CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nc(N4CCOCC4)cc4ccccc34)cnc2N)CC1 CHEMBL3892099 IC50 0.13 nM
Nc1ncc(-c2nc(N3CCOCC3)ncc2C(F)(F)F)nc1C(=O)Nc1ncccc1N1CCC(N)CC1 CHEMBL3984070 IC50 0.13 nM
Nc1ncc(-c2cccc(N3CCOCC3)c2)nc1C(=O)Nc1ncccc1N1CCC(N)CC1 CHEMBL3932204 IC50 0.13 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nc(C4=CCOCC4)ncc3C(F)(F)F)cnc2N)CC1 CHEMBL3958761 IC50 0.13 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nc(N4CCOCC4)nc4ccccc34)cnc2N)CC1 CHEMBL3984009 IC50 0.13 nM
Nc1ncc(-c2cccc3[nH]c(C(F)(F)F)cc23)nc1C(=O)Nc1ncccc1N1CCC(N)CC1 CHEMBL3951893 IC50 0.13 nM
Nc1ncc(-c2cc(N3CCOCC3)ccc2C(F)(F)F)nc1C(=O)Nc1ncccc1N1CCC(N)CC1 CHEMBL3980746 IC50 0.13 nM
CN(C)c1ccc(C(F)(F)F)c(-c2cnc(N)c(C(=O)Nc3ncccc3N3CCC(N)CC3)n2)n1 CHEMBL3943147 IC50 0.13 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nc(N4CCC(F)(F)CC4)ncc3F)cnc2N)CC1 CHEMBL3970090 IC50 0.13 nM
Cn1ccc2c(-c3cnc(N)c(C(=O)Nc4ncccc4N4CCC(N)CC4)n3)cccc21 CHEMBL3983009 IC50 0.13 nM
Nc1ncc(-c2cccc3[nH]ncc23)nc1C(=O)Nc1ncccc1N1CCC(N)CC1 CHEMBL3957715 IC50 0.13 nM
Nc1ncc(-c2nc(N3CCOCC3)nc3ccc(F)cc23)nc1C(=O)Nc1ncccc1N1CCC(N)CC1 CHEMBL3958917 IC50 0.13 nM
Cc1cc2c(-c3cnc(N)c(C(=O)Nc4ncccc4N4CCC(N)CC4)n3)cccc2[nH]1 CHEMBL3969856 IC50 0.13 nM
Nc1ncc(-c2nc(N3CCOCC3)ccc2C(F)(F)F)nc1C(=O)Nc1ncccc1N1CCC(N)CC1 CHEMBL3966643 IC50 0.13 nM
Nc1ncc(-c2cccc3[nH]ccc23)nc1C(=O)Nc1ncccc1N1CCC(N)CC1 CHEMBL3982497 IC50 0.13 nM
Nc1ncc(-c2nc(N3CCOCC3)cc3ccccc23)nc1C(=O)Nc1ncccc1N1CCC(N)CC1 CHEMBL3966595 IC50 0.13 nM
Nc1ncc(-c2cc(N3CCOCC3)cc(C(F)(F)F)c2)nc1C(=O)Nc1ncccc1N1CCC(N)CC1 CHEMBL3893533 IC50 0.13 nM
Nc1ncc(-c2nc(N3CCOCC3)ccc2C(F)(F)F)nc1C(=O)Nc1ncccc1N1CCC(N)(CO)CC1 CHEMBL3920517 IC50 0.13 nM
Nc1ncc(-c2ccccc2F)nc1C(=O)Nc1cnccc1N1CCC(N)CC1 CHEMBL3895998 IC50 0.13 nM
Nc1ncc(-c2ccccc2)nc1C(=O)Nc1cnccc1N1CCC(N)CC1 CHEMBL3963605 IC50 0.13 nM
CC1=CC23C(=O)[C@@H](C=C(CO)[C@@H](O)[C@]2(O)[C@H]1OC(=O)c1ccccc1)[C@H]1[C@@H](C[C@H]3C)C1(C)C CHEMBL46094 Ki 0.14 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nc(N4CCOCC4)ncc3F)cnc2N)CC1 CHEMBL3945647 IC50 0.14 nM
Nc1ncc(-c2ccccc2)nc1C(=O)Nc1ccccc1N1CCC(N)CC1 CHEMBL3943813 IC50 0.15 nM
CCOCC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3ncccc3OC(F)(F)F)cnc2N)CC1 CHEMBL3987185 IC50 0.16 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3cc(N4CCOCC4)ccc3C(F)(F)F)cnc2N)CC1 CHEMBL3970893 IC50 0.17 nM
Nc1ncc(-c2cccc(N3CCOCC3)n2)nc1C(=O)Nc1ncccc1N1CCC(N)CC1 CHEMBL3976541 IC50 0.19 nM
COc1ccc(-c2cnc(N)c(C(=O)Nc3cnccc3N3CCC(N)CC3)n2)cc1 CHEMBL3942619 IC50 0.19 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 Ki 0.2 nM
Nc1ncc(-c2nc(N3CCC3)ccc2C(F)(F)F)nc1C(=O)Nc1ncccc1N1CCC(N)CC1 CHEMBL3957149 IC50 0.2 nM
Nc1ncc(-c2ncccc2OC(F)(F)F)nc1C(=O)Nc1ncccc1N1CCC(N)(CO)CC1 CHEMBL3901073 IC50 0.22 nM
Nc1ncc(-c2nc(N3CCOCC3)ccc2C(F)(F)F)nc1C(=O)Nc1ncccc1N1C[C@@H]2CO[C@H](C1)[C@H]2N CHEMBL4115475 IC50 0.24 nM
Nc1ncc(-c2ncccc2OC(F)(F)F)nc1C(=O)Nc1ncccc1N1CCC(N)CC1 CHEMBL3915489 IC50 0.25 nM
Nc1ncc(-c2ncccc2OC(F)(F)F)nc1C(=O)Nc1ncccc1N1CC[C@@H](N)[C@@H](F)C1 CHEMBL3960459 IC50 0.25 nM
Nc1ncc(-c2cc3ccccc3c(N3CCOCC3)n2)nc1C(=O)Nc1ncccc1N1CCC(N)(CO)CC1 CHEMBL3912038 IC50 0.25 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 0.26 nM
C[C@H](CO)Nc1ccc(C(F)(F)F)c(-c2cnc(N)c(C(=O)Nc3ncccc3N3CCC(C)(N)CC3)n2)n1 CHEMBL4109540 IC50 0.26 nM
Cn1ncc2c(-c3cnc(N)c(C(=O)Nc4ncccc4N4CCC(N)CC4)n3)ncnc21 CHEMBL3967547 IC50 0.27 nM
CC(C)[C@H]1C(=O)N[C@H](CO)Cc2cc(NC(=O)CCCCCCCCCCCCC(=O)Nc3ccc4c(c3)N(C)[C@@H](C(C)C)C(=O)N[C@H](CO)C4)ccc2N1C CHEMBL337834 Kd 0.28 nM
Nc1ncc(-c2ccnc(N3CCOCC3)n2)nc1C(=O)Nc1ncccc1N1CCC(N)CC1 CHEMBL3975977 IC50 0.29 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nc(N4CCOCC4)ncc3C(F)(F)F)cnc2N)CC1 CHEMBL3893839 IC50 0.3 nM
Nc1ncc(-c2ncccc2OC(F)(F)F)nc1C(=O)Nc1ncccc1N1CCC(N)C(F)C1 CHEMBL3946659 IC50 0.3 nM
CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)NC4 CHEMBL388978 IC50 0.305 nM
C[C@H]1COCCN1c1ccc(C(F)(F)F)c(-c2cnc(N)c(C(=O)Nc3ncccc3N3CCC(C)(N)CC3)n2)n1 CHEMBL3893246 IC50 0.32 nM
Nc1ncc(-c2ncnc3[nH]cc(F)c23)nc1C(=O)Nc1ncccc1N1CCC(N)CC1 CHEMBL3904204 IC50 0.33 nM
Nc1ncc(-c2ncccc2F)nc1C(=O)Nc1ncccc1N1CCC(N)CC1 CHEMBL3950697 IC50 0.33 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nc(N)ncc3Cl)cnc2N)CC1 CHEMBL3907088 IC50 0.35 nM
COC1CN(c2cccnc2NC(=O)c2nc(-c3ncccc3OC(F)(F)F)cnc2N)CCC1N CHEMBL3965722 IC50 0.36 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 0.4 nM
Cc1cccc2c(C3=C(c4nc(N5CCN(C)CC5)nc5ccccc45)C(=O)NC3=O)c[nH]c12 CHEMBL2151411 IC50 0.4 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nc(C4CC4)ccc3C(F)(F)F)cnc2N)CC1 CHEMBL3908251 IC50 0.4 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3ncccc3C#N)cnc2N)CC1 CHEMBL3942560 IC50 0.4 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nc(C(N)=O)ncc3F)cnc2N)CC1 CHEMBL3937993 IC50 0.4 nM
Nc1ncc(-c2ncnc3c2CCCC3)nc1C(=O)Nc1ncccc1N1CCC(N)CC1 CHEMBL3909349 IC50 0.43 nM
Nc1ncc(-c2nc(C(F)(F)F)ccc2C(F)(F)F)nc1C(=O)Nc1ncccc1N1CCC(N)CC1 CHEMBL3909775 IC50 0.46 nM
CCC/C=C/C=C/C(=O)O[C@H]1/C(=C/C(=O)OC)C[C@H]2C[C@H]([C@@H](C)O)OC(=O)C[C@H](O)C[C@@H]3C[C@H](OC(C)=O)C(C)(C)[C@](O)(C[C@@H]4C/C(=C/C(=O)OC)C[C@H](/C=C/C(C)(C)[C@]1(O)O2)O4)O3 CHEMBL449158 Ki 0.48 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nc(C#N)ncc3C(F)(F)F)cnc2N)CC1 CHEMBL3977690 IC50 0.48 nM
CCCCCCCCc1ccc2c3c(c[nH]c13)C[C@@H](CO)NC(=O)[C@H](C(C)C)N2C CHEMBL285801 Ki 0.5 nM
O=C1NC(=O)C(c2c[nH]c3ccccc23)=C1c1nc(N2CCNCC2)nc2ccccc12 CHEMBL1996510 IC50 0.5 nM
Nc1ncc(-c2nc(N3CCOCC3)ccc2C(F)(F)F)nc1C(=O)Nc1ncccc1N1C[C@H]2CC[C@@H](C1)[C@@H]2N CHEMBL3928145 IC50 0.5 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nccc(Cl)c3C(F)(F)F)cnc2N)CC1 CHEMBL3921551 IC50 0.5 nM
CN(C)Cc1ccc2ccc(Cl)c(C3=C(c4c[nH]c5ccccc45)C(=O)NC3=O)c2c1 CHEMBL4102228 IC50 0.5 nM
CNCc1ccc2ccc(Cl)c(C3=C(c4cn(C)c5ccccc45)C(=O)NC3=O)c2c1 CHEMBL4072879 IC50 0.5 nM
CC1CN(c2ccc(C(F)(F)F)c(-c3cnc(N)c(C(=O)Nc4ncccc4N4CCC(C)(N)CC4)n3)n2)CCO1 CHEMBL3939304 IC50 0.51 nM
COc1ccnc(-c2cnc(N)c(C(=O)Nc3ncccc3N3CCC(N)(CC#N)CC3)n2)c1C#N CHEMBL3928668 IC50 0.53 nM
CCCCC(=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)CCCC CHEMBL346228 Ki 0.54 nM
COc1ccnc(-c2cnc(N)c(C(=O)Nc3ncccc3N3CCC(C)(N)CC3)n2)c1F CHEMBL3891166 IC50 0.55 nM
CN(C)c1ccc(C(F)(F)F)c(-c2cnc(N)c(C(=O)Nc3ncccc3N3CCC(C)(N)CC3)n2)n1 CHEMBL3919379 IC50 0.55 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nc(N4CCOCC4)ccc3C(F)(F)F)cnc2N)CC1 CHEMBL3968875 IC50 0.57 nM
CCC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3ncccc3OC(F)(F)F)cnc2N)CC1 CHEMBL3905583 IC50 0.6 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nccc(OC(F)(F)F)c3C#N)cnc2N)CC1 CHEMBL3919287 IC50 0.6 nM
COc1ccc(C(F)(F)F)c(-c2cnc(N)c(C(=O)Nc3ncccc3N3CCC(C)(N)CC3)n2)n1 CHEMBL3981769 IC50 0.63 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nc(C4CC(F)(F)C4)ccc3C(F)(F)F)cnc2N)CC1 CHEMBL3970381 IC50 0.68 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3ncccc3Cl)cnc2N)CC1 CHEMBL3892736 IC50 0.7 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nccc(C#N)c3C(F)(F)F)cnc2N)CC1 CHEMBL3889877 IC50 0.8 nM
Nc1ncc(-c2ccccc2F)nc1C(=O)Nc1cnccc1N1CCNCC1 CHEMBL3957649 IC50 0.8 nM
Nc1ncc(-c2ncnc3sccc23)nc1C(=O)Nc1ncccc1N1CCC(N)CC1 CHEMBL3924825 IC50 0.84 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nc(NCCO)ccc3C(F)(F)F)cnc2N)CC1 CHEMBL3922907 IC50 0.84 nM
N#Cc1cccnc1-c1cnc(N)c(C(=O)Nc2ncccc2N2CCC(N)(CO)CC2)n1 CHEMBL3928682 IC50 0.85 nM
COCC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3ncccc3F)cnc2N)CC1 CHEMBL3919244 IC50 0.86 nM
CCC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3ncccc3F)cnc2N)CC1 CHEMBL3975025 IC50 0.86 nM
Nc1ncc(-c2ncccc2F)nc1C(=O)Nc1ncccc1N1CCC(N)(CCO)CC1 CHEMBL3933423 IC50 0.88 nM
C[C@@H]1COCCN1c1ccc(C(F)(F)F)c(-c2cnc(N)c(C(=O)Nc3ncccc3N3CCC(C)(N)CC3)n2)n1 CHEMBL4113858 IC50 0.89 nM
CN1CCN(c2cc(C3=C(c4c[nH]c5ccccc45)C(=O)NC3=O)c3ccccc3c2)CC1 CHEMBL568580 IC50 0.9 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3ncccc3OC(F)(F)F)cnc2N)CC1 CHEMBL3954062 IC50 0.9 nM
Cc1nc(-c2cnc(N)c(C(=O)Nc3ncccc3N3CCC(C)(N)CC3)n2)c2cc(F)ccc2n1 CHEMBL3959314 IC50 0.9 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nc(N4C5CCC4COC5)ccc3C(F)(F)F)cnc2N)CC1 CHEMBL3915095 IC50 0.94 nM
CN1CCN(c2nc(C3=C(c4c[nH]c5ccccc45)C(=O)NC3=O)c3ccccc3n2)CC1 CHEMBL565612 IC50 0.95 nM
COc1ccnc(-c2cnc(N)c(C(=O)Nc3ncccc3N3CCC(C)(N)CC3)n2)c1C#N CHEMBL3933598 IC50 0.97 nM
O=C1Nc2ccccc2/C1=C/c1c[nH]nc1-c1ccccc1[N+](=O)[O-] CHEMBL2347053 IC50 0.98 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nccc(C#N)c3F)cnc2N)CC1 CHEMBL3943631 IC50 0.99 nM
CN1CCN(c2nc(C3=C(c4c[nH]c5ccccc45)C(=O)NC3=O)c3cc(F)ccc3n2)CC1 CHEMBL2153750 IC50 1.0 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 1.0 nM
Nc1ncc(-c2csc(N3CCOCC3)n2)nc1C(=O)Nc1ncccc1N1CCC(N)CC1 CHEMBL3914252 IC50 1.0 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nccc(OC4CC4)c3C#N)cnc2N)CC1 CHEMBL3963597 IC50 1.0 nM
CN(C)Cc1ccc2ccc(Cl)c(C3=C(c4cn(C)c5ccccc45)C(=O)NC3=O)c2c1 CHEMBL4077967 Ki 1.0 nM
CCOc1ccnc(-c2cnc(N)c(C(=O)Nc3ncccc3N3CCC(C)(N)CC3)n2)c1F CHEMBL3912781 IC50 1.1 nM
CCCCCCCC/C=C1\CC([C@H](CO)OC(=O)CCCCCCCC)OC1=O CHEMBL108303 Ki 1.202 nM
Nc1ncc(-c2ncccc2C(F)(F)F)nc1C(=O)Nc1ncccc1N1CCC(N)CC1 CHEMBL3890986 IC50 1.3 nM
COc1ccnc(-c2cnc(N)c(C(=O)Nc3ncccc3N3CCC(C)(N)CC3)n2)c1C(F)(F)F CHEMBL3899197 IC50 1.3 nM
CCOc1ccnc(-c2cnc(N)c(C(=O)Nc3ncccc3N3CCC(C)(N)CC3)n2)c1C(F)(F)F CHEMBL3967601 IC50 1.3 nM
COc1ccnc(-c2cnc(N)c(C(=O)Nc3ncccc3N3CCC(N)(CO)CC3)n2)c1C#N CHEMBL3925357 IC50 1.3 nM
CN1CCN(c2cc3ccccc3c(C3=C(c4c[nH]c5ccccc45)C(=O)NC3=O)n2)CC1 CHEMBL2153748 IC50 1.4 nM
Cn1cc(C2=C(c3nc(N4CCNCC4)nc4ccccc34)C(=O)NC2=O)c2ccccc21 CHEMBL2151415 IC50 1.4 nM
CC(C)CC(C/C=C1/C[C@@](CO)(COC(=O)C(C)(C)C)OC1=O)CC(C)C CHEMBL203524 Ki 1.45 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3ncnc4ccc(F)cc34)cnc2N)CC1 CHEMBL3916984 IC50 1.5 nM
COC(=O)/C=C1/C[C@H]2C[C@]3(O)O[C@H](C[C@@H](O)CC(=O)O[C@@H]([C@@H](C)O)C[C@@H]4C/C(=C\C(=O)OC)C[C@@](O)(O4)C(C)(C)/C=C/[C@@H](C1)O2)C[C@H](OC(=O)C(C)(C)C)C3(C)C CHEMBL501262 Ki 1.56 nM
CN1CCN(c2nc(C3=C(c4c[nH]c5ccccc45)C(=O)NC3=O)c3cc(Cl)ccc3n2)CC1 CHEMBL2153751 IC50 1.7 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3ncccc3F)cnc2N)CC1 CHEMBL3896642 IC50 1.7 nM
CCCCCCCC/C=C1/CC([C@H](CO)OC(=O)CCCCCCCC)OC1=O CHEMBL109630 Ki 1.758 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nccc4ccc(Cl)cc34)cnc2N)CC1 CHEMBL3968031 IC50 1.8 nM
CC(C)Oc1ccnc(-c2cnc(N)c(C(=O)Nc3ncccc3N3CCC(C)(N)CC3)n2)c1C#N CHEMBL3935341 IC50 1.8 nM
CN(C)Cc1ccc2c(C3=C(c4c[nH]c5ccccc45)C(=O)NC3=O)c(Cl)ccc2c1 CHEMBL4085837 IC50 1.8 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3ncccc3C(F)(F)F)cnc2N)CC1 CHEMBL3982723 IC50 1.9 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nc(C#N)ccc3F)cnc2N)CC1 CHEMBL3918138 IC50 1.9 nM
Nc1ncc(-c2ncccc2C(F)(F)F)nc1C(=O)Nc1ncccc1N1CCC(N)(CCO)CC1 CHEMBL3935905 IC50 1.9 nM
Cn1c2ccccc2c2c3c(c4c5ccccc5n(CCC#N)c4c21)CNC3=O CHEMBL302449 IC50 2.0 nM
C[C@@H](CO)Nc1ccc(C(F)(F)F)c(-c2cnc(N)c(C(=O)Nc3ncccc3N3CCC(C)(N)CC3)n2)n1 CHEMBL3892068 IC50 2.0 nM
CCC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3ncccc3C(F)(F)F)cnc2N)CC1 CHEMBL3920740 IC50 2.1 nM
CN(C)CCOc1cc(C2=C(c3c[nH]c4ccccc34)C(=O)NC2=O)c2ccccc2c1 CHEMBL565632 IC50 2.2 nM
CCCCCCCCCC(=O)OCC1(CO)C/C(=C/CC(C(C)C)C(C)C)C(=O)O1 CHEMBL111625 Ki 2.3 nM
CCCCCCCCCC(=O)OCC1(CO)C/C(=C/CC(C)C)C(=O)O1 CHEMBL110779 Ki 2.3 nM
CN(C)CCCn1cc(C2=C(c3c[nH]c4ccccc34)C(=O)NC2=O)c2ccccc21 CHEMBL7463 IC50 2.3 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nccc4ccc(F)cc34)cnc2N)CC1 CHEMBL3896330 IC50 2.3 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nc(OCCO)ccc3C(F)(F)F)cnc2N)CC1 CHEMBL3889579 IC50 2.3 nM
N#CCCn1c2ccccc2c2c3c(c4c5ccccc5[nH]c4c21)C(=O)NC3 CHEMBL292746 INH 2.3 nM
CCCCCCCCCCCCCC(=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(C)=O CHEMBL279115 Ki 2.5 nM
CC(C)C(C/C=C1\CC(CO)(COC(=O)CC(C(C)C)C(C)C)OC1=O)C(C)C CHEMBL137288 Ki 2.7 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3ncccc3OC(F)(F)F)cnc2N)CC1F CHEMBL3918192 IC50 2.7 nM
CC(C)NCc1ccc2ccc(Cl)c(C3=C(c4cn(C)c5ccccc45)C(=O)NC3=O)c2c1 CHEMBL4083319 IC50 2.7 nM
CC(C)C/C=C1\CC(CO)(COC(=O)CC(CC(C)C)CC(C)C)OC1=O CHEMBL3393748 Ki 2.78 nM
COCCNCc1ccc2ccc(Cl)c(C3=C(c4cn(C)c5ccccc45)C(=O)NC3=O)c2c1 CHEMBL4101316 IC50 2.8 nM
CC(C)C(C/C=C1/CC(CO)(COC(=O)CC(C(C)C)C(C)C)OC1=O)C(C)C CHEMBL290876 Ki 2.89 nM
CC(C)CC(C/C=C1/CC(CO)(COC(=O)C(C)(C)C)OC1=O)CC(C)C CHEMBL96766 Ki 2.9 nM
CC(C)C/C=C1/CC(CO)(COC(=O)CC(C)C)OC1=O CHEMBL108145 Ki 2.9 nM
CC(C)CC(C/C=C1/CC(O)(COC(=O)C(C)(C)C)OC1=O)CC(C)C CHEMBL597015 Ki 2.9 nM
CCCCCCCCCOCCCCCCC/C=C1\CC(CO)(COC(=O)C(C)(C)C)OC1=O CHEMBL596818 Ki 3.2 nM
CC(C)CC(C/C=C1\CC(CO)(COC(=O)C(C)(C)C)OC1=O)CC(C)C CHEMBL137386 Ki 3.25 nM
COCC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3ncccc3OC(F)(F)F)cnc2N)CC1 CHEMBL3932525 IC50 3.4 nM
Cn1cc(C2=C(c3c(Cl)ccc4ccc(CN5CCC5)cc34)C(=O)NC2=O)c2ccccc21 CHEMBL4089217 IC50 3.4 nM
CCCCCCOC(=O)/C=C/[C@]1(CO)C/C(=C/CC(C(C)C)C(C)C)C(=O)O1 CHEMBL355787 Ki 3.5 nM
CCCCCCCC(=O)OC[C@]1(CO)C/C(=C/CC(C(C)C)C(C)C)C(=O)O1 CHEMBL3085534 Ki 3.5 nM
CN1CCN(c2cc(C3=C(c4c[nH]c5ccccc45)C(=O)NC3=O)c3ccccc3n2)CC1 CHEMBL2153747 IC50 3.6 nM
Cc1cccc2nc(N3CCN(C)CC3)nc(C3=C(c4c[nH]c5ccccc45)C(=O)NC3=O)c12 CHEMBL2153749 IC50 3.6 nM
CCOc1ccnc(-c2cnc(N)c(C(=O)Nc3ncccc3N3CCC(C)(N)CC3)n2)c1C#N CHEMBL3927615 IC50 3.6 nM
CN(C)Cc1ccc2c(C3=C(c4cn(C)c5ccccc45)C(=O)NC3=O)c(Cl)ccc2c1 CHEMBL4064291 IC50 3.7 nM
CCCCCC(=O)OCC1(CO)C/C(=C/CC(CC(C)C)CC(C)C)C(=O)O1 CHEMBL383615 Ki 3.78 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 4.05 nM
Nc1ncc(-c2ncccc2OC(F)(F)F)nc1C(=O)Nc1ncccc1N1CCC(N)(COC(F)F)CC1 CHEMBL3981979 IC50 4.2 nM
CCCCC/C=C/C/C=C/CCCCCCCC(=O)OCC1(CO)C/C(=C\CC(C)C)C(=O)O1 CHEMBL3393741 Ki 4.33 nM
COCCCCCCCCCCCCCCC/C=C1\CC(CO)(COC(=O)C(C)(C)C)OC1=O CHEMBL598454 Ki 4.4 nM
N#CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3ncccc3OC(F)(F)F)cnc2N)CC1 CHEMBL3905625 IC50 4.4 nM
CC(C)CC(C/C=C1\CC(CO)(COC(=O)CC(C(C)C)C(C)C)OC1=O)CC(C)C CHEMBL138171 Ki 4.46 nM
CN1CCN(c2nc(C3=C(c4c[nH]c5ccccc45)C(=O)NC3=O)c3ccc(F)cc3n2)CC1 CHEMBL2153755 IC50 4.5 nM
CC(C)CC(CC(C)C)C(=O)OCC1(CO)C/C(=C\c2ccccn2)C(=O)O1 CHEMBL530110 Ki 4.6 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 4.7 nM
Cn1cc(C2=C(c3c(Cl)ccc4ccc(CN)cc34)C(=O)NC2=O)c2ccccc21 CHEMBL4089665 IC50 4.7 nM
CC(C)C/C=C1/CC(CO)(COC(=O)CC(CC(C)C)CC(C)C)OC1=O CHEMBL230048 Ki 4.74 nM
COC1CN(c2ccc(C(F)(F)F)c(-c3cnc(N)c(C(=O)Nc4ncccc4N4CCC(C)(N)CC4)n3)n2)C1 CHEMBL3952413 IC50 4.8 nM
CC(C)CC(C/C=C1\CC(CO)(CN(O)C(=O)C(C)(C)C)OC1=O)CC(C)C CHEMBL135779 Ki 4.81 nM
COC(=O)/C=C1/C[C@H]2C[C@]3(O)O[C@H](C[C@@H](O)CC(=O)O[C@@H]([C@@H](C)O)C[C@@H]4C/C(=C/C(=O)OC)C[C@@](O)(O4)C(C)(C)/C=C/[C@@H](C1)O2)C[C@H](OC(=O)C(C)(C)C)C3(C)C CHEMBL505767 Ki 4.82 nM
Cc1ccc(N2CCC(N)CC2)c(NC(=O)c2nc(-c3ncccc3OC(F)(F)F)cnc2N)n1 CHEMBL3903385 IC50 4.9 nM
Cc1ccnc(-c2cnc(N)c(C(=O)Nc3ncccc3N3CCC(C)(N)CC3)n2)c1F CHEMBL3935812 IC50 4.9 nM
CCCCCCCC(=O)OCC1(CO)C/C(=C/CC(CC(C)C)CC(C)C)C(=O)O1 CHEMBL206332 Ki 4.97 nM
CCCCCCCCC/C=C1/CC(CO)(COC(=O)C2CCCCC2)OC1=O CHEMBL210746 Ki 5.0 nM
COCCCCCCCCCCCCCCC/C=C1/CC(CO)(COC(=O)C(C)(C)C)OC1=O CHEMBL597632 Ki 5.0 nM
COc1cnc(-c2cnc(N)c(C(=O)Nc3ncccc3N3CCC(C)(N)CC3)n2)c(C(F)(F)F)c1 CHEMBL3928191 IC50 5.1 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nc(N4CC(O)C4)ccc3C(F)(F)F)cnc2N)CC1 CHEMBL3933646 IC50 5.2 nM
C#Cc1ccc(C#Cc2ccc(C(=O)OCC3(CO)CC(=C(C)C)C(=O)O3)cc2)cc1 CHEMBL223747 Ki 5.23 nM
CC(C)CC(C/C=C1/CC(CO)(CN(O)C(=O)C(C)(C)C)OC1=O)CC(C)C CHEMBL94505 Ki 5.42 nM
CCCCC/C=C1\CC(CO)(COC(=O)CC(C(C)C)C(C)C)OC1=O CHEMBL172433 Ki 5.5 nM
CC(C)[C@H]1C(=O)N[C@H](CO)Cc2cc(NC(=O)/C=C/C=C/c3cc(C(F)(F)F)cc(C(F)(F)F)c3)ccc2N1C CHEMBL330952 Ki 5.6 nM
CCCCCCn1cc2c3c(cccc31)N(C)[C@@H](C(C)C)C(=O)N[C@H](CO)C2 CHEMBL399981 Ki 5.8 nM
COc1ccc(C#Cc2ccc(C#Cc3ccc(C(=O)OCC4(CO)CC(=C(C)C)C(=O)O4)cc3)cc2)cc1 CHEMBL221332 Ki 5.88 nM
CCCCCC(=O)OCC1(CO)C/C(=C/CC(C(C)C)C(C)C)C(=O)O1 CHEMBL368346 Ki 5.9 nM
CCCCCCCC(=O)OC[C@]1(CO)C/C(=C\CC(C(C)C)C(C)C)C(=O)O1 CHEMBL3085533 Ki 5.9 nM
Nc1ncc(-c2ncccc2C(F)(F)F)nc1C(=O)Nc1ncccc1N1CCC(N)(CO)CC1 CHEMBL3968672 IC50 5.9 nM
CC(C)=C1CC(CO)(COC(=O)c2ccc(C#Cc3ccc(C)cc3)cc2)OC1=O CHEMBL522428 Ki 6.0 nM
CCCCCCCC(=O)OCC1(CO)C/C(=C\CC(CC(C)C)CC(C)C)C(=O)O1 CHEMBL383708 Ki 6.04 nM
CCCCCC(=O)OCC1(CO)C/C(=C\CC(CC(C)C)CC(C)C)C(=O)O1 CHEMBL203521 Ki 6.18 nM
CCOCC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3ncccc3C(F)(F)F)cnc2N)CC1 CHEMBL3914762 IC50 6.3 nM
CC(C)c1c2cc(-c3ccnc(Nc4ccc5c(N6CCN(C)CC6)ccnc5c4)n3)ccc2nn1C CHEMBL4856177 IC50 6.3 nM
CC(C)(C)C(=O)OCC1(CO)C/C(=C\CCCCCCCCCCCCCCC=O)C(=O)O1 CHEMBL603450 Ki 6.38 nM
CC(C)(C)C(=O)OCC1(CO)C/C(=C\CCCCCCCCCCCCCCCO)C(=O)O1 CHEMBL596828 Ki 6.4 nM
CN1CCN(c2nc(C3=C(c4cn(C)c5ccccc45)C(=O)NC3=O)c3ccccc3n2)CC1 CHEMBL2151412 IC50 6.4 nM
O=C(N[C@@H]1CNCCC[C@H]1OC(=O)c1cc(O)c(C(=O)c2c(O)cccc2C(=O)O)c(O)c1)c1ccc(O)cc1 CHEMBL60254 Kd 6.4 nM
CCCCCCCCCC(=O)OCC1(CO)C/C(=C\CC(C(C)C)C(C)C)C(=O)O1 CHEMBL171577 Ki 6.6 nM
CC(C)CC(C/C=C1/CC(CO)(COC(=O)c2ccccc2)OC1=O)CC(C)C CHEMBL382784 Ki 6.66 nM
COC(=O)CCCCCCCCCCCCCC/C=C1\CC(CO)(COC(=O)C(C)(C)C)OC1=O CHEMBL597490 Ki 6.83 nM
CC(C)CC(C/C=C1/CC(CO)(COC(=O)CC(C(C)C)C(C)C)OC1=O)CC(C)C CHEMBL137597 Ki 6.87 nM
CC(C)CC(C/C=C1/CC(CO)(COC(=O)CC(CC(C)C)CC(C)C)OC1=O)CC(C)C CHEMBL203607 Ki 6.88 nM
COc1ccc(/C=C2\CC(CO)(COC(=O)CC(C(C)C)C(C)C)OC2=O)cc1 CHEMBL209666 Ki 7.0 nM
CCCCC/C=C/C/C=C/CCCCCCCC(=O)OCC1(CO)C/C(=C/CC(C)C)C(=O)O1 CHEMBL3393654 Ki 7.05 nM
CN1CCN(c2cccc(C3=C(c4c[nH]c5ccccc45)C(=O)NC3=O)c2)CC1 CHEMBL585500 IC50 7.1 nM
CCCCCCCCCCCCC/C=C1/CC(CO)(COC(=O)C(C)(C)C)OC1=O CHEMBL608439 Ki 7.15 nM
CCCCC/C=C\C/C=C\CCCCCCC/C=C1/CC(CO)(COC(=O)C(C)(C)C)OC1=O CHEMBL3393753 Ki 7.2 nM
CCCCC/C=C1/CC(CO)(COC(=O)CC(C(C)C)C(C)C)OC1=O CHEMBL425676 Ki 7.3 nM
COCC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3ncccc3C(F)(F)F)cnc2N)CC1 CHEMBL3961086 IC50 7.4 nM
CCCCCCCCCOCCC/C=C1\CC(CO)(COC(=O)C(C)(C)C)OC1=O CHEMBL599274 Ki 7.44 nM
Cc1ccc2nc(N3CCN(C)CC3)nc(C3=C(c4c[nH]c5ccccc45)C(=O)NC3=O)c2c1 CHEMBL2153752 IC50 7.5 nM
CCCC(CCC)C(=O)OCC1(CO)C/C(=C\c2ccc3ccn(C)c3c2)C(=O)O1 CHEMBL3289013 Ki 7.5 nM
CC(C)CCOCCCCCCC/C=C1\CC(CO)(COC(=O)C(C)(C)C)OC1=O CHEMBL604180 Ki 7.74 nM
CC(C)[C@H]1C(=O)N[C@H](CO)Cc2cc(NC(=O)CCCCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)ccc2N1C CHEMBL333323 Ki 7.8 nM
CCCCCCCCCCCCC/C=C1\CC(CO)(COC(=O)C(C)(C)C)OC1=O CHEMBL598861 Ki 7.83 nM
CC(C)C(C/C=C1/CC(CO)(COC(=O)C2CCCCC2)OC1=O)C(C)C CHEMBL208618 Ki 8.0 nM
CC(C)(C)C(=O)OCC1(CO)C/C(=C\CCCCCCCCCCCCCCCOC=O)C(=O)O1 CHEMBL597491 Ki 8.0 nM
CCCCCOCCCCCCC/C=C1\CC(CO)(COC(=O)C(C)(C)C)OC1=O CHEMBL597633 Ki 8.1 nM
COCCCCCCCCCCC/C=C1\CC(CO)(COC(=O)C(C)(C)C)OC1=O CHEMBL598453 Ki 8.2 nM
CC(C)(C)C(=O)OCC1(CO)C/C(=C/CCCCCCCCCCCCCCCO)C(=O)O1 CHEMBL596829 Ki 8.24 nM
CC(=O)NCCCCCCCCCCCCCCC/C=C1\CC(CO)(COC(=O)C(C)(C)C)OC1=O CHEMBL597826 Ki 8.25 nM
CCCC(CCC)C(=O)OCC1(CO)C/C(=C\c2ccc3c(ccn3C)c2)C(=O)O1 CHEMBL3289012 Ki 8.25 nM
CCCCC/C=C\C/C=C\CCCCCCC/C=C1\CC(CO)(COC(=O)C(C)(C)C)OC1=O CHEMBL3393754 Ki 8.26 nM
CN1CCN(c2nc(C3=C(c4c[nH]c5ccc(Cl)cc45)C(=O)NC3=O)c3ccccc3n2)CC1 CHEMBL2151408 IC50 8.3 nM
CCCCCCC#CC#CCCCCCCCC(=O)OCC1(CO)C/C(=C\CC(C)C)C(=O)O1 CHEMBL3393752 Ki 8.31 nM
CC(C)C(C/C=C1/CC(CO)(COC(=O)C(C)(C)C)OC1=O)C(C)C CHEMBL137701 Ki 8.32 nM
CCCCCC(=O)OCC1(CO)C/C(=C\C=C(C(C)C)C(C)C)C(=O)O1 CHEMBL173821 Ki 8.4 nM
CN1CCN(c2nc(C3=C(c4c[nH]c5cc(Cl)ccc45)C(=O)NC3=O)c3ccccc3n2)CC1 CHEMBL2151409 IC50 8.5 nM
CCCCCCCCC#CCCCCCCCC(=O)OCC1(CO)C/C(=C\CC(C)C)C(=O)O1 CHEMBL3393750 Ki 8.7 nM
CC(C)C(CC(=O)OCC1(CO)C/C(=C\CCc2ccccc2)C(=O)O1)C(C)C CHEMBL210666 Ki 9.0 nM
CCCCCCCCC/C=C1\CC(CO)(COC(=O)C2CCCCC2)OC1=O CHEMBL379945 Ki 9.0 nM
CCCCCCCCC/C=C1/CC(CO)(COC(=O)c2ccccc2)OC1=O CHEMBL110256 Ki 9.0 nM
CN1CCN(c2nc(C3=C(c4c[nH]c5c(Cl)cccc45)C(=O)NC3=O)c3ccccc3n2)CC1 CHEMBL2151410 IC50 9.1 nM
CC(C)[C@H]1C(=O)N[C@H](CO)Cc2cc(NC(=O)CCCCc3ccc(CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)cc3)ccc2N1C CHEMBL123244 Ki 9.2 nM
CC(=O)OCCCCCCCCCCCCCCC/C=C1\CC(CO)(COC(=O)C(C)(C)C)OC1=O CHEMBL597893 Ki 9.3 nM
COCCC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3ncccc3C(F)(F)F)cnc2N)CC1 CHEMBL3964163 IC50 9.3 nM
CCCCCCCCC/C=C1\CC(CO)(COC(=O)CC(C(C)C)C(C)C)OC1=O CHEMBL369061 Ki 9.5 nM
CCCCCCC#CC#CCCCCCCCC(=O)OCC1(CO)C/C(=C/CC(C)C)C(=O)O1 CHEMBL3393751 Ki 9.8 nM
O=C(N[C@@H]1C[C@H](CO)C[C@H]1OC(=O)c1cc(O)c(C(=O)c2c(O)cccc2C(=O)O)c(O)c1)c1ccc(O)cc1 CHEMBL75661 IC50 10.0 nM
O=C(N[C@H]1C[C@H](CO)C[C@H]1OC(=O)c1cc(O)c(C(=O)c2c(O)cccc2C(=O)O)c(O)c1)c1ccc(O)cc1 CHEMBL306427 IC50 10.0 nM
CC(C)C(C/C=C1\CC(CO)(COC(=O)C2CCCCC2)OC1=O)C(C)C CHEMBL380039 Ki 10.0 nM
CC(C)C[C@H]1CN(c2ccc(-c3ccccc3)c(C(=O)c3cccnc3N)n2)CCN1 CHEMBL2046649 Ki 10.0 nM
CC(C)(C)C(=O)OCC1(CO)C/C(=C\CCCCCCCOC2CCCC2)C(=O)O1 CHEMBL599273 Ki 10.2 nM
CCCCCC1CC1CC1CC1CCCCCCCC(=O)OCC1(CO)C/C(=C\CC(C)C)C(=O)O1 CHEMBL3393743 Ki 10.2 nM
CC(C)(C)C(=O)OCCCCCCCCCCCCCCC/C=C1\CC(CO)(COC(=O)C(C)(C)C)OC1=O CHEMBL597696 Ki 10.5 nM
CC(C)[C@H]1C(=O)N[C@H](CO)Cc2c[nH]c3cccc(c23)N1C CHEMBL27266 Ki 10.96 nM
CC(C)CC(=O)OCC1(CO)C/C(=C/CC(C(C)C)C(C)C)C(=O)O1 CHEMBL38724 Ki 11.0 nM
CCCCCCCC[C@@H]1C(=O)N[C@H](CO)C[C@]2(C)CC(CCCC)(CCCC)CC[C@@H]12 CHEMBL51313 Ki 11.0 nM
CCCCCC(=O)OCC1(CO)C/C(=C\CC(C(C)C)C(C)C)C(=O)O1 CHEMBL367682 Ki 11.0 nM
CCCCCCCC/C=C\CCCCCCC/C=C1/C[C@](/C=C/C(=O)OC)(CO)OC1=O CHEMBL170120 Ki 11.0 nM
CCCCCCCC/C=C\CCCCCCCC/C=C1/C[C@](/C=C/C(=O)OC)(CO)OC1=O CHEMBL422468 Ki 11.0 nM
CN(C)CCCn1nc(C2=C(c3cn(-c4cnc5ccccc5c4)c4ccccc34)C(=O)NC2=O)c2ccccc21 CHEMBL359486 IC50 11.0 nM
CC(C)n1cc(C2=C(c3nc(N4CCN(C)CC4)nc4ccccc34)C(=O)NC2=O)c2ccccc21 CHEMBL2151413 IC50 11.0 nM
Nc1ncc(-c2ncccc2C(F)(F)F)nc1C(=O)Nc1ncccc1N1CCC(N)(COC(F)F)CC1 CHEMBL3971305 IC50 11.0 nM
CC(C)[C@H]1C(=O)N[C@H](CO)Cc2cc(NC(=O)/C=C/C=C/c3ccc(/C=C/C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)cc3)ccc2N1C CHEMBL123355 Ki 11.2 nM
CC(C)C(C/C=C1\CC(CO)(COC(=O)C(C)(C)C)OC1=O)C(C)C CHEMBL136760 Ki 11.25 nM
CC(C)(C)C(=O)OCC1(CO)C/C(=C/CCCCCCCCCCCCCCC=O)C(=O)O1 CHEMBL597082 Ki 11.4 nM
C#Cc1ccc(C#Cc2ccc(C#Cc3ccc(C(=O)OCC4(CO)CC(=C(C)C)C(=O)O4)cc3)cc2)cc1 CHEMBL223570 Ki 11.6 nM
CC(C)[C@H]1C(=O)N[C@H](CO)Cc2cc(NC(=O)/C=C/C=C/c3ccc(C(F)(F)F)cc3)ccc2N1C CHEMBL331344 Ki 11.9 nM
CCCCCC(=O)OCC1(CO)C/C(=C/C=C(C(C)C)C(C)C)C(=O)O1 CHEMBL172715 Ki 12.0 nM
CCCCCCCC/C=C\CCCCCCC/C=C1/C[C@@](CO)(COC(C)=O)OC1=O CHEMBL116029 Ki 12.0 nM
CCCCCCCC/C=C\CCCCCCCC/C=C1/C[C@@](CO)(COC(C)=O)OC1=O CHEMBL342430 Ki 12.0 nM
COc1cccc(/C=C2\CC(CO)(COC(=O)CC(C(C)C)C(C)C)OC2=O)c1 CHEMBL377577 Ki 12.0 nM
CC(C)C(CC(=O)OCC1(CO)C/C(=C\c2ccccc2)C(=O)O1)C(C)C CHEMBL378783 Ki 12.0 nM
N#CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3ncccc3C(F)(F)F)cnc2N)CC1 CHEMBL3942617 IC50 12.0 nM
CC(C)[C@H]1C(=O)N[C@H](CO)Cc2cc(NC(=O)CCCCc3ccc(C(F)(F)F)cc3)ccc2N1C CHEMBL123159 Ki 12.5 nM
CCCCCCCCC#CCCCCCCCC(=O)OCC1(CO)C/C(=C/CC(C)C)C(=O)O1 CHEMBL3393749 Ki 12.6 nM
CCCC(CCC)C(=O)OCC1(CO)C/C(=C\c2cccc3ccn(C)c23)C(=O)O1 CHEMBL3289014 Ki 12.9 nM
CCCC(CCC)C(=O)OCC1(CO)C/C(=C\c2cn(C)c3ccccc23)C(=O)O1 CHEMBL519741 Ki 12.9 nM
CCCCCCCCC/C=C1/CC(CO)(COC(=O)CC(C(C)C)C(C)C)OC1=O CHEMBL107614 Ki 13.0 nM
CCCCCCCC/C=C\CCCCCCC/C=C1\C[C@@](CO)(COC(C)=O)OC1=O CHEMBL119303 Ki 13.0 nM
CCCCCCCCC/C=C1/CC(CO)(COC(=O)CC(C)C)OC1=O CHEMBL108479 Ki 13.0 nM
CCCCCCCC/C=C\CCCCCCCC/C=C1\C[C@@](CO)(COC(C)=O)OC1=O CHEMBL138351 Ki 13.0 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 13.0 nM
COCc1ccnc(-c2cnc(N)c(C(=O)Nc3ncccc3N3CCC(C)(N)CC3)n2)c1C(F)(F)F CHEMBL3949255 IC50 13.0 nM
CCCCCC1OC1CC1OC1CCCCCCCC(=O)OCC1(CO)C/C(=C\CC(C)C)C(=O)O1 CHEMBL3393745 Ki 13.2 nM
CC(C)(C)C(=O)OCC1(CO)C/C(=C\c2ccc(Cl)cc2)C(=O)O1 CHEMBL4160361 Ki 13.6 nM
CCCC(CCC)C(=O)OCC1(CO)C/C(=C\c2cnc3ccccc3c2)C(=O)O1 CHEMBL488872 Ki 13.8 nM
CCCCCCCC(=O)O[C@H]1/C(=C/C(=O)OC)C[C@H]2C[C@@H](O)[C@@H](C)OC(=O)C[C@H](O)C[C@@H]3C[C@H](OC(C)=O)C(C)(C)[C@](O)(CCOC(=O)/C=C/C(C)(C)[C@]1(O)O2)O3 CHEMBL3581528 Ki 13.8 nM
CC(C)C(CC(=O)OCC1(CO)C/C(=C\Cc2ccccc2)C(=O)O1)C(C)C CHEMBL209779 Ki 14.0 nM
CCCCCCCCC/C=C1\CC(CO)(COC(=O)c2ccccc2)OC1=O CHEMBL209140 Ki 14.0 nM
CCCCCCC/C=C1/CC(CO)(COC(=O)CCc2ccccc2)OC1=O CHEMBL209013 Ki 14.0 nM
C[C@@]1(N)CCN(c2cccnc2NC(=O)c2nc(-c3ncccc3OC(F)(F)F)cnc2N)C[C@@H]1F CHEMBL3943074 IC50 14.0 nM
O=C1OC(CO)(COC(=O)c2ccccc2)C/C1=C/c1ccc(-c2ccccc2)cc1 CHEMBL112543 Ki 14.1 nM
CC(C)(C)C(=O)OCC1(CO)C/C(=C\CCCCCCCCCCCO)C(=O)O1 CHEMBL596827 Ki 14.5 nM
CCCCCCCCC#Cc1ccc2c(c1)C[C@@H](CO)NC(=O)[C@H](C(C)C)N2C CHEMBL6453 Ki 14.7 nM
CC(C)CC(CC(C)C)C(=O)OCC1(CO)C/C(=C\c2cn(C)c3ccccc23)C(=O)O1 CHEMBL488667 Ki 14.8 nM
CN(C)CCOc1cccc(C2=C(c3c[nH]c4ccccc34)C(=O)NC2=O)c1 CHEMBL566853 IC50 15.0 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 15.0 nM
CC(C)C/C=C1/CC(CO)(COC(=O)CC(C(C)C)C(C)C)OC1=O CHEMBL291104 Ki 15.1 nM
CC(C)C/C=C1\CC(CO)(COC(=O)CC(C(C)C)C(C)C)OC1=O CHEMBL39488 Ki 15.1 nM
CCCCCC1CC1CC1CC1CCCCCCCC(=O)OCC1(CO)C/C(=C/CC(C)C)C(=O)O1 CHEMBL3393742 Ki 15.4 nM
CC(C)(C)C(=O)OCC1(CO)C/C(=C\CCCCCCCCCCCCCCCN=[N+]=[N-])C(=O)O1 CHEMBL597697 Ki 15.6 nM
CC(C)Cn1cc(/C=C2\CC(CO)(COC(=O)C(C)(C)C)OC2=O)c2ccccc21 CHEMBL4167900 Ki 15.6 nM
CC(C)[C@H]1C(=O)N[C@H](CO)Cc2cc(NC(=O)/C=C/C=C/c3ccccc3)ccc2N1C CHEMBL333240 Ki 15.8 nM
COC(=O)COc1ccc(C#Cc2ccc(C#Cc3ccc(C(=O)OCC4(CO)CC(=C(C)C)C(=O)O4)cc3)cc2)cc1 CHEMBL221289 Ki 15.8 nM
CCCCCCCCCC(=O)OCC1(CO)CC(=C(C)C)C(=O)O1 CHEMBL413585 Ki 15.9 nM
COc1ccccc1/C=C1\CC(CO)(COC(=O)CC(C(C)C)C(C)C)OC1=O CHEMBL379822 Ki 16.0 nM
CC(C)C(C/C=C1/CC(CO)(COC(=O)c2ccccc2)OC1=O)C(C)C CHEMBL210495 Ki 16.0 nM
CC(C)CC(C/C=C1\CC(CO)(COC(=O)c2ccccc2)OC1=O)CC(C)C CHEMBL380661 Ki 16.1 nM
CCCCCC1OC1CC1OC1CCCCCCCC(=O)OCC1(CO)C/C(=C/CC(C)C)C(=O)O1 CHEMBL3393744 Ki 16.5 nM
CCCC[C@@H]1C(=O)N[C@H](CO)C[C@]2(C)CC(CCCC)(CCCC)CC[C@@H]12 CHEMBL50717 Ki 17.0 nM
CC(C)C(CC(=O)OCC1(CO)C/C(=C\c2cccc(O)c2)C(=O)O1)C(C)C CHEMBL206889 Ki 17.0 nM
CCCCCC/C=C1/CC(CO)(COC(=O)CCCc2ccccc2)OC1=O CHEMBL209830 Ki 17.0 nM
CC(C)[C@H]1C(=O)N[C@H](CO)Cc2coc3cccc(c23)N1C CHEMBL348378 Ki 17.3 nM
CCCC(CCC)C(=O)OCC1(CO)C/C(=C\c2cccc3c2ccn3C)C(=O)O1 CHEMBL3289011 Ki 17.8 nM
CC(C)CC(C/C=C1/CC(/C=C/C(=O)OC(C)(C)C)(CO)OC1=O)CC(C)C CHEMBL204134 Ki 18.0 nM
COc1ccc(C(=O)OCC2(CO)C/C(=C/CC(C(C)C)C(C)C)C(=O)O2)cc1 CHEMBL209938 Ki 18.0 nM
CCCCCCC/C=C1\CC(CO)(COC(=O)CCc2ccccc2)OC1=O CHEMBL377690 Ki 18.0 nM
CC(C)=C1CC(CO)(COC(=O)c2ccc(C#Cc3ccc(C#Cc4ccc(OCCOCCOCCOC(=O)N(CC(=O)OC(C)(C)C)CC(=O)OC(C)(C)C)cc4)cc3)cc2)OC1=O CHEMBL1162941 Ki 18.3 nM
CCCC(=O)OCC1(CO)C/C(=C/CC(C(C)C)C(C)C)C(=O)O1 CHEMBL170464 Ki 19.0 nM
CCCCCCCC/C=C\CCCCCCC/C=C1/C[C@](/C=C2\CCOC2=O)(CO)OC1=O CHEMBL344379 Ki 19.0 nM
CC(C)C(CC(=O)OCC1(CO)C/C(=C\c2ccc(O)cc2)C(=O)O1)C(C)C CHEMBL380645 Ki 19.0 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nccc(CO)c3C(F)(F)F)cnc2N)CC1 CHEMBL3926882 IC50 19.0 nM
CCCCCCCCC/C=C1/CC(CO)(COC(=O)c2ccc(-c3ccccc3)cc2)OC1=O CHEMBL109354 Ki 19.1 nM
CC(C)=C1CC(CO)(COC(=O)CCCOc2ccc(C#Cc3ccc(C)cc3)cc2)OC1=O CHEMBL489520 Ki 19.5 nM
CCCCCCC/C=C\CCCCCCC/C=C1\C[C@](/C=C/C(=O)OC)(CO)OC1=O CHEMBL173130 Ki 20.0 nM
CCCCCCCC/C=C\CCCCCCCC/C=C1\C[C@](/C=C/C(=O)OC)(CO)OC1=O CHEMBL139409 Ki 20.0 nM
N[C@@H]1C[C@@H](NC(=O)c2ccc(O)cc2)[C@H](OC(=O)c2cc(O)c(C(=O)c3c(O)cccc3C(=O)O)c(O)c2)C1 CHEMBL432168 IC50 20.0 nM
NC[C@H]1C[C@@H](NC(=O)c2ccc(O)cc2)[C@H](OC(=O)c2cc(O)c(C(=O)c3c(O)cccc3C(=O)O)c(O)c2)C1 CHEMBL307708 IC50 20.0 nM
NC[C@@H]1C[C@@H](NC(=O)c2ccc(O)cc2)[C@H](OC(=O)c2cc(O)c(C(=O)c3c(O)cccc3C(=O)O)c(O)c2)C1 CHEMBL308263 IC50 20.0 nM
CO[C@@H](CC[C@H](C)[C@H]1O[C@@]23CC(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 CHEMBL282159 Ki 20.0 nM
CN(C)CCCn1cc(C2=C(c3cn(C)c4ccccc34)C(=O)NC2=O)c2ccccc21 CHEMBL268769 IC50 20.0 nM
NC[C@@H]1C[C@H](NC(=O)c2ccc(O)cc2)[C@H](OC(=O)c2cc(O)c(C(=O)c3c(O)cccc3C(=O)O)c(O)c2)C1 CHEMBL67290 IC50 20.0 nM
N[C@@H]1C[C@H](NC(=O)c2ccc(O)cc2)[C@H](OC(=O)c2cc(O)c(C(=O)c3c(O)cccc3C(=O)O)c(O)c2)C1 CHEMBL417051 IC50 20.0 nM
NC[C@H]1C[C@H](NC(=O)c2ccc(O)cc2)[C@H](OC(=O)c2cc(O)c(C(=O)c3c(O)cccc3C(=O)O)c(O)c2)C1 CHEMBL421866 IC50 20.0 nM
CN1CCN(Cc2ccc3ccc(Cl)c(C4=C(c5cn(C)c6ccccc56)C(=O)NC4=O)c3c2)CC1 CHEMBL4068028 IC50 20.0 nM
CC(C)=C1CC(CO)(COC(=O)CCOc2ccc(C#Cc3ccc(C)cc3)cc2)OC1=O CHEMBL492118 Ki 20.8 nM
CCCCC1(CCCC)CC[C@H]2[C@H](C)C(=O)N[C@H](CO)C[C@]2(C)C1 CHEMBL52263 Ki 21.0 nM
Nc1ncc(-c2ncccc2C(F)(F)F)nc1C(=O)Nc1ncccc1N1CCC(N)(CCO)C(F)C1 CHEMBL3900688 IC50 21.0 nM
COC(=O)/C=C1/C[C@H]2C[C@]3(O)O[C@H](C[C@@H](O)CC(=O)O[C@H](C)[C@H](O)C[C@@H]4C[C@@H]5CC(=O)O[C@@]5(O4)C(=O)C(C)(C)/C=C/[C@@H](C1)O2)C[C@H](OC(=O)C(C)(C)C)C3(C)C CHEMBL3581527 Ki 21.2 nM
Cc1ccc(-c2cn(CC3(CO)C/C(=C\CC(CC(C)C)CC(C)C)C(=O)O3)nn2)cc1 CHEMBL5078146 Ki 21.3 nM
O=C(N[C@@H]1CNC[C@H]1OC(=O)c1cc(O)c(C(=O)c2c(O)cccc2C(=O)O)c(O)c1)c1ccc(O)cc1 CHEMBL59828 IC50 22.0 nM
O=C(NC1CNC[C@@H]1OC(=O)c1cc(O)c(C(=O)c2c(O)cccc2C(=O)O)c(O)c1)c1ccc(O)cc1 CHEMBL422056 IC50 22.0 nM
O=C(NC1CNCC1OC(=O)c1cc(O)c(C(=O)c2c(O)cccc2C(=O)O)c(O)c1)c1ccc(O)cc1 CHEMBL265559 IC50 22.0 nM
O=C(N[C@@H]1CNCC1OC(=O)c1cc(O)c(C(=O)c2c(O)cccc2C(=O)O)c(O)c1)c1ccc(O)cc1 CHEMBL177635 IC50 22.0 nM
CC(C)C(CC(=O)OCC1(CO)C/C(=C\c2ccccc2O)C(=O)O1)C(C)C CHEMBL209308 Ki 22.0 nM
CN(C)C[C@H]1CCn2c(c(C3=C(c4cn(C)c5ccccc45)C(=O)NC3=O)c3ccccc32)C1 CHEMBL26501 IC50 22.0 nM
O=C1OC(CO)(COC(=O)c2ccc(-c3ccccc3)cc2)C/C1=C/c1ccc(-c2ccccc2)cc1 CHEMBL442009 Ki 22.7 nM
COc1ccccc1C(=O)OCC1(CO)C/C(=C/CC(C(C)C)C(C)C)C(=O)O1 CHEMBL206786 Ki 23.0 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nccc(Oc4ccccc4)c3C#N)cnc2N)CC1 CHEMBL3891200 IC50 23.0 nM
CN(C)C[C@@H]1CCn2cc(c3ccccc32)C2=C(C(=O)NC2=O)c2cn(c3ccccc23)CCO1 CHEMBL91829 Kd apparent 23.0 nM
CC(C)CC(C/C=C1\CC(CO)(COC(=O)C(C)(C)C)OC1=S)CC(C)C CHEMBL370130 Ki 23.7 nM
CCC/C=C1/CC(CO)(COC(=O)CC(C(C)C)C(C)C)OC1=O CHEMBL173516 Ki 24.0 nM
CCCCCCCC/C=C\CCCCCCC/C=C1/CC(CO)(COC(C)=O)OC1=O CHEMBL321823 Ki 24.0 nM
CCCCCCC/C=C/CCCCCCC/C=C1/CC(CO)(COC(C)=O)OC1=O CHEMBL278654 Ki 24.0 nM
CCCCCCCC/C=C\CCCCCCC/C=C1\CC(CO)(COC(C)=O)OC1=O CHEMBL94718 Ki 24.0 nM
COc1cccc(C(=O)OCC2(CO)C/C(=C/CC(C(C)C)C(C)C)C(=O)O2)c1 CHEMBL208417 Ki 24.0 nM
CCCCCCCCCCCCCCCCC/C=C1/CC(=O)OC1(CO)COC(=O)C(C)(C)C CHEMBL3393758 Ki 24.5 nM
O=C1OC(CO)(COC(=O)c2ccc(Cl)cc2)C/C1=C\c1ccc(Cl)cc1 CHEMBL4172461 Ki 25.2 nM
CN(C)c1ccc(/C=C2\CC(CO)(COC(=O)c3ccc(Cl)cc3)OC2=O)cc1 CHEMBL4167589 Ki 25.4 nM
CCCCn1cc(/C=C2\CC(CO)(COC(=O)C(C)(C)C)OC2=O)c2ccccc21 CHEMBL4160540 Ki 25.65 nM
CCCCCCCC/C=C1/CC(CO)(COC(=O)c2ccccc2)OC1=O CHEMBL111711 Ki 25.7 nM
CCCCCCCC/C=C\CCCCCCC/C=C1\C[C@](/C=C2\CCOC2=O)(CO)OC1=O CHEMBL138352 Ki 26.0 nM
CCCCCC1CC1CC1CC1CCCCCCC/C=C1\CC(CO)(COC(=O)C(C)(C)C)OC1=O CHEMBL3393756 Ki 26.7 nM
N=C(N)SCCCn1cc(C2=C(Nc3ccccc3)C(=O)NC2=O)c2ccccc21 CHEMBL540357 IC50 27.0 nM
CCCCCC/C=C1\CC(CO)(COC(=O)CCCc2ccccc2)OC1=O CHEMBL210432 Ki 27.0 nM
COc1ccc(C(=O)OCC2(CO)C/C(=C\c3ccc(Cl)cc3)C(=O)O2)cc1 CHEMBL4175934 Ki 27.6 nM
CCC/C=C1\CC(CO)(COC(=O)CC(C(C)C)C(C)C)OC1=O CHEMBL440555 Ki 28.0 nM
CCCCCCCC/C=C1/CC(CO)(COC(=O)c2ccc(-c3ccccc3)cc2)OC1=O CHEMBL112401 Ki 28.0 nM
CCCC/C=C\CCCCCCC/C=C1\CC(CO)(COC(C)=O)OC1=O CHEMBL97661 Ki 28.0 nM
CC(C)CC(C/C=C1/CCC(CO)(COC(=O)C(C)(C)C)OC1=O)CC(C)C CHEMBL206605 Ki 28.0 nM
CC(C)C(C/C=C1\CC(CO)(COC(=O)c2ccccc2)OC1=O)C(C)C CHEMBL210725 Ki 28.0 nM
CC(C)C(CC(=O)OC[C@H](CO)OC(=O)CC(C(C)C)C(C)C)C(C)C CHEMBL289230 Ki 28.6 nM
CC(C)(C)C(=O)OCC1(CO)C/C(=C\c2csc3ccccc23)C(=O)O1 CHEMBL4174723 Ki 28.77 nM
CC(C)(C)C(=O)OCC1(CO)C/C(=C\c2cn(CC3CC3)c3ccccc23)C(=O)O1 CHEMBL4175761 Ki 29.0 nM
CC(C)=C1CC(CO)(COC(=O)CC(C(C)C)C(C)C)OC1=O CHEMBL295426 Ki 29.5 nM
CCCCCCOC(=O)/C=C/[C@]1(CO)C/C(=C\CC(C(C)C)C(C)C)C(=O)O1 CHEMBL368472 Ki 29.5 nM
CC(C)(C)C(=O)OCC1(CO)C/C(=C\CCCCCCCCCCCCCCC(=O)O)C(=O)O1 CHEMBL597286 Ki 29.7 nM
O=C(OC1CCCC1Cc1ccc(O)cc1)c1cc(O)c(C(=O)c2c(O)cccc2C(=O)O)c(O)c1 CHEMBL295806 IC50 30.0 nM
O=C(N[C@@H]1CNCCCC1OC(=O)c1cc(O)c(C(=O)c2c(O)cccc2C(=O)O)c(O)c1)c1ccc(O)cc1 CHEMBL311399 IC50 30.0 nM
O=C(NC1CNCCCC1OC(=O)c1cc(O)c(C(=O)c2c(O)cccc2C(=O)O)c(O)c1)c1ccc(O)cc1 CHEMBL49354 IC50 30.0 nM
CC(C)C(C/C=C1/CC(CO)(COC(=O)c2ccccc2O)OC1=O)C(C)C CHEMBL210460 Ki 30.0 nM
CC(C)CC(=O)OCC1(CO)C/C(=C\CC(C(C)C)C(C)C)C(=O)O1 CHEMBL39489 Ki 30.1 nM
COc1ccc(/C=C2\CC(CO)(COC(=O)c3ccc(Cl)cc3)OC2=O)cc1 CHEMBL4174397 Ki 30.1 nM
CC(C)(C)C(=O)OCC1(CO)C/C(=C\CCCCCCCCCCC=O)C(=O)O1 CHEMBL611974 Ki 30.3 nM
CN(C)c1ccc(C(=O)OCC2(CO)C/C(=C\c3ccc(Cl)cc3)C(=O)O2)cc1 CHEMBL4175128 Ki 30.4 nM
CCCCCCCCCCCCCCCCCC(=O)OCC1(CO)C/C(=C\CC(C)C)C(=O)O1 CHEMBL3393747 Ki 30.8 nM
CC(C)C(=CC(=O)O[C@@H](CO)COC(=O)CC(C(C)C)C(C)C)C(C)C CHEMBL38644 Ki 31.1 nM
Cn1cc(/C=C2\CC(CO)(COC(=O)C3CCC(C(C)(C)C)CC3)OC2=O)c2ccccc21 CHEMBL4161221 Ki 31.3 nM
CCCCCCCCCCCCCCCCC/C=C1\CC(=O)OC1(CO)COC(=O)C(C)(C)C CHEMBL3393757 Ki 31.6 nM
Cc1ccc(N2CCC(N)CC2)c(NC(=O)c2nc(-c3ncccc3C(F)(F)F)cnc2N)n1 CHEMBL3977527 IC50 32.0 nM
CCCCCCCC(=O)OC[C@H](CO)OC(=O)CCCCCCC CHEMBL55267 Ki 33.0 nM
Cn1cc(C2=C(c3cn(CCCSC(=N)N)c4ccccc34)C(=O)NC2=O)c2ccccc21 CHEMBL6291 IC50 33.0 nM
CCCCCC1CC1CC1CC1CCCCCCC/C=C1/CC(CO)(COC(=O)C(C)(C)C)OC1=O CHEMBL3393755 Ki 33.1 nM
CC(C)[C@H]1C(=O)N[C@H](CO)Cc2cc(NC(=O)CCCCc3ccccc3)ccc2N1C CHEMBL333801 Ki 34.2 nM
CCCCCCCCCCCCC/C=C1/CC(CO)(COC(C)=O)OC1=O CHEMBL420450 Ki 35.0 nM
CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)N[C@H]4O CHEMBL574737 Kd apparent 35.0 nM
COc1ccc(C(=O)OCC2(CO)C/C(=C\CC(C(C)C)C(C)C)C(=O)O2)cc1 CHEMBL210196 Ki 36.0 nM
NCc1ccc2cccc(C3=C(c4c[nH]c5ccccc45)C(=O)NC3=O)c2c1 CHEMBL4061321 IC50 36.0 nM
CC(C)(C)C(=O)OCC1(CO)C/C(=C\CCCCCCCCCCCCCCCN)C(=O)O1 CHEMBL597698 Ki 36.4 nM
CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3ncccc3C(F)(F)F)cnc2N)CC1F CHEMBL3896683 IC50 37.0 nM
CC(C)(C)C(=O)OCC1(CO)C/C(=C/c2csc3ccccc23)C(=O)O1 CHEMBL4175333 Ki 37.0 nM
CC(C)=C1CC(CO)(COC(=O)COc2ccc(C#Cc3ccc(C)cc3)cc2)OC1=O CHEMBL523155 Ki 38.0 nM
O=C(OC[C@H](CO)OC(=O)C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2 CHEMBL345343 Ki 38.7 nM
COc1cccc(C(=O)OCC2(CO)C/C(=C\CC(C(C)C)C(C)C)C(=O)O2)c1 CHEMBL208568 Ki 39.0 nM
Cn1cc(C2=C(c3cn(C4CCN(Cc5ccccn5)CC4)c4ccccc34)C(=O)NC2=O)c2ccccc21 CHEMBL300138 IC50 39.0 nM
CC(C)(C)C(=O)OCC1(CO)C/C(=C\CCCCCCC=O)C(=O)O1 CHEMBL597281 Ki 39.3 nM
CC(C)=CC(=O)O[C@@H](CO)COC(=O)CC(C(C)C)C(C)C CHEMBL40482 Ki 39.9 nM
O=C(N[C@@H]1CCC[C@H]1OC(=O)c1cc(O)c(C(=O)c2c(O)cccc2C(=O)O)c(O)c1)c1ccc(O)cc1 CHEMBL52529 IC50 40.0 nM
O=C(N[C@@H]1CCC[C@H]1COC(=O)c1cc(O)c(C(=O)c2c(O)cccc2C(=O)O)c(O)c1)c1ccc(O)cc1 CHEMBL60455 IC50 40.0 nM
O=C(NC1CCC[C@@H]1OC(=O)c1cc(O)c(C(=O)c2c(O)cccc2C(=O)O)c(O)c1)c1ccc(O)cc1 CHEMBL71331 IC50 40.0 nM
O=C(NC1CCCC1OC(=O)c1cc(O)c(C(=O)c2c(O)cccc2C(=O)O)c(O)c1)c1ccc(O)cc1 CHEMBL48636 IC50 40.0 nM
O=C(N[C@@H]1CC(O)C[C@H]1OC(=O)c1cc(O)c(C(=O)c2c(O)cccc2C(=O)O)c(O)c1)c1ccc(O)cc1 CHEMBL306580 IC50 40.0 nM
O=C(N[C@@H]1CCCC1OC(=O)c1cc(O)c(C(=O)c2c(O)cccc2C(=O)O)c(O)c1)c1ccc(O)cc1 CHEMBL427118 IC50 40.0 nM
O=C(N[C@H]1C[C@@H](O)C[C@H]1OC(=O)c1cc(O)c(C(=O)c2c(O)cccc2C(=O)O)c(O)c1)c1ccc(O)cc1 CHEMBL1794808 IC50 40.0 nM
NC[C@H](Cc1cccc(F)c1)NC(=O)c1cc(Br)c(-c2ccnc3[nH]ccc23)s1 CHEMBL523586 IC50 40.0 nM
Cn1cc(/C=C2\CC(CO)(COC(=O)C(C)(C)C)OC2=O)c2cc(Cl)ccc21 CHEMBL4160647 Ki 42.3 nM
CCCCCCCCCCCCOc1cccc2c1C(=O)O[C@]2(CO)COC(=O)C(C(C)(C)C)C(C)(C)C CHEMBL1778819 Ki 43.0 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 43.0 nM
CCCCCCCC/C=C1/CC(CO)(COC(=O)Cc2ccccc2)OC1=O CHEMBL109997 Ki 43.3 nM
CCCCCCCCC/C=C1/CC(CO)(COC(=O)Cc2ccccc2)OC1=O CHEMBL321665 Ki 43.8 nM
CCCCCCCCCCCCCCCCCC(=O)OCC1(CO)C/C(=C/CC(C)C)C(=O)O1 CHEMBL3393746 Ki 43.9 nM
CCCCCCCC/C=C1\CC(CO)(COC(=O)Cc2ccccc2)OC1=O CHEMBL206735 Ki 44.0 nM
COc1cc2c(cc1-c1cnn3ccc(-c4ccnc5[nH]ccc45)cc13)CNC(CF)C2 CHEMBL4212424 IC50 45.0 nM
CCCCCCCCC#Cc1ccc2c(c1OC)C[C@@H](CO)NC(=O)[C@H](C(C)C)N2C CHEMBL7078 Ki 45.6 nM
CCCCCCCCCCc1ccc2c(c1)C[C@@H](CO)NC(=O)[C@H](C(C)C)N2C CHEMBL28205 Ki 46.6 nM
O=C(Cc1ccccc1)OCC1(CO)C/C(=C/c2ccc(-c3ccccc3)cc2)C(=O)O1 CHEMBL321189 Ki 48.0 nM
CC(C)CC(C/C=C1\CCC(CO)(COC(=O)C(C)(C)C)OC1=O)CC(C)C CHEMBL205619 Ki 48.0 nM
CC(C)C[C@H]1CN(c2ccc(Cl)c(C(=O)c3cccnc3N)n2)CCN1 CHEMBL2046644 Ki 49.0 nM
Cc1ccc2ccc(CN)cc2c1C1=C(c2c[nH]c3ccccc23)C(=O)NC1=O CHEMBL4099609 IC50 49.0 nM
O=C(N[C@@H]1C[C@@H](O)C[C@H]1OC(=O)c1cc(O)c(C(=O)c2c(O)cccc2C(=O)O)c(O)c1)c1ccc(O)cc1 CHEMBL309034 IC50 50.0 nM
O=C(N[C@H]1C[C@H](O)C[C@H]1OC(=O)c1cc(O)c(C(=O)c2c(O)cccc2C(=O)O)c(O)c1)c1ccc(O)cc1 CHEMBL67716 IC50 50.0 nM
Cn1cc(/C=C2\Oc3cccc(O)c3C2=O)c2c(-c3ccc(C(=O)NCCO)cc3)ccnc21 CHEMBL1092754 IC50 50.0 nM
Nc1ncc(-c2ccccc2C(F)(F)F)nc1C(=O)Nc1cnccc1N1CCCC(N)C1 CHEMBL3949162 IC50 50.0 nM
CCCCCCCC/C=C/CCCCCCCC(=O)O[C@@H](CO)COC(C)=O CHEMBL158666 Ki 50.4 nM
CCCC(=O)OCC1(CO)C/C(=C\C=C(C(C)C)C(C)C)C(=O)O1 CHEMBL174028 Ki 51.0 nM
CCCC(CCC)C(=O)OCC1(CO)C/C(=C\c2ccc3ccccc3n2)C(=O)O1 CHEMBL529000 Ki 51.9 nM
COC(=O)CCCCCCCCCCCCCCCOc1ccc(C#Cc2ccc(C#Cc3ccc(C(=O)OCC4(CO)CC(=C(C)C)C(=O)O4)cc3)cc2)cc1 CHEMBL220962 Ki 52.7 nM
Nc1ncnc2c1c(-c1cccc(O)c1)cn2[C@H]1C[C@@H](CN2CCC2)C1 CHEMBL3787112 IC50 53.0 nM
CCCC(=O)OCC1(CO)C/C(=C\CC(C(C)C)C(C)C)C(=O)O1 CHEMBL175389 Ki 54.0 nM
CC(C)C[C@H]1CN(c2cccc(C(=O)c3cccnc3N)n2)CCN1 CHEMBL2046640 Ki 54.0 nM
O=C(NC1C2CCC(C2)C1OC(=O)c1cc(O)c(C(=O)c2c(O)cccc2C(=O)O)c(O)c1)c1ccc(O)cc1 CHEMBL305667 IC50 55.0 nM
CCCCCCCCCOC(=O)CC1(CO)C/C(=C/CC(C(C)C)C(C)C)C(=O)O1 CHEMBL443035 Ki 55.7 nM
CC(C)[C@@](C)(O)[C@@H]1CN(c2nc(-c3n[nH]c4ncccc34)c(F)cc2O)CCN1 CHEMBL2325998 Ki 56.0 nM
CN(C)CCCn1nc(C2=C(c3cn(-c4ccc5ccccc5c4)c4ccccc34)C(=O)NC2=O)c2ccccc21 CHEMBL368895 IC50 57.0 nM
NCC1(c2cccc(-c3ccnc4[nH]nc(C(F)(F)F)c34)c2)CCC1 CHEMBL4589844 Ki 57.0 nM
CCCCC1(CCCC)CC[C@H]2CC(=O)N[C@H](CO)C[C@]2(C)C1 CHEMBL49902 Ki 60.0 nM
O=C(N[C@@H]1C2CCC(C2)[C@H]1OC(=O)c1cc(O)c(C(=O)c2c(O)cccc2C(=O)O)c(O)c1)c1ccc(O)cc1 CHEMBL80525 IC50 60.0 nM
Cc1cc(-c2ccnc3[nH]nc(C(F)(F)F)c23)cc(C2(CN)CCC2)c1 CHEMBL4590477 Ki 60.0 nM
CCCCCCCCCOC(=O)CC1(CO)C/C(=C\CC(C(C)C)C(C)C)C(=O)O1 CHEMBL1169398 Ki 62.2 nM
CC(C)(C)C(=O)OCC1(CO)C/C(=C/c2coc3ccccc23)C(=O)O1 CHEMBL4164402 Ki 62.5 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 63.0 nM
Cc1[nH]c2ccccc2c1C1=C(c2nc(N3CCN(C)CC3)nc3ccccc23)C(=O)NC1=O CHEMBL2151414 IC50 63.0 nM
CC(=O)N(C)Cc1ccc2ccc(Cl)c(C3=C(c4cn(C)c5ccccc45)C(=O)NC3=O)c2c1 CHEMBL4100747 IC50 63.0 nM
CN(Cc1ccc2ccc(Cl)c(C3=C(c4cn(C)c5ccccc45)C(=O)NC3=O)c2c1)C1CC1 CHEMBL4073977 IC50 63.0 nM
COc1cc2c(cc1-c1cnn3ccc(-c4ccnc5[nH]ccc45)cc13)CNC(C)C2 CHEMBL4208685 IC50 64.0 nM
CN(C)c1ccc(/C=C2\CC(CO)(COC(=O)C(C)(C)C)OC2=O)cc1 CHEMBL4162516 Ki 65.9 nM
CNc1nccc(-c2ccc(C(=O)N[C@H](CN)Cc3ccc(Cl)cc3Cl)s2)n1 CHEMBL213618 IC50 66.0 nM
O=C(NC1CNCCC[C@H]1OC(=O)c1cc(O)c(C(=O)c2c(O)cccc2C(=O)O)c(O)c1)c1ccc(O)cc1 CHEMBL89648 IC50 67.0 nM
CC(C)C(C/C=C1\CC(CO)(COC(=O)c2ccccc2O)OC1=O)C(C)C CHEMBL211049 Ki 67.0 nM
CCCC(=O)OCC1(CO)C/C(=C/C=C(C(C)C)C(C)C)C(=O)O1 CHEMBL173241 Ki 68.0 nM
O=C(N[C@@H]1Cc2ccccc2C1OC(=O)c1cc(O)c(C(=O)c2c(O)cccc2C(=O)O)c(O)c1)c1ccc(O)cc1 CHEMBL367162 IC50 70.0 nM
COc1cc2c(cc1-c1cnn3ccc(-c4ccnc5[nH]ccc45)cc13)CNCC2 CHEMBL4202753 IC50 71.0 nM
COc1ccc(/C=C2\CC(CO)(COC(=O)C(C)(C)C)OC2=O)cc1 CHEMBL4163130 Ki 72.0 nM
COc1ccccc1C(=O)OCC1(CO)C/C(=C\CC(C(C)C)C(C)C)C(=O)O1 CHEMBL209184 Ki 73.0 nM
CN(C)CCCn1cc(C2=C(c3csc4ccccc34)C(=O)NC2=O)c2ccccc21 CHEMBL566424 IC50 73.0 nM
Cn1cc(C2=C(c3cccc4ccc(CN)cc34)C(=O)NC2=O)c2ccccc21 CHEMBL4083182 IC50 73.0 nM
CC(C)C(C/C=C1\CC(CO)(COC(=O)c2cn(C)c3ccccc23)OC1=O)C(C)C CHEMBL4075373 Ki 73.0 nM
O=C(N[C@H]1CNCCC[C@H]1OC(=O)c1cc(O)c(C(=O)c2c(O)cccc2C(=O)O)c(O)c1)c1ccc(O)cc1 CHEMBL307747 IC50 74.0 nM
CC1=CC[C@H](C)C(C)(C)[C@@H]1/C=C/C(C)=C\CC[C@@]1(CO)[C@H](CCCO)/C(=C(/C)C=O)CC[C@]1(C)O CHEMBL339911 Ki 75.6 nM
CCCC(CCC)C(=O)OCC1(CO)C/C(=C\c2cccnc2)C(=O)O1 CHEMBL472522 Ki 76.0 nM
CC(C)C[C@H]1CN(c2ccc(C(F)(F)F)c(C(=O)c3cccnc3N)n2)CCN1 CHEMBL2046643 Ki 76.0 nM
CCCCCCCCCCCCC/C=C1\CC(CO)(COC(C)=O)OC1=O CHEMBL49904 Ki 77.9 nM
CCCC(CCC)C(=O)OCC1(CO)C/C(=C/c2ccc3ccccc3n2)C(=O)O1 CHEMBL488871 Ki 78.8 nM
C[C@@H]1O[C@@H](n2c3ccc(O)cc3c3c4c(c5c6ccccc6[nH]c5c32)CNC4=O)C[C@@H](N)[C@H]1O CHEMBL4288105 IC50 79.0 nM
Cn1cc(/C=C2/CC(CO)(COC(=O)C(C)(C)C)OC2=O)c2cc(Cl)ccc21 CHEMBL4161062 Ki 79.1 nM
Cc1cc(OCC2(CO)C/C(=C\CC(CC(C)C)CC(C)C)C(=O)O2)no1 CHEMBL5077090 Ki 79.3 nM
O=C(N[C@@H]1C[C@@H](CO)C[C@H]1OC(=O)c1cc(O)c(C(=O)c2c(O)cccc2C(=O)O)c(O)c1)c1ccc(O)cc1 CHEMBL75004 IC50 80.0 nM
O=C(N[C@H]1C[C@@H](CO)C[C@H]1OC(=O)c1cc(O)c(C(=O)c2c(O)cccc2C(=O)O)c(O)c1)c1ccc(O)cc1 CHEMBL431955 IC50 80.0 nM
COc1ccc(/C=C2\CC(CO)(COC(=O)c3ccc(N(C)C)cc3)OC2=O)cc1 CHEMBL461374 Ki 82.2 nM
COc1nccc(-c2c(-c3ccc(F)cc3)ncn2C2CCNCC2)n1 CHEMBL95692 IC50 83.0 nM
COc1nccc(-c2c(-c3ccc(F)cc3)ncn2[C@H]2CC[C@H](O)CC2)n1 CHEMBL97162 IC50 83.0 nM
CC(C)C(C/C=C1/CC(CO)(COC(=O)c2cn(C)c3ccccc23)OC1=O)C(C)C CHEMBL4070999 Ki 83.1 nM
C=C(/C=C/C=C(/CCC=C(C)C)COC(C)=O)[C@@H]1CC[C@]2([C@H](CCCO)/C(=C(/C)C=O)CC[C@]2(C)O)[C@@H]1O CHEMBL123519 Ki 83.6 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 84.0 nM
COc1ccc(/C=C2\CC(CO)(COC(=O)c3ccc(OC)cc3)OC2=O)cc1 CHEMBL461754 Ki 84.7 nM
CC(C)[C@H]1C(=O)N[C@H](CO)Cc2cn3ncc4ccc(c2c43)N1C CHEMBL271403 Ki 85.5 nM
O=C1NC(=O)C2=C1c1cn(c3ccccc13)CCOCCOCCOCCn1cc2c2ccccc21 CHEMBL340259 IC50 86.0 nM
CCCC(CCC)C(=O)OCC1(CO)C/C(=C\c2ccccn2)C(=O)O1 CHEMBL472007 Ki 86.3 nM
CCCCCCCC/C=C/CCCCCCCC(=O)OC[C@H](CO)OC(=O)CCCCCCC/C=C/CCCCCCCC CHEMBL57517 Ki 87.2 nM
CC1(C)CC[C@@H]2CC(=O)O[C@@H](CO)CC(=O)O[C@H](CCCCCCc3ccccc3)C[C@@H]1O2 CHEMBL5220744 Ki 88.0 nM
NC(=O)c1cnc(N[C@@H]2CCCC[C@@H]2N)nc1Nc1cccc(-n2nccn2)c1 CHEMBL2177736 IC50 90.0 nM
CCCCCCCCCCCCCCS(=O)(=O)OCC1(CO)CCC(=O)O1 CHEMBL49945 Ki 90.7 nM
CC(=O)N[C@H]1C[C@H]2O[C@@](C)([C@@H]1O)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)NC4 CHEMBL4277459 IC50 92.0 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 92.0 nM
CN(C)CCCn1cc(NC(=O)Nc2nccc(-c3ccccc3)n2)c2ccccc21 CHEMBL1766422 IC50 95.0 nM
Cc1ccc2ccc(CN)cc2c1C1=C(c2cn(C)c3ccccc23)C(=O)NC1=O CHEMBL4078759 IC50 95.0 nM
CCCCCCCCCCCCCC(=O)OC[C@]1(CO)CCC(=O)O1 CHEMBL119907 Ki 96.0 nM
CCCCCCCC/C=C/CCCCCCCC(=O)OCC1(CO)CCC(=O)O1 CHEMBL323750 Ki 96.0 nM
CCCCCCCC/C=C\CCCCCCCC(=O)OCC1(CO)CCC(=O)O1 CHEMBL94492 Ki 96.0 nM
CC(=O)N[C@@H]1C[C@H](n2c3ccccc3c3c4c(c5c6cc(O)ccc6[nH]c5c32)CNC4=O)O[C@@H](C)[C@@H]1O CHEMBL4279758 IC50 97.0 nM
CN(C)CCCn1cc(C2=C(c3cccc4ccccc34)C(=O)NC2=O)c2ccccc21 CHEMBL584483 IC50 98.0 nM
O=C(NC1C2CC(C3CCCC32)C1OC(=O)c1cc(O)c(C(=O)c2c(O)cccc2C(=O)O)c(O)c1)c1ccc(O)cc1 CHEMBL72480 IC50 100.0 nM
O=C(N[C@@H]1CCC[C@H]1OC(=O)c1cc(O)c(C(=O)c2c(O)cccc2NS(=O)(=O)C(F)(F)F)c(O)c1)c1ccc(O)cc1 CHEMBL52869 IC50 100.0 nM
O=C(NC1CCCC1OC(=O)c1cc(O)c(C(=O)c2c(O)cccc2NS(=O)(=O)C(F)(F)F)c(O)c1)c1ccc(O)cc1 CHEMBL312846 IC50 100.0 nM
O=C(N[C@@H]1C2CC(C3CCCC32)[C@H]1OC(=O)c1cc(O)c(C(=O)c2c(O)cccc2C(=O)O)c(O)c1)c1ccc(O)cc1 CHEMBL263910 IC50 100.0 nM
CC(C)[C@@]12C[C@@H](C[C@@H](CCCCc3ccccc3)O1)OC(=O)C[C@H](CO)OC(=O)CCO2 CHEMBL5219806 Ki 100.0 nM
CCCCCCCCC/C=C1\CC(CO)(COC(=O)c2cn(C)c3ccccc23)OC1=O CHEMBL4099579 Ki 106.0 nM
CCCCCCCCCCCCCCOC(=O)/C=C/[C@]1(CO)CCC(=O)O1 CHEMBL141784 Ki 109.0 nM
CCN1CCOCCn2cc(c3ccccc32)C2=C(C(=O)NC2=O)c2cn(c3ccccc23)CCOCC1 CHEMBL103055 IC50 110.0 nM
O=C(OCC(Cc1ccc(O)cc1)NS(=O)(=O)c1ccccc1)c1cc(O)c(C(=O)c2c(O)cccc2C(=O)O)c(O)c1 CHEMBL358264 IC50 110.0 nM
COc1cc2c(cc1-c1cnn3ccc(-c4ccnc5[nH]ccc45)cc13)CNC2 CHEMBL4216507 IC50 110.0 nM
CC(C)(C#N)c1cccc(-c2ccnc3[nH]ccc23)n1 CHEMBL4453941 Ki 110.0 nM
CC(C)=C1CC(CO)(COC(=O)c2ccc(C#Cc3ccc(C#Cc4ccc(OCCOCCOCCN(CC(=O)OC(C)(C)C)CC(=O)OC(C)(C)C)cc4)cc3)cc2)OC1=O CHEMBL220099 Ki 111.1 nM
CC(C)[C@H]1C(=O)N[C@H](CO)Cc2cn3nc(C(F)(F)F)c4ccc(c2c43)N1C CHEMBL261387 Ki 112.0 nM
Cn1cc(/C=C2\CC(CO)(COC(=O)C3CCCCC3)OC2=O)c2ccccc21 CHEMBL4163809 Ki 112.0 nM
CC(C)CC(C/C=C1\CC(CO)(COC(=S)C(C)(C)C)OC1=O)CC(C)C CHEMBL434938 Ki 113.0 nM
CC(C)(C)C(=O)OCC1(CO)C/C(=C\c2coc3ccccc23)C(=O)O1 CHEMBL4165117 Ki 114.0 nM
Cc1ccc(C#Cc2ccc(C=C3CC(CO)(COC(=O)c4cn(C)c5ccccc45)OC3=O)cc2)cc1 CHEMBL4097154 Ki 116.0 nM
CC[C@@](C)(Nc1ccnc(-c2c[nH]c3ncccc23)n1)C(=O)NCC(F)(F)F CHEMBL3039513 Kd apparent 117.0 nM
COC(=O)/C=C1/C[C@H]2C[C@]3(O)O[C@H](C[C@@H](O)CC(=O)O[C@@H]([C@@H](C)O)C[C@@H]4C/C(=C\C(=O)OC)C=C(O4)C(C)(C)/C=C/[C@@H](C1)O2)C[C@H](OC(=O)C(C)(C)C)C3(C)C CHEMBL509516 Ki 118.0 nM
CCCCCCCCC(O)CCCCCC/C=C1\CC(CO)(COC(=O)C(C)(C)C)OC1=O CHEMBL599698 Ki 118.0 nM
CN(C)CCCn1nc(C2=C(c3cn(-c4cccnc4)c4ccccc34)C(=O)NC2=O)c2ccccc21 CHEMBL368416 IC50 120.0 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 120.0 nM
CCCCCCCCCCOc1cccc2c1C(=O)O[C@@]2(CO)COC(C)=O CHEMBL100914 Ki 122.0 nM
CCCCCCCCCCCCOc1cccc2c1C(=O)O[C@@]2(CO)COC(=O)C(C)(C)C CHEMBL433207 Ki 122.0 nM
CCCCCCCCCCOc1cccc2c1C(=O)O[C@]2(CO)COC(C)=O CHEMBL99115 Ki 122.0 nM
C=CCC(=O)Oc1cccc2c1C(=O)O[C@]2(CO)COC(C)=O CHEMBL101616 Ki 122.0 nM
CC(=O)OCC1(CO)C/C(=C/CC(C(C)C)C(C)C)C(=O)O1 CHEMBL369163 Ki 123.0 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 CHEMBL46252 Ki 125.8 nM
COC(=O)COc1ccc(C#Cc2ccc(C#Cc3ccc(C#Cc4ccc(C(=O)OCC5(CO)CC(=C(C)C)C(=O)O5)cc4)cc3)cc2)cc1 CHEMBL221290 Ki 126.9 nM
Cn1cc(/C=C2\CC(CO)(COC(=O)C(C)(C)C)OC2=O)c2ccccc21 CHEMBL4169454 Ki 127.0 nM
COc1ccc(C(=O)OCC2(CO)C/C(=C\c3ccc(N(C)C)cc3)C(=O)O2)cc1 CHEMBL508870 Ki 128.0 nM
CCCCCCCC(=O)OCC1(CO)CC/C(=C\CC(CC(C)C)CC(C)C)C(=O)O1 CHEMBL205248 Ki 129.0 nM
CC(=O)OCOC(=O)c1cccc(O)c1C(=O)c1c(O)cc(C(=O)O[C@@H]2CNC[C@H]2NC(=O)c2ccc(O)cc2)cc1O CHEMBL67528 IC50 130.0 nM
N#Cc1ccc(N2CC[C@@H](Nc3c(C(N)=O)cnc4[nH]ccc34)[C@@H](F)C2)nc1 CHEMBL3593777 IC50 130.0 nM
COc1ccc(C(=O)OCC2(CO)C/C(=C\c3ccc4ccccc4n3)C(=O)O2)cc1 CHEMBL487473 Ki 132.0 nM
CCCCCCC(=O)OCC1(CO)C/C(=C\c2cn(C)c3ccccc23)C(=O)O1 CHEMBL4167264 Ki 135.0 nM
COc1ccc(C(=O)OCC2(CO)C/C(=C\c3ccc([N+](=O)[O-])cc3)C(=O)O2)cc1 CHEMBL488668 Ki 136.0 nM
Cn1cc(C2=C(c3cccc4cc(CN)ccc34)C(=O)NC2=O)c2ccccc21 CHEMBL4072709 IC50 136.0 nM
CCCCCCCCCCCCCC(=O)OCC1(CO)CCC(=O)O1 CHEMBL299225 Ki 138.0 nM
C/C=C1\CC(CO)(COC(=O)CC(C(C)C)C(C)C)OC1=O CHEMBL172182 Ki 138.0 nM
COc1cc2c(cc1-c1cnn3ccc(-c4ccnc5[nH]ccc45)cc13)CN(C)C2 CHEMBL4206065 IC50 140.0 nM
COc1ccc(C(=O)OCC2(CO)C/C(=C\c3cnc4ccccc4c3)C(=O)O2)cc1 CHEMBL488509 Ki 144.0 nM
Cn1cc(/C=C2\CC(CO)(COC(=O)c3ccc(Cl)cc3)OC2=O)c2ccccc21 CHEMBL4168968 Ki 146.0 nM
CCCCCC(=O)OCC1(CO)CC/C(=C\CC(CC(C)C)CC(C)C)C(=O)O1 CHEMBL205670 Ki 147.0 nM
CN(C)CCCn1nc(C2=C(c3cn(-c4ccccc4)c4ccccc34)C(=O)NC2=O)c2ccccc21 CHEMBL366668 IC50 150.0 nM
CN(C)c1ccc(C(=O)OCC2(CO)C/C(=C\c3ccc4ccccc4n3)C(=O)O2)cc1 CHEMBL511472 Ki 150.0 nM
CC(C)(C)C(=O)OCOC(=O)c1cccc(O)c1C(=O)c1c(O)cc(C(=O)O[C@@H]2CNC[C@H]2NC(=O)c2ccc(O)cc2)cc1O CHEMBL304175 IC50 160.0 nM
O=C(N[C@@H]1c2ccccc2CC1OC(=O)c1cc(O)c(C(=O)c2c(O)cccc2C(=O)O)c(O)c1)c1ccc(O)cc1 CHEMBL177308 IC50 160.0 nM
C/C=C1/CC(CO)(COC(=O)CC(C(C)C)C(C)C)OC1=O CHEMBL173414 Ki 164.0 nM
CC(=O)c1cnc2ccc(-c3cc(Cl)c(O)c(Cl)c3)nc2c1N[C@H]1CC[C@H](CN(C)C)CC1 CHEMBL3688339 Kd apparent 164.0 nM
O=C(O[C@H]1CCC23CCCC[C@H](C=C(CO)C[C@H]12)C3=O)c1ccccc1 CHEMBL156719 Ki 165.0 nM
COC(=O)c1cc(NC(=O)c2cc(C(=O)c3cc(NC(=O)Cn4cc(C5=C(c6c[nH]c7ccccc67)C(=O)NC5=O)c5ccccc54)cn3C)cn2C)cn1C CHEMBL149237 IC50 170.0 nM
CC(C)N1CCOCCn2cc(c3ccccc32)C2=C(C(=O)NC2=O)c2cn(c3ccccc23)CCOCC1 CHEMBL421217 IC50 170.0 nM
CC(C)CC(C/C=C1\CC(/C=C/C(=O)OC(C)(C)C)(CO)OC1=O)CC(C)C CHEMBL381693 Ki 173.0 nM
CN(C)c1ccc(C(=O)OCC2(CO)C/C(=C\c3cn(C)c4ccccc34)C(=O)O2)cc1 CHEMBL472521 Ki 174.0 nM
CCCC(CCC)C(=O)OCC1(CO)C/C(=C/c2cnc3ccccc3c2)C(=O)O1 CHEMBL488707 Ki 177.0 nM
NCCCn1ccc2c(-c3ccnc(Nc4cccc(OC(F)(F)C(F)F)c4)n3)cccc21 CHEMBL293991 IC50 180.0 nM
Cn1nc(/C=C2\CC(CO)(COC(=O)C(C)(C)C)OC2=O)c2ccccc21 CHEMBL4167457 Ki 183.8 nM
COC(=O)/C=C1\C=C2O[C@@H](C1)C[C@H]([C@@H](C)O)OC(=O)C[C@H](O)C[C@@H]1C[C@H](OC(=O)C(C)(C)C)C(C)(C)[C@](O)(C[C@@H]3C/C(=C/C(=O)OC)C[C@H](/C=C/C2(C)C)O3)O1 CHEMBL452391 Ki 188.0 nM
CCCCC1(CCCC)CC[C@H]2CC(=O)N[C@@H](CO)C[C@]2(C)C1 CHEMBL50658 Ki 190.0 nM
COCCCCCCC/C=C1\CC(CO)(COC(=O)C(C)(C)C)OC1=O CHEMBL598241 Ki 191.0 nM
CC(C)[C@@](C)(O)[C@@H]1CN(c2nc(-c3n[nH]c4ncccc34)c(F)cc2F)CCN1 CHEMBL2326001 Ki 198.0 nM
COCOCCCCCCC/C=C1\CC(CO)(COC(=O)C(C)(C)C)OC1=O CHEMBL596819 Ki 198.4 nM
CN1CCC(n2cc(C3=C(c4c[nH]c5ccccc45)C(=O)NC3=O)c3ccccc32)CC1 CHEMBL52654 IC50 200.0 nM
CCCCCCCCCCCCC/C=C1\C(=O)O[C@@H](CO)[C@@H]1OC(C)=O CHEMBL422215 Ki 200.0 nM
CN1CCN(c2nc(C3=C(c4c[nH]c5cccc(Cl)c45)C(=O)NC3=O)c3ccccc3n2)CC1 CHEMBL2151407 IC50 202.0 nM
O=C(OCc1cccc(C(F)(F)F)c1)c1cc(CO)cc(C(=O)OCc2cccc(C(F)(F)F)c2)c1 CHEMBL466211 Ki 205.0 nM
CC(C)[C@@](C)(O)[C@@H]1CN(c2nc(-c3n[nH]c4ncccc34)c(F)cc2CO)CCN1 CHEMBL2326000 Ki 205.0 nM
CCCCCCCCC(=O)OCCC1(CO)C/C(=C/CC(C(C)C)C(C)C)C(=O)O1 CHEMBL158957 Ki 208.0 nM
COC(=O)c1cccc(O)c1C(=O)c1c(O)cc(C(=O)O[C@@H]2CCC[C@H]2NC(=O)c2ccc(O)cc2)cc1O CHEMBL66923 IC50 210.0 nM
O=C(OC[C@@H](Cc1ccc(O)cc1)NS(=O)(=O)c1ccccc1)c1cc(O)c(C(=O)c2c(O)cccc2C(=O)O)c(O)c1 CHEMBL345767 IC50 210.0 nM
COc1ccc(C(=O)OCC2(CO)C/C(=C\c3cn(C)c4ccccc34)C(=O)O2)cc1 CHEMBL488674 Ki 212.0 nM
C[C@@]1(OC(=O)c2cc(O)c(C(=O)c3c(O)cccc3C(=O)O)c(O)c2)CCCNC[C@H]1NC(=O)c1ccc(O)cc1 CHEMBL433101 IC50 220.0 nM
O=C(OC1CCCC1Oc1ccc(O)cc1)c1cc(O)c(C(=O)c2c(O)cccc2C(=O)O)c(O)c1 CHEMBL48988 IC50 220.0 nM
CN(C)CCCn1nc(C2=C(c3cn(-c4cccs4)c4ccccc34)C(=O)NC2=O)c2ccccc21 CHEMBL178945 IC50 220.0 nM
C[C@]12O[C@H](C[C@]1(O)CO)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)CNC4=O CHEMBL603469 Kd 220.0 nM
CC(=O)OC[C@H]1O[C@@H](O[C@H]2[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H](n3[se]c4ccccc4c3=O)O[C@@H]2COC(C)=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O CHEMBL1940993 IC50 220.0 nM
CCCCCC(=O)Nc1ccc2c(c1)C[C@@H](CO)NC(=O)[C@H](C(C)C)N2C CHEMBL334195 Ki 225.0 nM
Cc1cccc2c(C3=C(c4c[nH]c5ccccc45)C(=O)NC3=O)nc(N3CCN(C)CC3)nc12 CHEMBL2151406 IC50 235.0 nM
CC1=CC23C(=O)[C@@H](C=C(CO)[C@@H](O)[C@]2(O)[C@H]1O)[C@H]1[C@@H](C[C@H]3C)C1(C)C CHEMBL346507 Ki 240.0 nM
CC(C)C1C[C@@H](NC(=O)c2ccc(O)cc2)[C@H](OC(=O)c2cc(O)c(C(=O)c3c(O)cccc3C(=O)O)c(O)c2)C1 CHEMBL76920 IC50 240.0 nM
CNC[C@@H]1CCn2cc(c3ccccc32)C2=C(C(=O)NC2=O)c2cn(c3ccccc23)CCO1 CHEMBL311543 IC50 240.0 nM
COc1ccc2c(c1)c(/C=C1\CC(CO)(COC(=O)C(C)(C)C)OC1=O)cn2C CHEMBL4171253 Ki 249.0 nM
COC(=O)c1cccc(O)c1C(=O)c1c(O)cc(C(=O)O[C@@H]2CNC[C@H]2NC(=O)c2ccc(O)cc2)cc1O CHEMBL304626 IC50 250.0 nM
CN1CCCn2cc(c3ccccc32)C2=C(C(=O)NC2=O)c2cn(c3ccccc23)CCOCCOCC1 CHEMBL321315 IC50 250.0 nM
C=Cn1cc(C2=C(c3nn(CCCN(C)C)c4ccccc34)C(=O)NC2=O)c2ccccc21 CHEMBL368193 IC50 250.0 nM
CCCn1c(CNc2cccc(C(=O)NCc3c(F)cccc3F)c2)nnc1-c1ccncn1 CHEMBL1738878 IC50 250.0 nM
COc1cc2c(cc1-n1cnc3cnc(-c4ccnc5[nH]ccc45)cc31)CNC2 CHEMBL4208028 IC50 250.0 nM
CN(C)c1ccc(/C=C2\CC(CO)(COC(=O)c3ccc(N(C)C)cc3)OC2=O)cc1 CHEMBL452307 Ki 252.0 nM
Cc1ccc(C#Cc2ccc(/C=C3\CC(CO)(COC(=O)c4cn(C)c5ccccc45)OC3=O)cc2)cc1 CHEMBL4069954 Ki 257.0 nM
CCCCCCCCCCCCCCOC(=O)CC[C@]1(CO)CCC(=O)O1 CHEMBL138827 Ki 260.0 nM
O=C(OC1CNCC1Cc1ccc(O)cc1)c1cc(O)c(C(=O)c2c(O)cccc2C(=O)O)c(O)c1 CHEMBL300422 IC50 260.0 nM
O=C1NC(=O)C(c2nn(CCCN3CCOCC3)c3ccccc23)=C1c1cn(-c2ccc3ccccc3c2)c2ccccc12 CHEMBL367106 IC50 260.0 nM
Cn1cc(C2=C(c3cccc(NCC(O)CO)c3)C(=O)NC2=O)c2cc(Cl)ccc21 CHEMBL1082153 IC50 260.0 nM
CC(C)[C@H]1/C(S)=N/[C@H](CO)Cc2c[nH]c3cccc(c23)N1C CHEMBL63262 Ki 261.5 nM
O=C(N[C@@H]1CCCCC[C@H]1OC(=O)c1cc(O)c(C(=O)c2c(O)cccc2C(=O)O)c(O)c1)c1ccc(O)cc1 CHEMBL304549 IC50 270.0 nM
O=C(N[C@H]1CCCCC[C@H]1OC(=O)c1cc(O)c(C(=O)c2c(O)cccc2C(=O)O)c(O)c1)c1ccc(O)cc1 CHEMBL302998 IC50 270.0 nM
COC(=O)c1cc(NC(=O)c2cc(NC(=O)Cn3cc(C4=C(c5c[nH]c6ccccc56)C(=O)NC4=O)c4ccccc43)cn2C)cn1C CHEMBL269437 IC50 280.0 nM
CN1CCN(c2nc(C3=C(c4c[nH]c5ccccc45)C(=O)NC3=O)c3ccc(Cl)cc3n2)CC1 CHEMBL2153756 IC50 280.0 nM
COc1cc2c(cc1-n1cnc3ccc(-c4ccnc5[nH]ccc45)cc31)CNC2 CHEMBL4213984 IC50 280.0 nM
Cc1cc(-c2ccnc3[nH]nc(C(F)(F)F)c23)cc(C2(CN)COC2)c1 CHEMBL4587816 Ki 286.0 nM
CCN1CCOCCOCCn2cc(c3ccccc32)C2=C(C(=O)NC2=O)c2cn(c3ccccc23)CC1 CHEMBL103506 IC50 290.0 nM
CN1CCN(C)CCn2cc(c3ccccc32)C2=C(C(=O)NC2=O)c2cn(c3ccccc23)CCN(C)CC1 CHEMBL103628 IC50 290.0 nM
FC(F)C(F)(F)Oc1cccc(Nc2nccc(-c3c[nH]c4ccccc34)n2)c1 CHEMBL55379 IC50 290.0 nM
O=C(N[C@@H]1c2ccccc2C[C@@H]1OC(=O)c1cc(O)c(C(=O)c2c(O)cccc2C(=O)O)c(O)c1)c1ccc(O)cc1 CHEMBL367127 IC50 290.0 nM
CN(C)CCCn1nc(C2=C(c3cn(-c4cncc5ccccc45)c4ccccc34)C(=O)NC2=O)c2ccccc21 CHEMBL359808 IC50 290.0 nM
Cn1cc(C2=C(c3cn(C4CCNCC4)c4ccccc34)C(=O)NC2=O)c2ccccc21 CHEMBL55788 IC50 300.0 nM
Cn1cc(C2=C(c3cn(C4CCN(CC5CC5)CC4)c4ccccc34)C(=O)NC2=O)c2ccccc21 CHEMBL55394 IC50 300.0 nM
CN1CCOCCn2cc(c3ccccc32)C2=C(C(=O)NC2=O)c2cn(c3ccccc23)CCOCC1 CHEMBL106061 IC50 300.0 nM
FC(F)C(F)(F)Oc1cccc(Nc2nccc(-c3ccncc3)n2)c1 CHEMBL55662 IC50 300.0 nM
CCCCCCCCCCCCC/C=C1/C(=O)O[C@@H](CO)[C@@H]1OC(C)=O CHEMBL13306 Ki 300.0 nM
C[C@@H]1C(=O)NN=C2COc3cc(-c4ccccc4F)c([C@@H]4CCN(C)C[C@@H]4C)cc3N21 CHEMBL3355127 IC50 310.0 nM
CCCCC(CC)OC(=O)c1cc(CO)cc(C(=O)OC(CC)CCCC)c1 CHEMBL494361 Ki 319.0 nM
CCCCCCCCCCCCC/C=C1\CC(CO)(COC(C)=O)OS1(=O)=O CHEMBL52329 Ki 320.0 nM
COc1ccccc1C(=O)Nc1cccc(Nc2nccc(-c3cccnc3)n2)c1 CHEMBL299707 IC50 320.0 nM
CN1CCN(CCCn2nc(C3=C(c4cn(-c5ccc6ccccc6c5)c5ccccc45)C(=O)NC3=O)c3ccccc32)CC1 CHEMBL175845 IC50 320.0 nM
COCCOCOCCCCCCC/C=C1\CC(CO)(COC(=O)C(C)(C)C)OC1=O CHEMBL605949 Ki 323.0 nM
CC(C)C/C=C1/CC([C@H](CO)OC(=O)CC(C)C)OC1=O CHEMBL440707 Ki 327.0 nM
CC(C)C(C/C=C1/CC([C@H](CO)OC(=O)CC(C(C)C)C(C)C)OC1=O)C(C)C CHEMBL107602 Ki 327.0 nM
CC(C)CC(=O)OC[C@H](CO)OC(=O)C=C(C(C)C)C(C)C CHEMBL40602 Ki 330.0 nM
O=C1NC(=O)C(c2cn(CCCn3ccnc3)c3ccccc23)=C1Nc1ccccc1 CHEMBL366266 IC50 331.0 nM
CC(C)[C@H]1C(=O)N[C@H](CO)Cc2ccccc2N1C CHEMBL267144 Ki 334.0 nM
CC(C)N1CCC(n2cc(C3=C(c4cn(C)c5ccccc45)C(=O)NC3=O)c3ccccc32)CC1 CHEMBL301860 IC50 340.0 nM
O=C(N[C@@H]1CCC[C@H]1OC(=O)c1cc(O)c(C(=O)c2c(O)cccc2-c2nn[nH]n2)c(O)c1)c1ccc(O)cc1 CHEMBL298872 IC50 340.0 nM
O=C(NC1CCCC1OC(=O)c1cc(O)c(C(=O)c2c(O)cccc2-c2nn[nH]n2)c(O)c1)c1ccc(O)cc1 CHEMBL89384 IC50 340.0 nM
COc1cc2c(cc1-c1cnc3ccc(-c4ccnc5[nH]ccc45)cn13)CNC2 CHEMBL4206023 IC50 340.0 nM
CN(C)c1ccc(C(=O)OCC2(CO)C/C(=C\c3ccc([N+](=O)[O-])cc3)C(=O)O2)cc1 CHEMBL488675 Ki 343.0 nM
CCCCCCCCCCCCCC(=O)OCC1(CO)C/C(=C/C(=O)OC)CO1 CHEMBL132879 Ki 350.0 nM
CCCCCCCCCCCCCC(=O)OCC1(CO)C/C(=C\C(=O)OC)CO1 CHEMBL133165 Ki 350.0 nM
N#Cc1ccc(C(=O)Nc2cccc(Nc3nccc(-c4cccnc4)n3)c2)cc1 CHEMBL58580 IC50 350.0 nM
COc1cc2c(cc1-c1cnn3ccc(-c4ccnc5[nH]ccc45)nc13)CNC2 CHEMBL4211722 IC50 350.0 nM
CC(C)[C@@](C)(O)[C@@H]1CN(c2nc(-c3n[nH]c4ncccc34)c(F)cc2Cl)CCN1 CHEMBL2326002 Ki 356.0 nM
CC(=O)OCC1(CO)C/C(=C\CC(C(C)C)C(C)C)C(=O)O1 CHEMBL176579 Ki 359.0 nM
CN(C)C[C@@H]1CCn2cc(c3ccccc32)C2=C(C(=O)NC2=O)c2cn(c3ccccc23)CCO1 CHEMBL432130 IC50 360.0 nM
Cn1cc(/C=C/C(=O)OCC2(CO)C/C(=C\c3cn(C)c4ccccc34)C(=O)O2)c2ccccc21 CHEMBL4170226 Ki 375.0 nM
CC(C)(C)C(=O)OCC1(CO)C/C(=C\CCCCCCCO)C(=O)O1 CHEMBL599275 Ki 378.0 nM
CC(C)(N)CNc1nc(-c2ccnc(N)c2)cc2cnccc12 CHEMBL2147548 IC50 378.0 nM
COc1ccc(OC)c(C2=C(c3cn(C)c4ccccc34)C(=O)NC2=O)c1 CHEMBL1087243 IC50 380.0 nM
COc1cc2c(cc1-c1cnn3ccc(-c4ccnc5[nH]ccc45)cc13)CN(C(C)=O)C2 CHEMBL4215391 IC50 380.0 nM
O=C1OC(CO)(COC(=O)c2ccc(Cl)cc2)C/C1=C\c1ccccn1 CHEMBL4175742 Ki 383.0 nM
CC(=O)OCC1(CO)C/C(=C/C=C(C(C)C)C(C)C)C(=O)O1 CHEMBL173670 Ki 390.0 nM
CCCCCCCCCCCC(=O)Oc1ccc2c(c1)[C@](C)(C(C)C)[C@H]1C(=O)N[C@H](CO)[C@@H]21 CHEMBL368720 Ki 395.0 nM
CCN1CCC(n2cc(C3=C(c4cn(C)c5ccccc45)C(=O)NC3=O)c3ccccc32)CC1 CHEMBL54382 IC50 400.0 nM
CN1CCC(n2cc(C3=C(c4cn(C)c5ccccc45)C(=O)NC3=O)c3ccccc32)CC1 CHEMBL53596 IC50 400.0 nM
Cn1cc(C2=C(c3cccc(NCC(O)CO)c3)C(=O)NC2=O)c2cc(F)ccc21 CHEMBL1082152 IC50 400.0 nM
CC(C)C(C/C=C1/CC(CO)(COC(=O)c2cccc(O)c2)OC1=O)C(C)C CHEMBL209615 Ki 406.0 nM
CC(=O)OCC1(CO)C/C(=C\C=C(C(C)C)C(C)C)C(=O)O1 CHEMBL369665 Ki 409.0 nM
CC1(C)C2CCC1(C)C(OC(=O)c1cc(O)c(C(=O)c3c(O)cccc3C(=O)O)c(O)c1)C2NC(=O)c1ccc(O)cc1 CHEMBL306170 IC50 410.0 nM
O=C(N[C@@H]1CN2CCC(CC2)[C@H]1OC(=O)c1cc(O)c(C(=O)c2c(O)cccc2C(=O)O)c(O)c1)c1ccc(O)cc1 CHEMBL78129 IC50 410.0 nM
CC1(C)C2CCC1(C)[C@@H](OC(=O)c1cc(O)c(C(=O)c3c(O)cccc3C(=O)O)c(O)c1)[C@@H]2NC(=O)c1ccc(O)cc1 CHEMBL309078 IC50 410.0 nM
CC(CCc1ccc(O)cc1)OC(=O)c1cc(O)c(C(=O)c2c(O)cccc2C(=O)O)c(O)c1 CHEMBL148745 IC50 410.0 nM
CCCCCCCCCCc1ccc2c(c1)N(C)[C@@H](C(C)C)C(=O)O[C@H](CO)C2 CHEMBL102858 Ki 412.0 nM
O=C(NC1CN2CCC(CC2)C1OC(=O)c1cc(O)c(C(=O)c2c(O)cccc2C(=O)O)c(O)c1)c1ccc(O)cc1 CHEMBL306884 IC50 415.0 nM
Nc1ncccc1C(=O)c1cccc(N2CCNCC2)n1 CHEMBL2046626 Ki 418.0 nM
Nc1ncccc1C(=O)c1cccc(N2CCCNCC2)n1 CHEMBL2046624 Ki 428.0 nM
CC(C)CC(C/C=C1/CC(CO)(CNC(=O)C(C)(C)C)OC1=O)CC(C)C CHEMBL136786 Ki 429.7 nM
O=C(NC1CNCC1OC(=O)c1cc(O)c(C(=O)c2c(O)ccc3c2CCCC3)c(O)c1)c1ccc(O)cc1 CHEMBL91126 IC50 430.0 nM
O=C(N[C@@H]1CC(C(=O)C(F)(F)F)C[C@H]1OC(=O)c1cc(O)c(C(=O)c2c(O)cccc2C(=O)O)c(O)c1)c1ccc(O)cc1 CHEMBL262980 IC50 430.0 nM
COc1cc2c(cc1-n1cnc3ccc(-c4ccnc5[nH]ccc45)nc31)CNC2 CHEMBL4212934 IC50 430.0 nM
c1cc(-c2cc3cnccc3c(N3CCCNCC3)n2)ccn1 CHEMBL2147542 IC50 433.0 nM
Cn1cc(/C=C2\CC(CO)(COC(=O)/C=C/c3ccccc3)OC2=O)c2ccccc21 CHEMBL4160009 Ki 439.0 nM
O=C1NC(=O)C2=C1c1cn(c3ccccc13)CCOCCN(CCO)CCOCCn1cc2c2ccccc21 CHEMBL321529 IC50 440.0 nM
CS(=O)(=O)Nc1cccc(O)c1C(=O)c1c(O)cc(C(=O)O[C@@H]2CCC[C@H]2NC(=O)c2ccc(O)cc2)cc1O CHEMBL294166 IC50 450.0 nM
COc1ccc(-c2cc3c(cc2[C@@H]2CCN(C)C[C@@H]2C)N2C(=NNC(=O)[C@H]2C)CO3)c(F)c1 CHEMBL3355138 IC50 450.0 nM
CCCCCCCCC(=O)OCCC1(CO)C/C(=C\CC(C(C)C)C(C)C)C(=O)O1 CHEMBL1169397 Ki 459.0 nM
CC(C)C[C@H]1CN(c2ccc(OC(F)F)c(C(=O)c3cccnc3N)n2)CCN1 CHEMBL2046646 Ki 459.0 nM
Cc1cc(C(=O)c2cccnc2N)nc(N2CCN[C@@H](CC(C)C)C2)c1 CHEMBL2046651 Ki 459.0 nM
O=C(N[C@@H]1CCC[C@H]1OCc1cc(O)c(C(=O)c2c(O)cccc2C(=O)O)c(O)c1)c1ccc(O)cc1 CHEMBL294303 IC50 460.0 nM
CN(C)CCCNC(=O)c1cc(NC(=O)c2cc(NC(=O)c3cc(NC(=O)Cn4cc(C5=C(c6c[nH]c7ccccc67)C(=O)NC5=O)c5ccccc54)cn3C)cn2C)cn1C CHEMBL268744 IC50 460.0 nM
O=C(NC1CCCC1OCc1cc(O)c(C(=O)c2c(O)cccc2C(=O)O)c(O)c1)c1ccc(O)cc1 CHEMBL89833 IC50 460.0 nM
CN(C)CCCn1cc(C2=C(Nc3ccccc3)C(=O)NC2=O)c2ccccc21 CHEMBL365656 IC50 460.0 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 460.0 nM
CC(C)(C#N)c1cccc(-c2ccnc3[nH]ncc23)n1 CHEMBL4539521 Ki 465.0 nM
NCC1(c2cccc(-c3ccnc4[nH]nc(C(F)(F)F)c34)c2)CCOCC1 CHEMBL4457150 Ki 468.0 nM
O=C1NC(=O)C(c2nn(CCCN3CCCC3)c3ccccc23)=C1c1cn(-c2ccc3ccccc3c2)c2ccccc12 CHEMBL367107 IC50 480.0 nM
CCCCCCCCCCCCCCOC(=O)CCC1(CO)CCC(=O)O1 CHEMBL136296 Ki 489.0 nM
CN1CCOCCN(C)CCn2cc(c3ccccc32)C2=C(C(=O)NC2=O)c2cn(c3ccccc23)CC1 CHEMBL105477 IC50 490.0 nM
CCCCCCCCC(=O)O[C@@H](CO)C1C/C(=C/CC(C)C)C(=O)O1 CHEMBL439594 Ki 499.0 nM
CCCCCCCCC(=O)O[C@@H](CO)C1C/C(=C/CC(C(C)C)C(C)C)C(=O)O1 CHEMBL109099 Ki 499.0 nM
COC(=O)c1cc(NC(=O)Cn2cc(C3=C(c4c[nH]c5ccccc45)C(=O)NC3=O)c3ccccc32)cn1C CHEMBL9680 IC50 500.0 nM
CS(=O)(=O)Nc1cccc(O)c1C(=O)c1c(O)cc(C(=O)OC2CCCC2NC(=O)c2ccc(O)cc2)cc1O CHEMBL88749 IC50 500.0 nM
CCCCCCCCCCCCCC[C@H]1C(=O)O[C@@H](CO)[C@@H]1OC(C)=O CHEMBL12988 Ki 500.0 nM
CCCC(/C=C1\CC(CO)(COC(=O)c2cn(C)c3ccccc23)OC1=O)CCC CHEMBL4081576 Ki 504.0 nM
CCN1CCN(Cc2ccc(Nc3ncc(F)c(-c4cc(F)c5nc(C)n(C(C)C)c5c4)n3)nc2)CC1 CHEMBL3301610 Kd apparent 530.0 nM
COC(=O)CCCCCC/C=C1\CC(CO)(COC(=O)C(C)(C)C)OC1=O CHEMBL597287 Ki 533.0 nM
CCCCCCCCCCCCOc1cccc2c1C(=O)O[C@]2(CO)COC(C)=O CHEMBL102106 Ki 540.0 nM
CC(=O)OC[C@@]1(CO)OC(=O)c2c(OCc3ccccc3)cccc21 CHEMBL322865 Ki 540.0 nM
CCCCCCCCCCCCOc1cccc2c1C(=O)O[C@@]2(CO)COC(C)=O CHEMBL100739 Ki 540.0 nM
CCCCCCCC(=O)OC[C@H](CO)OC(C)=O CHEMBL102042 Ki 540.0 nM
COC(=O)C1C[C@@H](NC(=O)c2ccc(O)cc2)[C@H](OC(=O)c2cc(O)c(C(=O)c3c(O)cccc3C(=O)O)c(O)c2)C1 CHEMBL77399 IC50 540.0 nM
CC(C)[C@@](C)(O)[C@@H]1CN(c2ccc(F)c(-c3n[nH]c4ncccc34)n2)CCN1 CHEMBL2326007 Ki 549.0 nM
CN(C)CCCn1cc(C2=C(Nc3cccc(Cl)c3)C(=O)NC2=O)c2ccccc21 CHEMBL364337 IC50 558.0 nM
Oc1cccc(Nc2[nH]nc3ncnc(Nc4cccc(Cl)c4)c23)c1 CHEMBL121954 IC50 560.0 nM
CCCCCCCC/C=C1/CC([C@H](CO)OC(=O)CC(C)C)OC1=O CHEMBL110213 Ki 565.0 nM
CCCCCCCC/C=C1/CC([C@H](CO)OC(=O)CC(C(C)C)C(C)C)OC1=O CHEMBL420668 Ki 565.0 nM
CCn1c(-c2nonc2N)nc2c(C#CC(C)(C)O)ncc(OC[C@H]3CCCNC3)c21 CHEMBL494089 Kd apparent 566.0 nM
CN1CCOCCn2cc(c3ccccc32)C2=C(C(=O)NC2=O)c2cn(c3ccccc23)CCN(C)CC1 CHEMBL106384 IC50 570.0 nM
CCCCCCCC/C=C1\CC([C@H](CO)OC(=O)CC(C)C)OC1=O CHEMBL2111705 Ki 579.0 nM
CCCCCCCC/C=C1\CC([C@H](CO)OC(=O)CC(C(C)C)C(C)(C)C)OC1=O CHEMBL320984 Ki 579.0 nM
CCCCCCCCC#Cc1ccc2c(c1)[C@](C)(C(C)C)[C@H]1C(=O)N[C@H](CO)[C@@H]21 CHEMBL440201 Ki 580.0 nM
CCCCCCCCCCCCCCCCCCOC(=O)/C=C1\COC(CO)(COC(C)=O)C1 CHEMBL133269 Ki 580.0 nM
CCc1nc(C(N)=O)c(Nc2ccc(N3CCC(N4CCN(C)CC4)CC3)c(OC)c2)nc1NC1CCOCC1 CHEMBL3301622 Kd apparent 591.0 nM
CCCCCCCCCCCCCC[C@@H]1C(=O)O[C@@H](CO)[C@@H]1OC(C)=O CHEMBL13221 Ki 600.0 nM
O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@H](O)[C@@H](O)[C@H](OCCc2ccc(O)c(O)c2)O[C@@H]1CO CHEMBL481635 IC50 600.0 nM
CCCCCCCCCCCCO[C@@H]1[C@H](OC)[C@@H](OC)[C@H](OCC#Cc2cccc3c2C(=O)O[C@]3(CO)COC(=O)C(C(C)(C)C)C(C)(C)C)[C@@H](OC)[C@@H]1OC CHEMBL1778822 Ki 600.0 nM
C=C[C@@]1(C)CC[C@](C)(C(C)C)c2cc3c4c(c[nH]c4c21)CC(=O)NC(=O)[C@H](C(C)C)N3C CHEMBL1807163 Ki 600.0 nM
CN(C)CCCn1nc(C2=C(c3cn(-c4csc5ccccc45)c4ccccc34)C(=O)NC2=O)c2ccccc21 CHEMBL426587 IC50 610.0 nM
CC(C)CC(C/C=C1/COC(CO)(COC(=O)C(C)(C)C)C1)CC(C)C CHEMBL194257 Ki 622.0 nM
CCCC(CCC)C(=O)OCC1(CO)C/C(=C\c2ccncc2)C(=O)O1 CHEMBL472523 Ki 627.0 nM
CN(C)CCCNC(=O)c1cc(NC(=O)c2cc(NC(=O)Cn3cc(C4=C(c5c[nH]c6ccccc56)C(=O)NC4=O)c4ccccc43)cn2C)cn1C CHEMBL429569 IC50 630.0 nM
CCCC(CC)OC(=O)c1cc(CO)cc(C(=O)OC(CC)CCC)c1 CHEMBL523053 Ki 661.0 nM
O=C1NC(=O)C(c2cn(CCCN3CCCC3)c3ccccc23)=C1Nc1ccccc1 CHEMBL184042 IC50 662.0 nM
CC(C)C(C/C=C1\CC(CO)(COC(=O)c2cccc(O)c2)OC1=O)C(C)C CHEMBL209616 Ki 670.0 nM
O=C1NC(=O)C2=C1c1cn(c3ccccc13)CCOCCOCCOCCn1cc2c2cccnc21 CHEMBL340935 IC50 673.0 nM
CCCCCCCCCCCC(=O)Oc1ccc2c(c1)[C@@](C)(C(C)C)[C@H]1C(=O)N[C@H](CO)[C@@H]21 CHEMBL173348 Ki 674.0 nM
NCCCNc1nc(-c2ccncc2)cc2cnccc12 CHEMBL2147544 IC50 676.0 nM
CC(C)C/C=C1\CC([C@H](CO)OC(=O)CC(C)C)OC1=O CHEMBL2111703 Ki 679.0 nM
CC(C)C(C/C=C1\CC([C@H](CO)OC(=O)CC(C(C)C)C(C)C)OC1=O)C(C)C CHEMBL320520 Ki 679.0 nM
O=C(Nc1ccccc1)c1cccc(NCc2nc(-c3ccncc3)n[nH]2)c1 CHEMBL4076320 IC50 680.0 nM
CC(C)=C1CC(CO)(COC(=O)c2cn(C)c3ccccc23)OC1=O CHEMBL4066764 Ki 698.0 nM
NC1=NC(=O)/C(=C2\CCNC(=O)c3[nH]c(Br)cc32)N1 CHEMBL361708 IC50 700.0 nM
O=C1NC(=O)C2=C1c1cn(c3ccccc13)CCO[C@H](CO)CCn1cc2c2ccccc21 CHEMBL292495 IC50 720.0 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 720.0 nM
O=C1NC(=O)C(c2cn(CCCN3CCCCC3)c3ccccc23)=C1Nc1ccccc1 CHEMBL187235 IC50 726.0 nM
Cc1cccc(NC2=C(c3cn(CCCN(C)C)c4ccccc34)C(=O)NC2=O)c1 CHEMBL369114 IC50 727.0 nM
CN(C)CCCCn1cc(C2=C(Nc3ccccc3)C(=O)NC2=O)c2ccccc21 CHEMBL184548 IC50 730.0 nM
O=C(CCCn1[se]c2ccccc2c1=O)N[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O CHEMBL1940999 IC50 730.0 nM
CCCCCCCC(=O)OCCCC1(CO)C/C(=C/CC(C(C)C)C(C)C)C(=O)O1 CHEMBL160544 Ki 736.0 nM
Cn1cc(C2=C(c3cccc(NCCCO)c3)C(=O)NC2=O)c2ccccc21 CHEMBL1082151 IC50 740.0 nM
CC(=O)OC[C@H]1O[C@@H](NC(=O)CCCn2[se]c3ccccc3c2=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O CHEMBL1940997 IC50 740.0 nM
CCCCCCCC/C=C\CCCCCCC/C=C1/C[C@](/C=C2/CCOC2=O)(CO)OC1=O CHEMBL138350 Ki 746.0 nM
CN(C)c1ccc(C(=O)OCC2(CO)C/C(=C\c3cnc4ccccc4c3)C(=O)O2)cc1 CHEMBL472183 Ki 755.0 nM
Cn1cc(C2=C(c3ccccc3Cl)C(=O)NC2=O)c2ccccc21 CHEMBL431933 IC50 760.0 nM
CN1CCOCCOCCN(C)CCn2cc(c3ccccc32)C2=C(C(=O)NC2=O)c2cn(c3ccccc23)CC1 CHEMBL105620 IC50 770.0 nM
NC1CCCN(c2nc(-c3ccncc3)cc3cnccc23)C1 CHEMBL2147543 IC50 771.0 nM
O=[N+]([O-])c1cccc(Nc2nccc(-c3cccnc3)n2)c1 CHEMBL56081 IC50 790.0 nM
CN(C)c1ccc(C(=O)OCC2(CO)C/C(=C\c3cccnc3)C(=O)O2)cc1 CHEMBL487484 Ki 790.0 nM
COc1ccc(C(=O)OCC2(CO)C/C(=C\c3cccnc3)C(=O)O2)cc1 CHEMBL471316 Ki 810.0 nM
NC(CNc1nc(-c2ccncc2)cc2cnccc12)Cc1ccccc1 CHEMBL2147539 IC50 818.0 nM
CCCCCCCCCCCCC/C=C1\CC(CO)(COS(C)(=O)=O)OC1=O CHEMBL48577 Ki 823.0 nM
C[C@H](N)CNc1nc(-c2ccncc2)cc2cnccc12 CHEMBL2147537 IC50 829.0 nM
FC(F)C(F)(F)Oc1cccc(Nc2nccc(-c3ccc(Cl)cc3)n2)c1 CHEMBL57581 IC50 850.0 nM
O=C(NC1CNCCC[C@H]1OC(=O)c1cc(O)c(C(=O)c2c(O)cccc2O)c(O)c1)c1ccc(O)cc1 CHEMBL328747 IC50 860.0 nM
CCCCCCCCCCc1cccc2c1C[C@@H](CO)OC(=O)[C@H](C(C)C)N2C CHEMBL103091 Ki 870.0 nM
CCCC(CCC)C(=O)OCC1(CO)C/C(=C/c2ccncc2)C(=O)O1 CHEMBL443643 Ki 870.0 nM
Cc1nc(Nc2n[nH]c3c2CN(C(=O)N[C@H](CN(C)C)c2ccccc2)C3(C)C)c2sccc2n1 CHEMBL3128043 Kd apparent 873.0 nM
CCCCCCCCCCCCCC(=O)O[C@@H]1CC(=O)O[C@H]1CCO CHEMBL281660 Ki 880.0 nM
CN1C/C=C/CCOc2cccc(c2)-c2ccnc(n2)Nc2cccc(c2)C1 CHEMBL1944698 Kd apparent 885.0 nM
NCCNc1nc(-c2ccncc2)cc2cnccc12 CHEMBL1214929 IC50 900.0 nM
CCN1CCOCCN(CC)CCn2cc(c3ccccc32)C2=C(C(=O)NC2=O)c2cn(c3ccccc23)CCOCC1 CHEMBL103421 IC50 910.0 nM
CS(=O)(=O)C1C[C@@H](NC(=O)c2ccc(O)cc2)[C@H](OC(=O)c2cc(O)c(C(=O)c3c(O)cccc3C(=O)O)c(O)c2)C1 CHEMBL306623 IC50 910.0 nM
O=C(N[C@@H]1CNC[C@H]1NC(=O)c1cc(O)c(C(=O)c2c(O)cccc2C(=O)O)c(O)c1)c1ccc(O)cc1 CHEMBL59677 IC50 920.0 nM
CCOC(=O)c1cccc(O)c1C(=O)c1c(O)cc(C(=O)O[C@@H]2CCC[C@H]2NC(=O)c2ccc(O)cc2)cc1O CHEMBL66452 IC50 920.0 nM
C1=N/C2=N/c3ccc(OCCN4CCCC4)c(c3)COC/C=C/COCc3cccc(c3)C(=C1)N2 CHEMBL2035187 Kd apparent 934.0 nM
CC(C)(N)CNc1nc(-c2ccncc2)cc2cnccc12 CHEMBL2147538 IC50 967.0 nM
CN1CCN(CCCn2cc(C3=C(Nc4ccccc4)C(=O)NC3=O)c3ccccc32)CC1 CHEMBL184146 IC50 968.0 nM
O=C1NCc2c1c1c3ccccc3[nH]c1c1[nH]c3ccc(O)cc3c21 CHEMBL4284524 IC50 980.0 nM
CC(C)C(C/C=C1/CC(CO)(COC(=O)c2ccc(O)cc2)OC1=O)C(C)C CHEMBL209665 Ki 983.0 nM