.0 nM
COc1ccccc1CNc1ncc([N+](=O)[O-])c(NCC2CCC(CN)CC2)n1 CHEMBL395690 IC50 17.0 nM
N#Cc1cncc(-c2cccc(OCCN3CCOCC3)c2)c1Nc1cccc2[nH]ccc12 CHEMBL468139 IC50 17.0 nM
Cc1ncc(C#N)c(Nc2ccc3[nH]ccc3c2C)c1/C=C/CCN1CCNCC1 CHEMBL593892 IC50 17.0 nM
NCC1(c2cccc(-c3ccnc4[nH]ncc34)c2)CCC1 CHEMBL4566843 Ki 17.0 nM
NC[C@H]1CC[C@@H](CNc2nc(NCc3ccccc3Cl)ncc2[N+](=O)[O-])CC1 CHEMBL246159 IC50 18.0 nM
NCC1CCC(CNc2nc(NCc3ccccc3OC(F)(F)F)ncc2[N+](=O)[O-])CC1 CHEMBL248183 IC50 18.0 nM
CN1CCN(CCOc2cccc(-c3cncc(C#N)c3Nc3cccc4[nH]ccc34)c2)CC1 CHEMBL467321 IC50 18.0 nM
C[C@@H](CO)Nc1ccc(C(F)(F)F)c(-c2cnc(N)c(C(=O)Nc3ncccc3N3CCC(C)(N)CC3)n2)n1 CHEMBL3892068 IC50 18.0 nM
O=c1[nH]c2ncccc2n1-c1nc(N2CCCNCC2)ccc1Cl CHEMBL4074629 IC50 18.0 nM
CC(C)[C@H]1C(=O)N[C@H](CO)Cc2cn3ncc4ccc(c2c43)N1C CHEMBL271403 Ki 18.6 nM
Cc1c(Nc2c(C#N)cncc2-c2ccc(OCCCN3CCN(C)CC3)cc2)ccc2[nH]ccc12 CHEMBL493825 IC50 19.0 nM
Cc1c(Nc2c(C#N)cncc2/C=C/CCN2CCC(c3ccccc3)CC2)ccc2[nH]ccc12 CHEMBL596206 IC50 19.0 nM
Cc1c(Nc2c(C#N)cncc2/C=C/CCCN2CCCCC2)ccc2[nH]ccc12 CHEMBL593388 IC50 19.0 nM
C[C@@H]1C(=O)NN=C2COc3cc(-c4ccc(F)cc4)c([C@@H]4CCN(C)C[C@@H]4C)cc3N21 CHEMBL3355129 IC50 19.0 nM
COC1CN(c2cccnc2NC(=O)c2nc(-c3ncccc3OC(F)(F)F)cnc2N)CCC1N CHEMBL3965722 IC50 19.0 nM
CN(C)Cc1ccc2c(C3=C(c4cn(C)c5ccccc45)C(=O)NC3=O)c(Cl)ccc2c1 CHEMBL4064291 IC50 19.0 nM
CO[C@@H]1[C@H](N(C)CCOCCOCCOCCNC(=O)CCC2=[N+]3C(=Cc4c(C)cc(C)n4[B-]3(F)F)C=C2)C[C@H]2O[C@]1(C)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)NC4 CHEMBL4576489 Kd 19.0 nM
Cc1c(Nc2c(C#N)cncc2-c2ccc(OCCN3CCOCC3)cc2)ccc2[nH]ccc12 CHEMBL467068 IC50 20.0 nM
CCCc1ccc(N2CCN[C@@H](CC(C)C)C2)nc1C(=O)c1cccnc1N CHEMBL2046648 Ki 20.0 nM
CC(C)[C@@](C)(O)[C@@H]1CN(c2ccc(C(F)(F)F)c(-c3n[nH]c4ncccc34)n2)CCN1 CHEMBL2326013 Ki 20.0 nM
N#Cc1cnc(NCc2ccccc2C(F)(F)F)cc1N[C@H]1CC[C@@H](C(N)=O)CC1 CHEMBL4858914 IC50 20.0 nM
CC1(C)C[C@H](Nc2cc(NCc3cnccc3C(F)(F)F)ncc2C#N)CC(C)(C)[C@H]1O CHEMBL4856779 IC50 20.0 nM
Cc1ncc(C#N)c(Nc2ccc3[nH]ccc3c2C)c1/C=C/c1ccc(S(=O)(=O)N2CCCC2)cc1 CHEMBL1079745 IC50 21.0 nM
CC(C)[C@@](C)(O)[C@@H]1CN(c2ccc(Cl)c(-c3n[nH]c4ncccc34)n2)CCN1 CHEMBL2326012 Ki 21.0 nM
CC(C)[C@@](C)(O)[C@H]1CN(c2ccc(F)c(-c3n[nH]c4ncccc34)n2)CCN1 CHEMBL2326010 Ki 21.0 nM
COC1CN(c2ccc(C(F)(F)F)c(-c3cnc(N)c(C(=O)Nc4ncccc4N4CCC(C)(N)CC4)n3)n2)C1 CHEMBL3952413 IC50 21.0 nM
CNCc1ccc2ccc(Cl)c(C3=C(c4cn(C)c5ccccc45)C(=O)NC3=O)c2c1 CHEMBL4072879 IC50 21.0 nM
COCCNCc1ccc2ccc(Cl)c(C3=C(c4cn(C)c5ccccc45)C(=O)NC3=O)c2c1 CHEMBL4101316 IC50 21.0 nM
NCC1CCC(CNc2nc(NCc3cccc(F)c3F)ncc2[N+](=O)[O-])CC1 CHEMBL245783 IC50 22.0 nM
Cc1c(Nc2c(C#N)cnc3sc(/C=C/CN4CCCC4)cc23)ccc2[nH]ccc12 CHEMBL517677 IC50 22.0 nM
Cc1c(Nc2c(C#N)cncc2/C=C/CCN2CCC(NS(=O)(=O)C(C)C)CC2)ccc2[nH]ccc12 CHEMBL596173 IC50 22.0 nM
CCS(=O)(=O)NC1CCN(CC/C=C/c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)CC1 CHEMBL595752 IC50 22.0 nM
NCC1(c2cccc(-c3ccnc4[nH]ncc34)c2)CCCC1 CHEMBL4584166 Ki 22.0 nM
CN1CCC2(CC1)CN(c1ncnc3[nH]cc(-c4cccc(C#N)c4)c13)CCO2 CHEMBL3972882 Ki 22.0 nM
COc1ccccc1-c1cc2c(Nc3ccc4[nH]ccc4c3C)c(C#N)cnc2s1 CHEMBL480839 IC50 23.0 nM
Cc1c(Nc2c(C#N)cncc2-c2cccc(CN3CCOCC3)c2)ccc2[nH]ccc12 CHEMBL567730 IC50 23.0 nM
Cc1c(Nc2c(C#N)cncc2-c2cc3ccccc3s2)ccc2[nH]ccc12 CHEMBL578174 IC50 23.0 nM
Cc1c(Nc2c(C#N)cncc2/C=C/CCN2CCC(NS(=O)(=O)c3ccccc3)CC2)ccc2[nH]ccc12 CHEMBL605086 IC50 23.0 nM
Cc1c(Nc2c(C#N)cncc2/C=C/c2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)ccc2[nH]ccc12 CHEMBL1079435 IC50 23.0 nM
C[C@@H]1C(=O)NN=C2COc3cc(C(F)(F)F)c(NC4(C)CNC4)cc3N21 CHEMBL3355112 IC50 23.0 nM
C[C@H]1C[C@@H](N)CN(c2ncnc3[nH]c(Cl)c(-c4cccc(C#N)c4F)c23)C1 CHEMBL5415661 Ki 23.0 nM
N#Cc1cncc(/C=C/c2ccccc2)c1Nc1ccc2[nH]ccc2c1 CHEMBL579201 IC50 24.0 nM
Cc1c(Nc2c(C#N)cncc2/C=C/CCN2CC[C@H](O)C2)ccc2[nH]ccc12 CHEMBL595492 IC50 24.0 nM
Cc1cc(C(=O)c2cccnc2N)nc(N2CCN[C@@H](CC(C)C)C2)c1 CHEMBL2046651 Ki 24.0 nM
Cc1ccc(-c2cc3c(cc2[C@@H]2CCN(C)C[C@@H]2C)N2C(=NNC(=O)[C@H]2C)CO3)cc1 CHEMBL3355131 IC50 24.0 nM
N#Cc1nc(C(N)=O)c(Nc2cccc(Br)c2)nc1NC[C@H]1CC[C@H](N)CC1 CHEMBL4280300 IC50 24.0 nM
N#Cc1cccc(-c2c(Cl)[nH]c3ncnc(N4CCO[C@]5(CCNC5)C4)c23)c1 CHEMBL5435589 Ki 24.0 nM
CCCCCCCC(=O)O[C@H]1/C(=C/C(=O)OC)CC2C[C@H]([C@@H](C)O)OC(=O)C[C@H](O)CCO[C@H](C(C)(C)C)C[C@@H]3CCO[C@H](/C=C/C(C)(C)[C@]1(O)O2)O3 CHEMBL45053 Ki 24.1 nM
Cc1c(Nc2c(C#N)cncc2/C=C/C2CCCCC2)ccc2[nH]ccc12 CHEMBL566074 IC50 26.0 nM
Cc1[nH]c2ccccc2c1C1=C(c2nc(N3CCN(C)CC3)nc3ccccc23)C(=O)NC1=O CHEMBL2151414 IC50 26.0 nM
Cc1ccc(N2CCC(N)CC2)c(NC(=O)c2nc(-c3ncccc3OC(F)(F)F)cnc2N)n1 CHEMBL3903385 IC50 26.0 nM
NCC1CCC(CNc2nc(NCc3ccc(Cl)cc3Cl)ncc2[N+](=O)[O-])CC1 CHEMBL246184 IC50 27.0 nM
Cc1c(Nc2c(C#N)cncc2-c2ccccc2)ccc2[nH]ccc12 CHEMBL466653 IC50 27.0 nM
CN1CCC[C@@H](CNc2nc(Nc3cccc(-c4cnco4)c3)ncc2F)C1 CHEMBL3586045 IC50 27.0 nM
N#CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3ncccc3C(F)(F)F)cnc2N)CC1 CHEMBL3942617 IC50 27.0 nM
CNC(=O)[C@H]1CC[C@@H](Nc2cc(NCc3cnccc3C(F)(F)F)ncc2C#N)CC1 CHEMBL4876360 IC50 27.0 nM
CC(C)C[C@H]1CN(c2ccc(C3CC3)c(C(=O)c3cccnc3N)n2)CCN1 CHEMBL2046645 Ki 28.0 nM
CN1CCC[C@@H](CNc2nc(Nc3cccc(-n4cccn4)c3)ncc2F)C1 CHEMBL3586046 IC50 28.0 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nc(OCCO)ccc3C(F)(F)F)cnc2N)CC1 CHEMBL3889579 IC50 28.0 nM
N#Cc1cnc(Nc2ccccc2)nc1NC[C@]12C[C@@H]3C[C@H](C1)[C@@H](N)[C@@H](C3)C2 CHEMBL4279376 IC50 28.0 nM
CO[C@@H]1[C@H](NCCOCCOCCOCCNC(=O)CCC2=[N+]3C(=Cc4c(C)cc(C)n4[B-]3(F)F)C=C2)C[C@H]2O[C@]1(C)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)NC4 CHEMBL4465866 Kd 28.0 nM
CC(C)(C#N)c1cccc(-c2ccnc3[nH]ncc23)c1 CHEMBL4559701 Ki 28.0 nM
NC[C@H]1CC[C@H](CNc2nc(NCc3ccccc3Cl)ncc2[N+](=O)[O-])CC1 CHEMBL395691 IC50 29.0 nM
N#Cc1cncc(-c2cccc(OCCN3CCCC3)c2)c1Nc1cccc2[nH]ccc12 CHEMBL467723 IC50 29.0 nM
COCCC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3ncccc3C(F)(F)F)cnc2N)CC1 CHEMBL3964163 IC50 29.0 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nc(N4CC(O)C4)ccc3C(F)(F)F)cnc2N)CC1 CHEMBL3933646 IC50 29.0 nM
COc1cc(Nc2ncc(F)c(NC[C@@H]3CCCN(CC(F)F)C3)n2)cc(-n2nnnc2C)c1 CHEMBL3586041 IC50 30.0 nM
Nc1ncc(-c2ncccc2C(F)(F)F)nc1C(=O)Nc1ncccc1N1CCC(N)(CCO)C(F)C1 CHEMBL3900688 IC50 30.0 nM
NCC1(c2cccc(-c3ccnc4[nH]ncc34)c2)CCCCC1 CHEMBL4444700 Ki 30.0 nM
NCC1CCC(CNc2nc(NC3Cc4ccccc4C3)ncc2[N+](=O)[O-])CC1 CHEMBL247572 IC50 31.0 nM
CC(=O)NC1CCN(CC/C=C/c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)CC1 CHEMBL596414 IC50 31.0 nM
Cc1c(Nc2c(C#N)cncc2/C=C/CN2CCN(C)CC2)ccc2[nH]ccc12 CHEMBL596413 IC50 31.0 nM
Cc1c(Nc2c(C#N)cncc2/C=C/c2ccc(CN3CCC(O)CC3)cn2)ccc2[nH]ccc12 CHEMBL1098034 IC50 31.0 nM
CN1CCN(c2cc(C3=C(c4c[nH]c5ccccc45)C(=O)NC3=O)c3ccccc3n2)CC1 CHEMBL2153747 IC50 31.0 nM
COCCOc1cccc(-c2cncc(C#N)c2Nc2cccc3[nH]ccc23)c1 CHEMBL467722 IC50 32.0 nM
Nc1ncccc1C(=O)c1cccc(N2CCNCC2)n1 CHEMBL2046626 Ki 32.0 nM
Cc1cnn(-c2cccc(Nc3ncc(F)c(NC[C@@H]4CCCN(C)C4)n3)c2)c1 CHEMBL3586047 IC50 32.0 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nccc(OC4CC4)c3C#N)cnc2N)CC1 CHEMBL3963597 IC50 32.0 nM
C[S+]([O-])c1ncccc1CNc1ncc(C#N)c(NCC23CC4CC(C2)C(NC[C@H]2CC[C@H](O)CC2)C(C4)C3)n1 CHEMBL4592349 IC50 32.0 nM
CCCc1cc(-c2ccnc3[nH]ncc23)cc(C(C)(CC)CN)c1 CHEMBL4454086 Ki 32.0 nM
CC(C)(F)c1ncncc1CNc1cc(N[C@H]2CC[C@@H](O)CC2)c(C#N)cn1 CHEMBL4858601 IC50 32.0 nM
Cc1cc2[nH]ccc2cc1Nc1c(C#N)cncc1-c1ccc(OCCN2CCN(C)CC2)cc1 CHEMBL467871 IC50 33.0 nM
COc1ccnc2[nH]c(=O)n(-c3nc(N4CCNC(c5ccccc5)C4)ccc3Cl)c12 CHEMBL4101327 IC50 33.0 nM
N#Cc1cnc(NCc2cccc(Cl)c2)nc1NC[C@]12C[C@@H]3C[C@H](C1)[C@@H](N)[C@@H](C3)C2 CHEMBL4293947 IC50 33.0 nM
CN1CCC2(CC1)CN(c1ncnc3[nH]c(Cl)c(-c4cccc(C#N)c4)c13)CCO2 CHEMBL5415748 Ki 33.0 nM
Cc1ccccc1CNc1ncc([N+](=O)[O-])c(NCC2CCC(CN)CC2)n1 CHEMBL428751 IC50 34.0 nM
Cc1c(Nc2c(C#N)cncc2/C=C/c2ccccc2)cc(C)c2[nH]ccc12 CHEMBL566060 IC50 34.0 nM
Cc1c(Nc2c(C#N)cncc2CCc2ccccc2)ccc2[nH]ccc12 CHEMBL578783 IC50 34.0 nM
Cc1c(Nc2c(C#N)cncc2/C=C/CCCN2CCOCC2)ccc2[nH]ccc12 CHEMBL596412 IC50 34.0 nM
N#Cc1cnc(NCc2cnccc2C(F)(F)F)cc1N[C@H]1CC[C@@H](c2nc[nH]n2)CC1 CHEMBL4851347 IC50 34.0 nM
NCC1CCC(CNc2nc(NCc3cc(F)ccc3F)ncc2[N+](=O)[O-])CC1 CHEMBL396370 IC50 35.0 nM
Cc1c(Nc2c(C#N)cncc2-c2ccc(CN3CCCC3)o2)ccc2[nH]ccc12 CHEMBL567094 IC50 35.0 nM
Cc1c(Nc2c(C#N)cncc2/C=C/CCN2CCCCC2)ccc2[nH]ccc12 CHEMBL593387 IC50 35.0 nM
COc1cccc(-c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)c1 CHEMBL513827 IC50 36.0 nM
Cn1cc(C2=C(c3cn(C4CCN(Cc5ccccn5)CC4)c4ccccc34)C(=O)NC2=O)c2ccccc21 CHEMBL300138 Kd 36.0 nM
N#Cc1cnc(Nc2cccc(Br)c2)nc1NCC1CCNCC1 CHEMBL4280341 IC50 36.0 nM
CO[C@@H]1[C@H](N)C[C@H]2O[C@]1(C)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)NC4=O CHEMBL4754496 IC50 36.0 nM
Cn1cncc1C1=CN(c2ncnc3[nH]cnc23)CCS1 CHEMBL5433617 IC50 36.0 nM
Cc1c(Nc2c(C#N)cncc2-c2ccc(CN3CCN(C)CC3)nc2)ccc2[nH]ccc12 CHEMBL567092 IC50 38.0 nM
CC(=O)N1CCN(CC/C=C/c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)CC1 CHEMBL595753 IC50 38.0 nM
CC(C)(C)[C@H]1CN(c2cccc(C(=O)c3cccnc3N)n2)CCN1 CHEMBL2046639 Ki 38.0 nM
CO[C@@H]1[C@H](NC(C)=O)C[C@H]2O[C@]1(C)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)NC4 CHEMBL4758448 IC50 38.0 nM
CN(C)C(=O)[C@H]1CC[C@@H](Nc2cc(NCc3cnccc3C(F)(F)F)ncc2C#N)CC1 CHEMBL4870192 IC50 38.0 nM
NCC1CCC(CNc2nc(NCc3ccccc3-c3ccccc3)ncc2[N+](=O)[O-])CC1 CHEMBL246177 IC50 39.0 nM
Cc1cccc(CNc2ncc([N+](=O)[O-])c(NCC3CCC(CN)CC3)n2)c1 CHEMBL438669 IC50 39.0 nM
Cc1c(Nc2c(C#N)cncc2/C=C/CCN2CCC(CO)CC2)ccc2[nH]ccc12 CHEMBL596424 IC50 39.0 nM
N#Cc1cnc(NCc2ccccc2)nc1NC[C@]12C[C@@H]3C[C@H](C1)[C@@H](N)[C@@H](C3)C2 CHEMBL4289223 IC50 39.0 nM
O=C1NCCc2[nH]c(-c3ccncc3)cc21 CHEMBL225519 pKi 39.81 nM
Cc1c(Nc2c(C#N)cnc3sc(/C=C/C(=O)N4CCC(O)C4)cc23)ccc2[nH]ccc12 CHEMBL477818 IC50 41.0 nM
Cc1c(Nc2c(C#N)cncc2-c2ccc(CN3CCCCC3)o2)ccc2[nH]ccc12 CHEMBL585113 IC50 41.0 nM
C[C@@H]1C(=O)NN=C2COc3cc(-c4ccccc4F)c([C@H]4CCN(C)C4)cc3N21 CHEMBL3355121 IC50 41.0 nM
NCC1CCC(CNc2nc(NCc3c(F)cccc3F)ncc2[N+](=O)[O-])CC1 CHEMBL246182 IC50 42.0 nM
CCN(CC)Cc1ccc(-c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)o1 CHEMBL568142 IC50 42.0 nM
COC1CCN(CC/C=C/c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)CC1 CHEMBL593891 IC50 42.0 nM
C[C@@H]1C(=O)NN=C2COc3cc(-c4ccccc4F)c(C4CCN(C)C4)cc3N21 CHEMBL3355120 IC50 42.0 nM
Cc1c(Nc2c(C#N)cnc3sc(/C=C/C(=O)N4CCN(C)CC4)cc23)ccc2[nH]ccc12 CHEMBL477405 IC50 43.0 nM
C[C@@H]1C(=O)NN=C2COc3cc(-c4ccccc4F)c(C4CCN(C)CC4)cc3N21 CHEMBL3355122 IC50 43.0 nM
CC(C)CN1c2cc(-n3c(=O)[nH]c4ncccc43)ccc2C(=O)NC1(C)C CHEMBL3799399 IC50 45.0 nM
Cc1c(Cl)cccc1CNc1ncc([N+](=O)[O-])c(NCC2CCC(CN)CC2)n1 CHEMBL246387 IC50 46.0 nM
NCC1CCC(CNc2nc(NCc3ccccc3Cl)ncc2[N+](=O)[O-])CC1 CHEMBL246970 IC50 46.0 nM
Cc1c(Nc2c(C#N)cncc2/C=C/CCN2CCC(N)C(C)C2)ccc2[nH]ccc12 CHEMBL607036 IC50 46.0 nM
NCC1CCC(CNc2nc(NCc3ccccc3F)ncc2[N+](=O)[O-])CC1 CHEMBL395689 IC50 48.0 nM
COCCNC(=O)/C=C/c1cc2c(Nc3ccc4[nH]ccc4c3C)c(C#N)cnc2s1 CHEMBL476127 IC50 48.0 nM
Cc1c(Nc2c(C#N)cnc3sc(/C=C/C(=O)N4CCCCC4)cc23)ccc2[nH]ccc12 CHEMBL476149 IC50 48.0 nM
C[C@@H]1C(=O)NN=C2COc3cc(C(F)(F)F)c(NC4CNC4)cc3N21 CHEMBL3356474 IC50 49.0 nM
C[C@@H]1C(=O)NN=C2COc3cc(-c4ccccc4)c(NC4CNC4)cc3N21 CHEMBL3356472 IC50 49.0 nM
Cc1c(Nc2c(C#N)cncc2/C=C/CCN2CCN(S(=O)(=O)c3ccccc3)CC2)ccc2[nH]ccc12 CHEMBL594784 IC50 50.0 nM
c1cc(-c2n[nH]c3ncccc23)nc(N2CCNCC2)c1 CHEMBL2326014 Ki 50.0 nM
CO[C@@H]1[C@H](N(C)C(C)=O)C[C@H]2O[C@]1(C)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)NC4=O CHEMBL4777775 IC50 50.0 nM
N#Cc1cnc(NCc2cnccc2C(F)(F)F)cc1NC[C@H]1CC[C@H](O)CC1 CHEMBL4851812 IC50 50.0 nM
Cc1c(Nc2c(C#N)cncc2/C=C/CN2CCOCC2)ccc2[nH]ccc12 CHEMBL595500 IC50 51.0 nM
Cc1c(Nc2c(C#N)cncc2/C=C/CCN2CCN(OC(=O)C(C)(C)C)CC2)ccc2[nH]ccc12 CHEMBL577254 IC50 51.0 nM
COC[C@H]1CN(c2ccc(F)c(-c3n[nH]c4ncccc34)n2)CCN1 CHEMBL2326006 Ki 51.0 nM
Cc1ccc(N2CCC(N)CC2)c(NC(=O)c2nc(-c3ncccc3C(F)(F)F)cnc2N)n1 CHEMBL3977527 IC50 51.0 nM
N#Cc1cnc(Nc2cccc(Br)c2)nc1NCC[C@H]1CC[C@H](N)CC1 CHEMBL4278969 IC50 51.0 nM
CC(C)[C@H]1C(=O)N[C@H](CO)Cc2cn3nc(C(F)(F)F)c4ccc(c2c43)N1C CHEMBL261387 Ki 51.1 nM
Cc1c(Nc2c(C#N)cnc3sc(-c4ccccc4)cc23)ccc2[nH]ccc12 CHEMBL256535 IC50 52.0 nM
N#Cc1cnc2sc(-c3ccccc3)cc2c1Nc1ccc2[nH]ccc2c1 CHEMBL409155 IC50 52.0 nM
CN(C)CCOc1cccc(C2=C(c3c[nH]c4ccccc34)C(=O)NC2=O)c1 CHEMBL566853 IC50 52.0 nM
CC1C(=O)NN=C2COc3cc(-c4ccccc4)c(NC4(C)CN(C)C4)cc3N21 CHEMBL3355116 IC50 52.0 nM
Cc1c(Nc2c(C#N)cnc3sc(/C=C/C(=O)N4CCOCC4)cc23)ccc2[nH]ccc12 CHEMBL476150 IC50 53.0 nM
CN(C)CC1CCC(CNc2nc(NCc3ccccc3Cl)ncc2[N+](=O)[O-])CC1 CHEMBL246160 IC50 54.0 nM
NCC1CCC(CNc2nc(NCCc3cccc(F)c3)ncc2[N+](=O)[O-])CC1 CHEMBL391610 IC50 54.0 nM
CCc1c(Nc2c(C#N)cncc2-c2ccc(OC)c(OC)c2)ccc2[nH]ccc12 CHEMBL494000 IC50 55.0 nM
C[C@H](N)CNc1nc(-c2ccncc2)cc2cnccc12 CHEMBL2147537 IC50 55.0 nM
Cc1cc2c(cc1NC1CNC1)N1C(=NNC(=O)[C@H]1C)CO2 CHEMBL3356470 IC50 55.0 nM
Cc1c(Nc2c(C#N)cncc2/C=C/c2ccc(CN3CCOCC3)cn2)ccc2[nH]ccc12 CHEMBL1094375 IC50 56.0 nM
Cc1c(Nc2c(C#N)cncc2/C=C/CCN2CCC(NS(C)(=O)=O)C(C)C2)ccc2[nH]ccc12 CHEMBL592936 IC50 57.0 nM
C[C@@H]1C(=O)NN=C2COc3cc(C(F)(F)F)c(NC4(C)CN(C)C4)cc3N21 CHEMBL3355114 IC50 57.0 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3ncccc3OC(F)(F)F)cnc2N)CC1F CHEMBL3918192 IC50 57.0 nM
Cc1c(Nc2c(C#N)cnc3sc(-c4cccc(C(=O)N5CCCC5)c4)cc23)ccc2[nH]ccc12 CHEMBL476746 IC50 58.0 nM
CO[C@H]1CC[C@@H](Nc2cc(NCc3cnccc3C(F)(F)F)ncc2C#N)CC1 CHEMBL4873755 IC50 58.0 nM
N#Cc1cnc(NCc2cnccc2C(F)(F)F)cc1NC[C@H]1CC[C@@H](O)CC1 CHEMBL4875258 IC50 58.0 nM
CC1C(=O)NN=C2COc3cc(C(F)(F)F)c(CC4CNC4)cc3N21 CHEMBL3356469 IC50 59.0 nM
C[C@@H]1C(=O)NN=C2COc3cc(C(F)(F)F)c(N(C)C4(C)CNC4)cc3N21 CHEMBL3355113 IC50 59.0 nM
NCC1CCC(CNc2nc(Nc3cccc(Cl)c3)ncc2[N+](=O)[O-])CC1 CHEMBL396924 IC50 60.0 nM
N#Cc1cncc(-c2cccc(OCCN3CCCCC3)c2)c1Nc1cccc2[nH]ccc12 CHEMBL468135 IC50 60.0 nM
Fc1ccc(N2CCNCC2)nc1-c1n[nH]c2ncccc12 CHEMBL2326015 Ki 60.0 nM
CCN1c2cc(-c3c[nH]c4ncccc34)ccc2C(=O)NC1(C)C CHEMBL3798713 IC50 60.0 nM
N#Cc1cnc(NCc2ccc(Cl)cc2)nc1NC[C@]12C[C@@H]3C[C@H](C1)[C@@H](N)[C@@H](C3)C2 CHEMBL4282664 IC50 60.0 nM
Cn1cc(-c2ccc(-c3cncc(Cl)c3N3CCC4(CCNC4=O)CC3)cc2)cn1 CHEMBL3408213 Ki 61.0 nM
C[C@H]1C[C@@H](N)CN(c2ncnc3[nH]c(Cl)c(-c4cccc(CO)c4)c23)C1 CHEMBL5418420 Ki 61.0 nM
CC(C)[C@H]1/C(S)=N/[C@H](CO)Cc2c[nH]c3cccc(c23)N1C CHEMBL63262 Ki 61.6 nM
CCCCCCCCCCc1ccc2c(c1)N(C)[C@@H](C(C)C)C(=O)O[C@H](CO)C2 CHEMBL102858 Ki 62.0 nM
COCCOc1cc(-c2cncc(C#N)c2Nc2cccc3[nH]ccc23)ccc1OC CHEMBL511403 IC50 63.0 nM
N#Cc1cccc(-c2c(Cl)[nH]c3ncnc(N4CCCC5(CNC5)C4)c23)c1 CHEMBL5416894 Ki 63.0 nM
Cc1cc(Nc2ncc(F)c(NC3C4C=CC(C4)C3C(N)=O)n2)ccc1N1CCN(C)CC1 CHEMBL1967878 pKi 63.1 nM
NCC(NC(=O)c1ccc(-c2ccncc2)cc1)c1ccccc1 CHEMBL1990254 pKi 63.1 nM
NC(=O)c1cc(-c2ccnc(N)n2)[nH]c1-c1ccc(Cl)cc1Cl CHEMBL1965660 pKi 63.1 nM
CNS(=O)(=O)c1ccccc1Nc1nc(Nc2cc(OC)c(OC)c(OC)c2)ncc1Cl CHEMBL1993661 pKi 63.1 nM
O=C1NC(=O)C2=C1c1cn(c3ccccc13)CCOCCOCCOCCn1cc2c2ccccc21 CHEMBL340259 IC50 65.0 nM
N#Cc1cncc(/C=C/c2ccccc2)c1Nc1cc2cc[nH]c2cc1Cl CHEMBL578169 IC50 65.0 nM
N#CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3ncccc3OC(F)(F)F)cnc2N)CC1 CHEMBL3905625 IC50 66.0 nM
C[C@@]1(N)CCN(c2cccnc2NC(=O)c2nc(-c3ncccc3OC(F)(F)F)cnc2N)C[C@@H]1F CHEMBL3943074 IC50 66.0 nM
C[C@H]1CN(c2cccc(C(=O)c3cccnc3N)n2)CCN1 CHEMBL2046635 Ki 67.0 nM
Cc1cccc2c(C3=C(c4c[nH]c5ccccc45)C(=O)NC3=O)nc(N3CCN(C)CC3)nc12 CHEMBL2151406 IC50 67.0 nM
CC1C(=O)NN=C2COc3cc(C(F)(F)F)c(NC4CNC4)cc3N21 CHEMBL3356467 IC50 67.0 nM
Cc1c(Nc2c(C#N)cncc2/C=C/CCN2CCN(c3ccccc3)CC2)ccc2[nH]ccc12 CHEMBL605112 IC50 68.0 nM
Cc1ncc(C#N)c(Nc2ccc3[nH]ccc3c2C)c1/C=C/c1ccc(S(=O)(=O)N2CCCCC2)cc1 CHEMBL1080114 IC50 68.0 nM
CC(C)(O)C(=O)N1CCN(c2ccc(C(F)(F)F)c(C3=C(c4c[nH]c5ccccc45)C(=O)NC3=O)c2)CC1 CHEMBL1650951 IC50 68.0 nM
C[C@@H]1CN(c2cccc(-c3n[nH]c4ncccc34)n2)CCN1 CHEMBL2321918 Ki 68.0 nM
COc1ccc(-c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2)cc1OC CHEMBL492251 IC50 70.0 nM
Cc1cc2c(C)c(Nc3c(C#N)cncc3/C=C/c3ccccc3)ccc2[nH]1 CHEMBL585878 IC50 70.0 nM
CO[C@H]1CC[C@@H](CNc2cc(NCc3cnccc3C(F)(F)F)ncc2C#N)CC1 CHEMBL4864053 IC50 70.0 nM
Cc1c(Nc2c(C#N)cncc2/C=C/CCN2CCC[C@@H](O)C2)ccc2[nH]ccc12 CHEMBL606342 IC50 71.0 nM
CC(C)c1ccc2nc(N3CCN(C)CC3)nc(C3=C(c4c[nH]c5ccccc45)C(=O)NC3=O)c2c1 CHEMBL2153753 IC50 71.0 nM
CCC(C)(C#N)c1cccc(-c2ccnc3[nH]ncc23)c1 CHEMBL4447253 Ki 72.0 nM
CN1CCN(CCOc2ccc(-c3cncc(C#N)c3Nc3ccc4[nH]ccc4c3)cc2)CC1 CHEMBL523194 IC50 73.0 nM
C[C@H]1C[C@@H](N)CN(c2ncnc3[nH]c(Cl)c(-c4cccc(C#N)c4Cl)c23)C1 CHEMBL5437932 Ki 74.0 nM
CN(C)Cc1cccc(-c2cc3c(Nc4ccc5[nH]ccc5c4)c(C#N)cnc3s2)c1 CHEMBL256317 IC50 75.0 nM
CN1CCN(c2cccc(C3=C(c4c[nH]c5ccccc45)C(=O)NC3=O)c2)CC1 CHEMBL585500 IC50 76.0 nM
Nc1ncccc1C(=O)c1cccc(N2CCC(N)CC2)n1 CHEMBL2046629 Ki 76.0 nM
NCC1CCC(CNc2nc(NCCc3ccc(F)cc3)ncc2[N+](=O)[O-])CC1 CHEMBL247377 IC50 77.0 nM
Cc1c(Nc2c(C#N)cncc2/C=C/c2ccccc2)cc(Cl)c2[nH]ccc12 CHEMBL568687 IC50 77.0 nM
NCCNc1nc(-c2ccncc2)cc2cnccc12 CHEMBL1214929 IC50 77.0 nM
c1cc(-c2cc3cnccc3c(N3CCCNCC3)n2)ccn1 CHEMBL2147542 IC50 77.0 nM
Cc1c(Nc2c(C#N)cncc2/C=C\c2ccccc2)ccc2[nH]ccc12 CHEMBL568974 IC50 79.0 nM
CN1CCC(c2c(O)cc(O)c3c(=O)cc(-c4ccccc4Cl)oc23)C(O)C1 CHEMBL422897 pKi 79.43 nM
CC(N)C1CCC(C(=O)Nc2ccncc2)CC1 CHEMBL1994526 pKi 79.43 nM
COc1ccc(-c2cncc(C#N)c2Nc2ccc(Cl)cc2Cl)cc1OC CHEMBL522199 IC50 80.0 nM
COc1ccccc1-c1cncc(C#N)c1Nc1ccc2[nH]ccc2c1C CHEMBL512606 IC50 82.0 nM
NCC1CCC(CNc2nc(NCc3cccc(F)c3)ncc2[N+](=O)[O-])CC1 CHEMBL245757 IC50 83.0 nM
Cc1c(Nc2c(C#N)cnc3sc(-c4cncc(CN(C)C)c4)cc23)ccc2[nH]ccc12 CHEMBL518942 IC50 84.0 nM
NCC1CCC(CNc2nc(NCc3cccc(Cl)c3)ncc2[N+](=O)[O-])CC1 CHEMBL437941 IC50 85.0 nM
CC1(C)CN(c2cccc(C(=O)c3cccnc3N)n2)CCN1 CHEMBL2046636 Ki 85.0 nM
Cc1nc(Nc2n[nH]c3c2CN(C(=O)N[C@H](CN(C)C)c2ccccc2)C3(C)C)c2sccc2n1 CHEMBL3128043 Kd apparent 85.0 nM
Cc1c(Nc2c(C#N)cnc3sc(/C=C/C(=O)N4CCNCC4)cc23)ccc2[nH]ccc12 CHEMBL477404 IC50 88.0 nM
O=[N+]([O-])c1cnc(NCc2ccccc2Cl)nc1NCC1CCNCC1 CHEMBL246161 IC50 90.0 nM
NCC1CCC(CNc2nc(NCCCCc3ccccc3)ncc2[N+](=O)[O-])CC1 CHEMBL391609 IC50 90.0 nM
Cc1c(Oc2c(C#N)cncc2/C=C/c2ccccc2)ccc2[nH]ccc12 CHEMBL578984 IC50 90.0 nM
C[C@@H](N)c1ccc(C(=O)Nc2ccnc3[nH]ccc23)cc1 CHEMBL571948 Kd apparent 90.0 nM
N#Cc1cnc(NCc2cncnc2-c2ccccc2)cc1N[C@H]1CC[C@@H](O)CC1 CHEMBL4856178 IC50 90.0 nM
N#Cc1cnc(NCc2cncnc2OCC(F)F)cc1N[C@H]1CC[C@@H](O)CC1 CHEMBL4865721 IC50 90.0 nM
NC[C@H]1CN(c2ncnc3[nH]c(Cl)c(-c4cccc(CO)c4)c23)CCO1 CHEMBL5419222 Ki 90.0 nM
Cc1c(Nc2c(C#N)cnc3sc(-c4ccccc4CN(C)C)cc23)ccc2[nH]ccc12 CHEMBL480641 IC50 93.0 nM
CC(C)(N)CNc1nc(-c2ccncc2Cl)cc2cnccc12 CHEMBL2147551 IC50 93.0 nM
C[C@H]1C[C@@H](N)CN(c2ncnc3[nH]c(Cl)c(-c4cccc(C#N)c4)c23)C1 CHEMBL5423993 Ki 93.0 nM
NCC1CCC(CNc2nc(NCCc3ccccc3)ncc2[N+](=O)[O-])CC1 CHEMBL247573 IC50 94.0 nM
NCCCNc1nc(-c2ccncc2)cc2cnccc12 CHEMBL2147544 IC50 97.0 nM
CN(C)c1nc2ccc1CCCn1cc(c3ccccc31)C1=C(C(=O)NC1=O)c1cn(c3ccccc13)CC2 CHEMBL1162963 IC50 98.0 nM
NCC1CCC(CNc2nc(NCc3ccc(F)cc3F)ncc2[N+](=O)[O-])CC1 CHEMBL245982 IC50 100.0 nM
CN1CCN(Cc2cccc(-c3cc4c(Nc5ccc6[nH]ccc6c5)c(C#N)cnc4s3)c2)CC1 CHEMBL256533 IC50 100.0 nM
Cc1ccc(CN(C)C)cc1-c1cc2c(Nc3ccc4[nH]ccc4c3C)c(C#N)cnc2s1 CHEMBL480222 IC50 100.0 nM
Cc1c(Nc2c(C#N)cnc3sc(/C=C/C(=O)NN(C)C)cc23)ccc2[nH]ccc12 CHEMBL515166 IC50 100.0 nM
C[C@]12O[C@H](C[C@]1(O)CO)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)CNC4=O CHEMBL603469 Kd 100.0 nM
OC1CCC(Nc2cc(Cl)nc(-c3c[nH]c4ncccc34)n2)CC1 CHEMBL1991674 pKi 100.0 nM
CCn1c(-c2nonc2N)nc2cncc(C(=O)N3CCC(N)C3)c21 CHEMBL1870106 pKi 100.0 nM
CC1C(=O)NN=C2COc3cc(F)c(NC4CNC4)cc3N21 CHEMBL3356465 IC50 100.0 nM
C[C@@H](c1ccccc1)N1c2cc(-n3c(=O)[nH]c4ncccc43)ccc2C(=O)NC1(C)C CHEMBL3800082 IC50 100.0 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nccc(Oc4ccccc4)c3C#N)cnc2N)CC1 CHEMBL3891200 IC50 100.0 nM
O=c1[nH]c2ncccc2n1-c1nc(N2CCCNCC2)ccc1F CHEMBL4071874 IC50 100.0 nM
N#Cc1cnc(NCc2cnccc2C(F)(F)F)cc1N[C@H]1CC[C@@H](O)CC1 CHEMBL4872717 IC50 100.0 nM
N#Cc1cnc(NCc2cnccc2C(F)(F)F)cc1N[C@H]1CC[C@@H](n2cncn2)CC1 CHEMBL4874653 IC50 100.0 nM
CC1(C)C[C@H](Nc2cc(NCc3cnccc3C(F)(F)F)ncc2C#N)CC[C@H]1O CHEMBL4853493 IC50 100.0 nM
CC(C)NCc1ccc2ccc(Cl)c(C3=C(c4cn(C)c5ccccc45)C(=O)NC3=O)c2c1 CHEMBL4083319 IC50 101.0 nM
c1cc(-c2cc3cnccc3c(N3CCNCC3)n2)ccn1 CHEMBL1214932 IC50 109.0 nM
O=C1NCCC12CCN(c1c(Cl)cncc1-c1cc3ccccc3o1)CC2 CHEMBL4777349 Ki 109.0 nM
NCCCCCCCNc1nc(NCc2ccccc2Cl)ncc1[N+](=O)[O-] CHEMBL246367 IC50 110.0 nM
Cc1c(Nc2c(C#N)cnc3sc(/C=C/C(=O)Nc4ccccc4)cc23)ccc2[nH]ccc12 CHEMBL475919 IC50 110.0 nM
Cc1cc2c(cc1NC1CNC1)N1C(=NNC(=O)C1C)CO2 CHEMBL3356464 IC50 110.0 nM
N#Cc1cccc(-c2c(Cl)[nH]c3ncnc(N4C[C@H](N)C[C@H](C(F)(F)F)C4)c23)c1 CHEMBL5439912 Ki 116.0 nM
COc1ccc(-c2cncc(C#N)c2Nc2cc(C)c3[nH]ccc3c2)cc1OC CHEMBL494001 IC50 120.0 nM
Cc1c(Nc2c(C#N)cncc2/C=C/CCN2CCC[C@H](O)C2)ccc2[nH]ccc12 CHEMBL592935 IC50 120.0 nM
CC1(C)C[C@@H](Nc2cc(NCc3cnccc3C(F)(F)F)ncc2C#N)CC[C@H]1O CHEMBL4849429 IC50 120.0 nM
CC1(C)C[C@@H](Nc2cc(NCc3cnccc3C(F)(F)F)ncc2C#N)CC[C@@H]1O CHEMBL4855568 IC50 120.0 nM
CCC(C)NS(=O)(=O)Cc1ccc(/C=C/c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)cc1 CHEMBL1081357 IC50 121.0 nM
COc1cccc(C(C)NC(=O)c2ccc(-c3ccncc3)cc2)c1 CHEMBL1975121 pKi 125.89 nM
Cc1cc(=O)n2ccc(CN(C)C)c(O)c2n1 CHEMBL1988581 pKi 125.89 nM
Cc1n[nH]c2ccc(-c3cccnc3)cc12 CHEMBL1967252 pKi 125.89 nM
Nc1nc(Cl)cc(-c2c[nH]c3ncccc23)n1 CHEMBL2007574 pKi 125.89 nM
NCC1CCC(CNc2nc(NCCc3ccccc3F)ncc2[N+](=O)[O-])CC1 CHEMBL247177 IC50 130.0 nM
CN(C)Cc1ccc(-c2cc3c(Nc4ccc5[nH]ccc5c4)c(C#N)cnc3s2)cc1 CHEMBL257818 IC50 130.0 nM
N#Cc1cnc2sc(/C=C/C(=O)N3CCCC3)cc2c1Nc1ccc2[nH]ccc2c1 CHEMBL479058 IC50 130.0 nM
CC(C)c1cc2c(cc1NC1CNC1)N1C(=NNC(=O)C1C)CO2 CHEMBL3356466 IC50 130.0 nM
N#Cc1cnc(NCC2CCCCC2)nc1NC[C@]12C[C@@H]3C[C@H](C1)[C@@H](N)[C@@H](C3)C2 CHEMBL4282831 IC50 130.0 nM
N#Cc1cnc(Nc2cccc(Br)c2)cc1NC[C@H]1CC[C@H](N)CC1 CHEMBL4290595 IC50 130.0 nM
CC1(C)[C@H](O)C[C@H]1Nc1nc(NCc2cnccc2C(F)(F)F)ncc1C#N CHEMBL4858037 IC50 130.0 nM
NC1CCCN(c2nc(-c3ccncc3)cc3cnccc23)C1 CHEMBL2147543 IC50 132.0 nM
CC(C)[C@](C)(O)[C@H]1CN(c2ccc(F)c(-c3n[nH]c4ncccc34)n2)CCN1 CHEMBL2326008 Ki 133.0 nM
O=C1NCCC12CCN(c1c(Cl)cncc1-c1cc3ccccc3s1)CC2 CHEMBL4791586 Ki 134.0 nM
Cc1c(Nc2c(C#N)cncc2/C=C/CN2CCC(O)CC2)ccc2[nH]ccc12 CHEMBL604050 IC50 140.0 nM
CC(C)(N)CNc1nc(-c2ccncc2F)cc2cnccc12 CHEMBL2147550 IC50 140.0 nM
CS(=O)(=O)c1ncccc1CNc1ncc(C#N)c(NCC23CC4CC(C2)C(NC[C@H]2CC[C@H](O)CC2)C(C4)C3)n1 CHEMBL4583637 IC50 140.0 nM
N#Cc1cnc(NCc2ccccc2C(F)(F)F)cc1N[C@H]1CC[C@@H](O)CC1 CHEMBL4861789 IC50 140.0 nM
CC1(C)[C@H](Nc2cc(NCc3cnccc3C(F)(F)F)ncc2C#N)C[C@H]1C(N)=O CHEMBL4850874 IC50 140.0 nM
CC1(C)[C@@H](Nc2cc(NCc3cnccc3C(F)(F)F)ncc2C#N)C[C@H]1C(N)=O CHEMBL4849864 IC50 140.0 nM
CC(C)(N)CNc1nc(-c2ccncc2)cc2cnccc12 CHEMBL2147538 IC50 141.0 nM
C[C@H]1C[C@@H](N)CN(c2ncnc3[nH]c(Cl)c(-c4ccccc4)c23)C1 CHEMBL5435406 Ki 147.0 nM
CCCCCCCC(=O)O[C@H]1/C(=C/C(=O)OC)CC2C[C@H]([C@@H](C)O)OC(=O)C[C@@H](O)C[C@@H]3CCC[C@H](C[C@@H]4CCO[C@H](/C=C/C(C)(C)[C@]1(O)O2)O4)O3 CHEMBL46053 Ki 147.5 nM
Cc1nn2cc3c4c(ccc1c42)N(C)[C@@H](C(C)C)C(=O)N[C@H](CO)C3 CHEMBL441897 Ki 149.0 nM
COc1ccc(-c2cncc(C#N)c2Nc2cccc(Br)c2)cc1OC CHEMBL448406 IC50 150.0 nM
Cc1c(Nc2c(C#N)cnc3sc(/C=C/C(=O)N(C)CCN(C)C)cc23)ccc2[nH]ccc12 CHEMBL477173 IC50 150.0 nM
CC1(C)NC(=O)c2ccc(-n3c(=O)[nH]c4ncccc43)cc2N1Cc1cccnc1 CHEMBL3798849 IC50 150.0 nM
N#Cc1cnc(NCc2ccccc2C(F)(F)F)cc1N[C@H]1C[C@@H](C(N)=O)C1 CHEMBL4878146 IC50 150.0 nM
NC(=O)c1ccc(-c2c[nH]c3nccc(Cl)c23)cc1 CHEMBL1982711 pKi 158.49 nM
NCc1ccc(CNc2nc(NCc3ccccc3Cl)ncc2[N+](=O)[O-])cc1 CHEMBL391753 IC50 160.0 nM
COc1ccc(-c2cncc(C#N)c2Nc2ccc(C)cc2C)cc1OC CHEMBL495138 IC50 160.0 nM
Nc1ncccc1C(=O)c1cccc(N2CCCNCC2)n1 CHEMBL2046624 Ki 164.0 nM
CN(C)CCCn1cc(C2=C(c3cccc4ccccc34)C(=O)NC2=O)c2ccccc21 CHEMBL584483 IC50 165.0 nM
CCCCCCCCCCc1cccc2c1C[C@@H](CO)OC(=O)[C@H](C(C)C)N2C CHEMBL103091 Ki 167.0 nM
NCC1CCC(CNc2nc(NCc3ccc(Cl)cc3)ncc2[N+](=O)[O-])CC1 CHEMBL246972 IC50 170.0 nM
Cc1c(Nc2c(C#N)cnc3sc(/C=C/C(=O)N4CC[C@H](N(C)C)C4)cc23)ccc2[nH]ccc12 CHEMBL514356 IC50 170.0 nM
O=C1C[C@H](CO)OC(=O)C[C@H]2CCC[C@]3(C[C@@H](C[C@@H](CCCCc4ccccc4)O3)O1)O2 CHEMBL1258349 Ki 170.0 nM
CC1(C)NC(=O)c2ccc(-n3c(=O)[nH]c4ncccc43)cc2N1CC1CC1 CHEMBL3798787 IC50 170.0 nM
N#Cc1cnc(NC2CCCCC2)nc1NC[C@]12C[C@@H]3C[C@H](C1)[C@@H](N)[C@@H](C3)C2 CHEMBL4290718 IC50 170.0 nM
CO[C@@H]1[C@H](N(C)C(C)=O)C[C@H]2O[C@]1(C)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)NC4 CHEMBL4764299 IC50 170.0 nM
CO[C@H]1[C@@H](N2CC[C@@H](O)C2=O)C[C@@H]2O[C@@]1(C)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)NC4 CHEMBL4754636 IC50 170.0 nM
CC1(C)[C@@H](Nc2nc(NCc3cnccc3C(F)(F)F)ncc2C#N)C[C@@H]1O CHEMBL4873812 IC50 170.0 nM
Cc1ccccc1CCNc1ncc([N+](=O)[O-])c(NCC2CCC(CN)CC2)n1 CHEMBL247176 IC50 180.0 nM
Cc1c(Nc2c(C#N)cnc3sc(/C=C/C(=O)N4CC[C@@H](N(C)C)C4)cc23)ccc2[nH]ccc12 CHEMBL514533 IC50 180.0 nM
C[C@@H]1CN(c2cccc(C(=O)c3cccnc3N)n2)CCN1 CHEMBL2046634 Ki 182.0 nM
N#Cc1cncc(-c2cccc(OCCN3CCCC3)c2)c1Nc1ccc2[nH]ccc2c1 CHEMBL513162 IC50 190.0 nM
Cc1c(Nc2c(C#N)cncc2-c2cncc(CN3CCN(C)CC3)c2)ccc2[nH]ccc12 CHEMBL567093 IC50 190.0 nM
Cc1c(Nc2c(C#N)cncc2/C=C/c2ccccc2)ccc2c1ccn2C CHEMBL585681 IC50 190.0 nM
Cc1c(Nc2c(C#N)cncc2/C=C/CN2CCCCC2)ccc2[nH]ccc12 CHEMBL596207 IC50 190.0 nM
CC1C(=O)NN=C2COc3cc(C(F)(F)F)c(OC4CNC4)cc3N21 CHEMBL3356468 IC50 190.0 nM
C[C@@H]1C(=O)NN=C2COc3cc(-c4ccccc4F)c([C@H]4CCN(C)CC4(C)C)cc3N21 CHEMBL3355139 IC50 190.0 nM
N#Cc1cccc(-c2c(Cl)[nH]c3ncnc(N4CCC[C@@H](N)C4)c23)c1 CHEMBL5404690 Ki 193.0 nM
COc1cccc(CNC(=O)c2ccc(-c3ccncc3)cc2)c1 CHEMBL2006299 pKi 199.53 nM
CCC1CC(NS(=O)(=O)C2CC2)CC1c1ncc2cnc3[nH]ccc3n12 CHEMBL1992073 pKi 199.53 nM
NCc1cccc(CNc2nc(NCc3ccccc3Cl)ncc2[N+](=O)[O-])c1 CHEMBL391754 IC50 200.0 nM
CN1CCN(Cc2ccc(-c3cc4c(Nc5ccc6[nH]ccc6c5)c(C#N)cnc4s3)cc2)CC1 CHEMBL401611 IC50 200.0 nM
N#Cc1cncc(-c2cccc(OCCN3CCOCC3)c2)c1Nc1ccc2[nH]ccc2c1 CHEMBL468140 IC50 200.0 nM
Cc1c(Nc2c(C#N)cncc2-c2ccccc2CN(C)C)ccc2[nH]ccc12 CHEMBL566868 IC50 200.0 nM
CC(C)(C)Oc1ncncc1CNc1cc(N[C@H]2CC[C@@H](O)CC2)c(C#N)cn1 CHEMBL4878871 IC50 200.0 nM
COc1cccc(CNc2ncc([N+](=O)[O-])c(NCC3CCC(CN)CC3)n2)c1 CHEMBL395160 IC50 210.0 nM
NCC1CCC(CNc2nc(NCc3ccc(F)cc3)ncc2[N+](=O)[O-])CC1 CHEMBL245958 IC50 210.0 nM
CN(C)Cc1ccc2ccc(Cl)c(C3=C(c4c[nH]c5ccccc45)C(=O)NC3=O)c2c1 CHEMBL4102228 IC50 216.0 nM
CN1CCN(c2nc(C3=C(c4c[nH]c5cccc(Cl)c45)C(=O)NC3=O)c3ccccc3n2)CC1 CHEMBL2151407 IC50 221.0 nM
C[C@H]1C[C@@H](N)CN(c2ncnc3[nH]c(Cl)c(-c4cnn(C)c4)c23)C1 CHEMBL5414886 Ki 223.0 nM
Cc1c(C#N)cccc1-c1c(Cl)[nH]c2ncnc(N3C[C@@H](C)C[C@@H](N)C3)c12 CHEMBL5428265 Ki 224.0 nM
N#Cc1cnc2sc(-c3ccccc3)cc2c1Nc1cccc2[nH]ccc12 CHEMBL409274 IC50 230.0 nM
CC1C(=O)NN=C2COc3ccc(NC4CNC4)cc3N21 CHEMBL3356461 IC50 230.0 nM
Nc1ncnc2c1c(-c1cccc(O)c1)cn2[C@H]1C[C@@H](CN2CCC2)C1 CHEMBL3787112 IC50 230.0 nM
Nc1ncccc1C(=O)c1cccc(N2CCN[C@H](c3ccccc3)C2)n1 CHEMBL2046641 Ki 238.0 nM
COc1ccc(-c2cc3c(cc2[C@@H]2CCN(C)C[C@@H]2C)N2C(=NNC(=O)[C@H]2C)CO3)cc1OC CHEMBL3355135 IC50 240.0 nM
CCN1c2cc(-c3c[nH]nc3C)ccc2C(=O)NC1(C)C CHEMBL3799887 IC50 240.0 nM
Cc1c(Nc2c(C#N)cnc3sc(CCC(=O)N4CCCC4)cc23)ccc2[nH]ccc12 CHEMBL476134 IC50 250.0 nM
CC(C)CC1CCCN1c1ccc(F)c(-n2c(=O)[nH]c3ncccc32)n1 CHEMBL4063243 IC50 250.0 nM
CO[C@@H]1[C@H](N(C)C=O)C[C@H]2O[C@]1(C)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)NC4 CHEMBL4744662 IC50 250.0 nM
CCN(CC)CCNC(=O)c1cccc(-n2nc(C(C)(C)C)cc2NC(=O)Nc2cccc3ccccc23)c1 CHEMBL1970290 pKi 251.19 nM
NC(=O)c1ccc2nc(-c3ccc([N+](=O)[O-])o3)cn2c1 CHEMBL1973359 pKi 251.19 nM
Cn1cc(C2=C(c3c(Cl)ccc4ccc(CN5CCC5)cc34)C(=O)NC2=O)c2ccccc21 CHEMBL4089217 IC50 254.0 nM
CN(C)CCCn1cc(C2=C(c3csc4ccccc34)C(=O)NC2=O)c2ccccc21 CHEMBL566424 IC50 255.0 nM
COc1ccc(-c2cncc(C#N)c2Nc2ccc3c(ccn3C)c2C)cc1OC CHEMBL466037 IC50 260.0 nM
CCN1c2cc(-n3c(=O)[nH]c4ncccc43)ccc2C(=O)NC1(C)C CHEMBL3798933 IC50 260.0 nM
C[C@@H]1O[C@@H](n2c3ccccc3c3c4c(c5c6ccccc6[nH]c5c32)CNC4=O)C[C@@H](N)[C@H]1O CHEMBL4214897 IC50 260.0 nM
CN(C)Cc1ccc2ccc(Cl)c(C3=C(c4cn(C)c5ccccc45)C(=O)NC3=O)c2c1 CHEMBL4077967 IC50 263.0 nM
NCC1CCC(CNc2nc(NCCCc3ccccc3)ncc2[N+](=O)[O-])CC1 CHEMBL397397 IC50 270.0 nM
COc1ccc(-c2cncc(C#N)c2N(C)c2ccc3[nH]ccc3c2)cc1OC CHEMBL494229 IC50 270.0 nM
Cn1cc(-c2cnc3c(-c4csc(C(=O)N[C@@H]5CCCC[C@@H]5N)c4)cnn3c2)cn1 CHEMBL4568087 IC50 270.0 nM
CC(=O)N[C@H]1C[C@H]2O[C@@](C)([C@@H]1O)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)NC4 CHEMBL4277459 IC50 270.0 nM
CC(C)[C@@H]1CN(c2cccc(C(=O)c3cccnc3N)n2)CCN1 CHEMBL2046638 Ki 275.0 nM
Cn1cc(C2=C(c3cccc4cc(CN)ccc34)C(=O)NC2=O)c2ccccc21 CHEMBL4072709 IC50 276.0 nM
CC(=O)N[C@@H]1C[C@H](n2c3ccc(O)cc3c3c4c(c5c6ccccc6[nH]c5c32)CNC4=O)O[C@@H](C)[C@@H]1O CHEMBL4287662 IC50 280.0 nM
CCCCCCCCc1cccc2c1CC[C@@H](CO)NC(=O)[C@H](C(C)C)N2C CHEMBL206866 Ki 290.0 nM
CC(C)C[C@H]1CN(c2ccc(OCC(F)(F)F)c(C(=O)c3cccnc3N)n2)CCN1 CHEMBL2046647 Ki 290.0 nM
CS(=O)(=O)Nc1cccc(CC(=O)Nc2nc(-c3c[nH]c4ncccc34)cs2)c1 CHEMBL4249925 Ki 290.0 nM
CC1(C)NC(=O)c2ccc(-n3c(=O)[nH]c4ncccc43)cc2N1CCc1ccccc1 CHEMBL3800116 IC50 300.0 nM
N#Cc1cnc(NCc2cnccc2C(F)(F)F)cc1NC[C@H]1C[C@@H](O)C1 CHEMBL4878438 IC50 300.0 nM
CC1(C)[C@H](O)C[C@@H]1Nc1nc(NCc2cnccc2C(F)(F)F)ncc1C#N CHEMBL4875806 IC50 300.0 nM
CN1CCN(Cc2ccc3ccc(Cl)c(C4=C(c5cn(C)c6ccccc56)C(=O)NC4=O)c3c2)CC1 CHEMBL4068028 IC50 314.0 nM
CN1CCN(c2nc(C3=C(c4c[nH]c5ccccc45)C(=O)NC3=O)c3ccc(Cl)cc3n2)CC1 CHEMBL2153756 IC50 316.0 nM
CC(Nc1cncc(-n2cnc3ccc(C#N)cc32)n1)c1ccccc1F CHEMBL1977138 pKi 316.23 nM
O=C1Nc2cc(-c3ccc(O)cc3)ccc2C1=Cc1ccc[nH]1 CHEMBL1980329 pKi 316.23 nM
COc1cccc(C(C)NC(=O)c2ccc(-c3ccncc3)s2)c1 CHEMBL1994724 pKi 316.23 nM
CN1CCN(c2ccc(Nc3nc(N)c(C(=O)c4c(Cl)cccc4Cl)s3)cc2)CC1 CHEMBL1989043 pKi 316.23 nM
COCCOc1cc(-c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2)ccc1OC CHEMBL467524 IC50 320.0 nM
C[C@H]1C(=O)NN=C2COc3cc(C(F)(F)F)c(NC4CNC4)cc3N21 CHEMBL3356475 IC50 320.0 nM
N#Cc1ccc(N2CC[C@@H](Nc3c(C(N)=O)cnc4[nH]ccc34)[C@@H](F)C2)nc1 CHEMBL3593777 IC50 320.0 nM
CO[C@H]1CC[C@H](CNc2cc(NCc3cnccc3C(F)(F)F)ncc2C#N)CC1 CHEMBL4850753 IC50 330.0 nM
CN1CC[C@H](c2c(O)cc(O)c3c(=O)cc(-c4ccccc4Cl)oc23)[C@H](O)C1 CHEMBL428690 Kd 350.0 nM
CCCN(CCC)S(=O)(=O)c1ccc(/C=C/c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)cc1 CHEMBL1079904 IC50 350.0 nM
CN(CCN)c1nc(-c2ccncc2)cc2cnccc12 CHEMBL2147540 IC50 350.0 nM
N#Cc1cnc(NCc2cnccc2C(F)(F)F)cc1N[C@H]1CC[C@H](O)CC1 CHEMBL4870017 IC50 350.0 nM
NCCNc1cc(-c2ccncc2)cc2cnccc12 CHEMBL2147534 IC50 355.0 nM
CCCCCCCCCCCN1c2ccccc2C[C@@H](CO)OC(=O)[C@@H]1C(C)C CHEMBL102991 Ki 358.0 nM
Cc1cc2cc(Nc3c(C#N)cncc3/C=C/c3ccccc3)ccc2[nH]1 CHEMBL569203 IC50 360.0 nM
CC1CN(c2ccncc2NC(=O)c2ccnn3cc(-c4ccccc4)nc23)CCO1 CHEMBL5270781 IC50 360.0 nM
Cc1c(Nc2c(C#N)cnc3sc(/C=C/C(=O)NN4CCCC4)cc23)ccc2[nH]ccc12 CHEMBL515456 IC50 370.0 nM
COC1=C(C)O[C@@H]2C[C@@]1(OC)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)NC4 CHEMBL4784365 IC50 370.0 nM
CN1CCCN(c2cccc(C(=O)c3cccnc3N)n2)CC1 CHEMBL2046625 Ki 375.0 nM
Cc1cc2c(cc1NC1CNC1)N1C(=NNC(=O)[C@@H]1C)CO2 CHEMBL3356471 IC50 390.0 nM
Cc1cccc(Nc2nc(NC3CCCCC3N)cnc2C(N)=O)c1 CHEMBL1974328 pKi 398.11 nM
CN1c2ccc(N)cc2C(c2ccccc2)c2cc(N)ccc21 CHEMBL1991734 pKi 398.11 nM
COc1c(-c2nc3ccccc3[nH]2)c(O)cc2oc(C)cc(=O)c12 CHEMBL1972355 pKi 398.11 nM
NCC1CCC(CNc2nc(NCc3cc(Cl)cc(Cl)c3)ncc2[N+](=O)[O-])CC1 CHEMBL394113 IC50 400.0 nM
COc1ccc(Nc2c(C#N)cncc2-c2ccc(OC)c(OC)c2)cc1 CHEMBL522677 IC50 400.0 nM
CO[C@@H]1[C@H](N(C)C(N)=O)C[C@H]2O[C@]1(C)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)NC4 CHEMBL4794799 IC50 400.0 nM
N#Cc1cnc(NCc2cnccc2C(F)(F)F)cc1NCC1CCOCC1 CHEMBL4853079 IC50 400.0 nM
Cc1c(Nc2c(C#N)cncc2/C=C/c2ccc(S(=O)(=O)N(C(C)C)C(C)C)cc2)ccc2[nH]ccc12 CHEMBL1079376 IC50 410.0 nM
CN(c1ccc2[nH]ccc2c1)c1c(C#N)cncc1/C=C/c1ccccc1 CHEMBL576233 IC50 440.0 nM
NCCCCCNc1nc(NCc2ccccc2Cl)ncc1[N+](=O)[O-] CHEMBL246366 IC50 450.0 nM
N#Cc1cnc2sc(-c3ccc(CN4CCOCC4)cc3)cc2c1Nc1ccc2[nH]ccc2c1 CHEMBL257819 IC50 450.0 nM
N#Cc1cnc(NCc2cncnc2C(F)(F)F)cc1N[C@H]1CC[C@@H](O)CC1 CHEMBL4851228 IC50 450.0 nM
NCC1CCC(CNc2nc(N[C@@H]3CCc4ccccc43)ncc2[N+](=O)[O-])CC1 CHEMBL246550 IC50 460.0 nM
COc1ccc(-c2cncc(C#N)c2Nc2cc(Cl)ccc2Cl)cc1OC CHEMBL495139 IC50 470.0 nM
N#Cc1cccc(-c2c[nH]c3ncnc(N4CCC[C@@H](N)C4)c23)c1 CHEMBL5417963 Ki 478.0 nM
CO[C@@H]1[C@@H](O)C[C@H]2O[C@]1(C)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)NC4 CHEMBL4763267 IC50 480.0 nM
CC(C)(N)CNc1nc(-c2ccnc(N)c2)cc2cnccc12 CHEMBL2147548 IC50 496.0 nM
NCC1CCC(CNc2nc(NCc3ccccc3)ncc2[N+](=O)[O-])CC1 CHEMBL247571 IC50 500.0 nM
N#Cc1cnc(NCc2cnccc2C(F)(F)F)cc1N[C@H]1C[C@@H](O)C1 CHEMBL4861260 IC50 500.0 nM
NC(Cc1c[nH]c2ccccc12)C(=O)Nc1cncc(C=Cc2ccncc2)c1 CHEMBL1983945 pKi 501.19 nM
Nc1ncnc2c1c(-c1cnc3[nH]ccc3c1)nn2C1CCCC1 CHEMBL1081312 pKi 501.19 nM
CC(C)Oc1cc(Nc2nc(NC(C)c3ccc(F)cn3)ncc2Cl)n[nH]1 CHEMBL2007421 pKi 501.19 nM
CCN(CCN)C(=O)c1cccc(-n2nc(C(C)(C)C)cc2NC(=O)Nc2cccc3ccccc23)c1 CHEMBL2004637 pKi 501.19 nM
COC(=O)[C@@]1(OC)C[C@H]2O[C@]1(C)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)NC4 CHEMBL4745823 IC50 520.0 nM
COC(=O)[C@@]1(O)C[C@H]2O[C@]1(C)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)NC4 CHEMBL281948 IC50 530.0 nM
CO[C@H]1C(=O)C[C@H]2O[C@]1(C)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)NC4 CHEMBL4793766 IC50 560.0 nM
CN(C)Cc1ccccc1-c1cc2c(Nc3ccc4[nH]ccc4c3)c(C#N)cnc2s1 CHEMBL253755 IC50 570.0 nM
Nc1ncc(-c2ccccc2C(F)(F)F)nc1C(=O)Nc1cnccc1N1CCCC(N)C1 CHEMBL3949162 IC50 590.0 nM
C[C@]12O[C@H](C[C@@H](O)[C@H]1O)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)CNC4=O CHEMBL4763012 IC50 600.0 nM
Cn1nccc1-c1ccc(C(=O)N[C@@H]2CNCC[C@H]2c2ccc(F)c(F)c2)c(F)c1 CHEMBL4556790 IC50 629.0 nM
O=S(=O)(c1cccc2cnccc12)N1CCCNCC1 CHEMBL38380 pKi 630.96 nM
NC(=O)c1cc2c(-c3ccc(Br)cc3)cncc2s1 CHEMBL1978195 pKi 630.96 nM
CC(C)(C)Nc1ncnc2[nH]cc(-c3ccccc3)c12 CHEMBL1995211 pKi 630.96 nM
COc1cccc(C(C)NC(=O)c2cnc(-c3ccncc3)nc2)c1 CHEMBL2003514 pKi 630.96 nM
O=C1NC(=O)c2c1c(-c1ccccc1Cl)cc1[nH]c3ccc(O)cc3c21 CHEMBL379975 pKi 630.96 nM
CCCC(=O)Nc1cccc(-c2nc(Nc3ccc4[nH]ncc4c3)c3cc(OCCN4CCCC4)ccc3n2)c1 CHEMBL1968705 pKi 630.96 nM
NCC1CCC(CNc2nc(Nc3cccc(Cl)c3)ncc2C(F)(F)F)CC1 CHEMBL247376 IC50 640.0 nM
NCC1CCC(CNc2nc(Nc3cc(Cl)cc(Cl)c3)ncc2[N+](=O)[O-])CC1 CHEMBL394069 IC50 680.0 nM
N#Cc1cncc(/C=C/c2ccccc2)c1Oc1ccc2[nH]ccc2c1 CHEMBL568973 IC50 690.0 nM
C[C@@H]1C(=O)NN=C2COc3cc(C(F)(F)F)c(N(C)C4(C)CN(C)C4)cc3N21 CHEMBL3355115 IC50 700.0 nM
N#Cc1cnc(NCc2cnccc2C(F)(F)F)cc1NC[C@H]1C[C@H](O)C1 CHEMBL4858809 IC50 700.0 nM
Cc1nc(Nc2ncc(C(=O)Nc3c(C)cccc3Cl)s2)cc(N2CCN(CCO)CC2)n1 CHEMBL5416410 Kd apparent 711.0 nM
CN1CCN(Cc2ccccc2-c2cc3c(Nc4ccc5[nH]ccc5c4)c(C#N)cnc3s2)CC1 CHEMBL256318 IC50 730.0 nM
Cc1cnccc1-c1cc2cnccc2c(NCC(C)(C)N)n1 CHEMBL2147552 IC50 738.0 nM
COc1ccc(-c2cncc(C#N)c2Nc2cccc3cc[nH]c23)cc1OC CHEMBL511716 IC50 740.0 nM
OCCNc1nc(-c2ccncc2)cc2cnccc12 CHEMBL2147545 IC50 743.0 nM
NCC1CCN(c2cccc(C(=O)c3cccnc3N)n2)C1 CHEMBL2046628 Ki 745.0 nM
C[C@H]1C(=O)NN=C2COc3cc(-c4ccccc4)c(NC4CNC4)cc3N21 CHEMBL3356473 IC50 760.0 nM
c1cc2c(N3CCNCC3)nc(-c3ccc4[nH]ncc4c3)nc2cn1 CHEMBL3338839 IC50 785.0 nM
COc1cc(N2CCC(N3CCN(C)CC3)CC2)ccc1Nc1ncc(Cl)c(Nc2ccccc2S(=O)(=O)C(C)C)n1 CHEMBL509032 pKi 794.33 nM
CC(C)(C)c1nc2c3ccc(F)cc3c3c(=O)[nH]ccc3c2[nH]1 CHEMBL21156 pKi 794.33 nM
C=CCn1c(=O)c2cnc(Nc3ccc(N4CCN(C)CC4)cc3)nc2n1-c1cccc(C(C)(C)O)n1 CHEMBL1976040 pKi 794.33 nM
Oc1cc(O)cc(C=Cc2ccc(O)c(O)c2)c1 CHEMBL1972346 pKi 794.33 nM
N#Cc1ccc(-c2ccncc2)cc1NCc1ccccc1 CHEMBL1967992 pKi 794.33 nM
CN1CCN(c2ccc(-c3cnc4c(c3)N(Cc3cc(Cl)ccc3C(F)(F)F)CCN4)cn2)CC1 CHEMBL1164180 pKi 794.33 nM
CCC(=O)Nc1ccc(C(=O)N2CCNCC2)c(O)c1 CHEMBL1988141 pKi 794.33 nM
COc1ncncc1CNc1cc(N[C@H]2CC[C@@H](O)CC2)c(C#N)cn1 CHEMBL4873015 IC50 800.0 nM
CCc1c(Nc2c(C#N)cnc3sc(-c4ccccc4)cc23)ccc2[nH]ccc12 CHEMBL256739 IC50 830.0 nM
O=C1NC(=O)C2=C1c1cn(c3ccccc13)CCOCCOCCOCCn1cc2c2cccnc21 CHEMBL340935 IC50 835.0 nM
CO[C@H]1NC(=O)c2c1c1c3ccccc3n3c1c1c2c2ccccc2n1[C@@H]1O[C@@]3(C)[C@H](OC)[C@@H](O)[C@H]1O CHEMBL4749940 IC50 890.0 nM
COc1ccc(-c2cncc(C#N)c2Nc2ccc(C)cc2)cc1OC CHEMBL523688 IC50 900.0 nM
N#Cc1cnc(NCc2cnccc2C(F)(F)F)cc1N[C@H]1C[C@H](O)C1 CHEMBL4865377 IC50 900.0 nM
N#Cc1cnc(NCc2cnccc2C(F)(F)F)cc1NC1CCOCC1 CHEMBL4861249 IC50 900.0 nM
Cc1ccc(C)c(CNc2ncc([N+](=O)[O-])c(NCC3CCC(CN)CC3)n2)c1 CHEMBL245914 IC50 910.0 nM
COc1cc(Nc2c(C#N)cnc3cc(OCCCN4CCN(C)CC4)c(OC)cc23)c(Cl)cc1Cl CHEMBL288441 Kd 910.0 nM
CO[C@@H]1[C@H](N(C)C(=O)c2ccccc2)C[C@H]2O[C@]1(C)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)NC4 CHEMBL608533 Kd 920.0 nM
CCN1c2cc(-c3cn[nH]c3)ccc2C(=O)NC1(C)C CHEMBL3798888 IC50 930.0 nM
NCCOc1nc(-c2ccncc2)cc2cnccc12 CHEMBL2147536 IC50 948.0 nM
CC(C)(N)CNc1nc(-c2ccc3[nH]ncc3c2)nc2cnccc12 CHEMBL3338838 IC50 995.0 nM
CNCCNc1nc(-c2ccncc2)cc2cnccc12 CHEMBL2147541 IC50 997.0 nM