O=C(N[C@H]1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3CC2CC2)[C@H]1O5)c1cccc2cc[nH]c12 CHEMBL4595328 IC50 0.021 nM
Cc1cccc(CCN2CCC(C(=O)c3ccc(NS(C)(=O)=O)cc3)CC2)n1 CHEMBL327980 IC50 0.029 nM
Cc1ccc(CN2[C@@H]3CC[C@H]2C[C@H](Oc2cccc(C(N)=O)c2)C3)cc1 CHEMBL1257821 IC50 0.14 nM
Cc1cc2cccc(C(=O)N[C@H]3CC[C@@]4(O)[C@H]5Cc6ccc(O)c7c6[C@@]4(CCN5CC4CC4)[C@H]3O7)c2[nH]1 CHEMBL5432371 IC50 0.14 nM
NC(=O)c1cccc(O[C@@H]2C[C@H]3CC[C@@H](C2)N3CCCc2ccccc2)c1 CHEMBL1257820 IC50 0.25 nM
Cc1ccc(CN2[C@@H]3CC[C@H]2C[C@H](Oc2cccc(C(N)=O)c2)C3)s1 CHEMBL1257578 IC50 0.26 nM
CCCCCCCc1cccc(CCCCCCC)[n+]1C CHEMBL3590463 Ki 0.28 nM
NC(=O)c1cccc(O[C@@H]2C[C@H]3CC[C@@H](C2)N3CCc2ccccc2)c1 CHEMBL1257698 IC50 0.38 nM
CS(=O)(=O)Nc1ccc(CCN(CCOc2ccc(NS(C)(=O)=O)cc2)c2ccc([N+](=O)[O-])c3nonc23)cc1 CHEMBL227134 Ki 0.39 nM
O=C1COc2ccc(CNC34CCC(CCc5ccnc6cc(C(F)(F)F)cnc56)(CC3)OC4)nc2N1 CHEMBL3422978 IC50 0.39 nM
CCCCCCC[N+](CC)(CC)CCCCc1ccc(Cl)cc1 CHEMBL598270 Ki 0.4 nM
COC1OC2(CCN(Cc3ccccc3)CC2)c2cnn(-c3ccccc3)c21 CHEMBL410832 IC50 0.41 nM
NC(=O)c1cccc(O[C@@H]2C[C@H]3CC[C@@H](C2)N3Cc2cccs2)c1 CHEMBL1257577 IC50 0.43 nM
Cc1cccc(CN2[C@@H]3CC[C@H]2C[C@H](Oc2cccc(C(N)=O)c2)C3)c1 CHEMBL1257937 IC50 0.52 nM
CN1C[C@@H]2C[C@H]1CN2c1ccc(-c2ccc3sccc3c2)cn1 CHEMBL1085090 Ki 0.55 nM
CN1C[C@@H]2C[C@H]1CN2c1ncc(-c2ccc3sccc3c2)cn1 CHEMBL1085806 Ki 0.56 nM
NC(=O)c1cccc(O[C@@H]2C[C@H]3CC[C@@H](C2)N3Cc2ccccc2)c1 CHEMBL1223951 IC50 0.61 nM
Cc1ccccc1CN1[C@@H]2CC[C@H]1C[C@H](Oc1cccc(C(N)=O)c1)C2 CHEMBL1257938 IC50 0.62 nM
NC(=O)c1cccc(O[C@@H]2C[C@H]3CC[C@@H](C2)N3Cc2ccc3c(c2)OCO3)c1 CHEMBL1258280 IC50 0.62 nM
CCCCN1CCC2(CC1)OC(OC)c1c2cnn1-c1ccccc1 CHEMBL259732 IC50 0.65 nM
O=c1cc(OCc2ccc3ccccc3c2)ccn1-c1ccc(OCCN2CCCC2)cc1 CHEMBL1642479 IC50 0.67 nM
NC(=O)c1cccc(O[C@@H]2C[C@H]3CC[C@@H](C2)N3CC(=O)Nc2ccccc2)c1 CHEMBL1258503 IC50 0.72 nM
C[C@@H](c1ccccn1)c1c(CCN2CCC2)sc2ccccc12 CHEMBL1091775 Ki 0.73 nM
COc1nc2c(CCC34CCC(NCc5ccc6c(n5)NC(=O)CO6)(CC3)CO4)c(F)cnc2cc1F CHEMBL3422952 IC50 0.73 nM
CN(CCCCOc1ccc([N+](=O)[O-])cc1)CCc1ccc([N+](=O)[O-])cc1 CHEMBL3590452 Kd 0.73 nM
CC1CN(CCc2ccc([N+](=O)[O-])cc2)CCN1CCc1ccc([N+](=O)[O-])cc1 CHEMBL2146867 IC50 0.76 nM
CN(CCOc1ccc(-n2ccc(OCc3ccccc3)cc2=O)cc1)Cc1ccccc1 CHEMBL1642487 IC50 0.81 nM
Cc1nc2c(CCC34CCC(NCc5ccc6c(n5)NC(=O)CO6)(CC3)CO4)ccnc2cc1C#N CHEMBL3422970 IC50 0.87 nM
O=C1COc2ccc(CNC34CCC(CCc5c(F)cnc6cc(C(F)(F)F)cnc56)(CC3)OC4)nc2N1 CHEMBL3422959 IC50 0.89 nM
COc1ccc(CCN2CCC(Nc3nc4ccccc4n3Cc3ccc(F)cc3)CC2)cc1 CHEMBL296419 IC50 0.9 nM
NC(=O)c1cccc(O[C@@H]2C[C@H]3CC[C@@H](C2)N3C2CCCc3ccccc32)c1 CHEMBL1258725 IC50 0.95 nM
COC(=O)c1ccc2c(c1)NC(=O)/C2=C(\Nc1ccc(N2C(=O)CC[C@H]2CN2CCN(C)CC2)cc1)c1ccccc1 CHEMBL4171244 IC50 0.95 nM
O=C1COc2ccc(CNC34CCC(CCc5ccnc6ccc(C(F)(F)F)nc56)(CC3)OC4)nc2N1 CHEMBL3422977 IC50 0.99 nM
Oc1ccc(CCN2CCC(Nc3nc4ccccc4n3Cc3ccc(F)cc3)CC2)cc1 CHEMBL60796 pIC50 1.0 nM
CCc1cc(F)c2nc(N3CCC(NC4CCOCC4)CC3)c(-c3nc(C)no3)c(C)c2c1 CHEMBL4592045 IC50 1.0 nM
COCC(C)(C)C#Cc1c(Cl)c2c(Cl)cc(C(N)=O)nc2n1[C@H]1CCCNC1 CHEMBL4457529 IC50 1.1 nM
CCOc1cc(C)c2ncc(F)c(CCC34CCC(NCc5ccc6c(n5)NC(=O)CO6)(CC3)CO4)c2n1 CHEMBL3422954 IC50 1.19 nM
CN1C[C@@H]2C[C@H]1CN2c1cnc(-c2ccc3sccc3c2)cn1 CHEMBL1084022 Ki 1.2 nM
COc1ccc(COc2ccn(-c3ccc(OCCN4CCCC4)cc3)c(=O)c2)cc1 CHEMBL1642476 IC50 1.2 nM
CCCCCCC[N+](CC)(CC)CC#Cc1ccc(Cl)cc1 CHEMBL3140084 Kd 1.2 nM
CN(C)c1nc2c(CCC34CCC(NCc5ccc6c(n5)NC(=O)CO6)(CC3)CO4)ccnc2cc1F CHEMBL3422976 IC50 1.21 nM
CN1C[C@@H]2C[C@H]1CN2c1ncc(-c2ccc3occc3c2)cn1 CHEMBL1085805 Ki 1.3 nM
c1ccc(-c2cccc(O[C@@H]3C[C@H]4CC[C@@H](C3)N4)n2)cc1 CHEMBL1644470 Ki 1.3 nM
O=C(NC1CCN(Cc2ccc3c(c2)OCO3)CC1)c1cc(=O)c2cc(Cl)c(Cl)cc2o1 CHEMBL204828 IC50 1.4 nM
COC(=O)c1ccc2c(c1)NC(=O)/C2=C(\Nc1ccc(N2C(=O)CC[C@@H]2CN2CCN(C)CC2)cc1)c1ccccc1 CHEMBL4170680 IC50 1.4 nM
NC(=O)c1cc(Cl)c2c(Cl)c(C#CC3COCCO3)n([C@H]3CCCNC3)c2n1 CHEMBL4466764 IC50 1.4 nM
COc1cc2nccc(CCC34CCC(NCc5ccc6c(n5)NC(=O)CO6)(CC3)CO4)c2nc1OC CHEMBL3422964 IC50 1.43 nM
NC(=O)c1cccc(O[C@@H]2C[C@H]3CC[C@@H](C2)N3Cc2ccncc2)c1 CHEMBL1258047 IC50 1.5 nM
CCCCCCC[N+](CC)(CC)C/C=C/Cc1ccc(Cl)cc1 CHEMBL3093957 IC50 1.5 nM
CCCNC(=O)CCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O CHEMBL5272464 pIC50 1.585 nM
Cc1ccc(C(C)N2[C@@H]3CC[C@H]2C[C@H](Oc2cccc(C(N)=O)c2)C3)s1 CHEMBL1258616 IC50 1.6 nM
COc1nc2c(CCC34CCC(NCc5ccc6c(n5)NC(=O)CO6)(CC3)CO4)ccnc2cc1C#N CHEMBL3422966 IC50 1.6 nM
N#Cc1ccc2ncc(C#N)c(CCC34CCC(NCc5ccc6c(n5)NC(=O)CO6)(CC3)CO4)c2n1 CHEMBL3422962 IC50 1.66 nM
CCOC(=O)CCc1ccc(OC[C@H](O)CNC(C)(C)Cc2ccc3ccccc3c2)c(C#N)c1 CHEMBL1204009 IC50 1.7 nM
O=c1cc(OCc2ccc(Cl)cc2)ccn1-c1ccc(OCCN2CCCC2)cc1 CHEMBL1642475 IC50 1.7 nM
CCN(CC)CCN(C)c1ccc(-n2ccc(OCc3ccccc3)cc2=O)cc1 CHEMBL1642493 IC50 1.7 nM
COc1nc2c(CCC34CCC(NCc5ccc6c(n5)NC(=O)CO6)(CC3)CO4)c(F)cnc2cc1C(F)(F)F CHEMBL3422957 IC50 1.7 nM
NC(=O)c1cc(Cl)c2c(Cl)c(C#CC3CCOCC3)n([C@H]3CCCNC3)c2n1 CHEMBL4528544 IC50 1.7 nM
COc1cc(OC)c2nccc(CCC34CCC(NCc5ccc6c(n5)NC(=O)CO6)(CC3)CO4)c2n1 CHEMBL3422968 IC50 1.78 nM
CN1C[C@@H]2C[C@H]1CN2c1ccc(-c2ccc3sccc3c2)nn1 CHEMBL1083302 Ki 1.8 nM
C[C@@H](c1ccccc1)N1[C@@H]2CC[C@H]1C[C@H](Oc1cccc(C(N)=O)c1)C2 CHEMBL1257227 IC50 1.8 nM
CN1C[C@@H]2C[C@H]1CN2c1ncc(-c2ccc3[nH]c(C(F)(F)F)cc3c2)cn1 CHEMBL1086525 Ki 1.85 nM
CN1C[C@@H]2C[C@H]1CN2c1cnc(-c2ccc3[nH]c(C(F)(F)F)cc3c2)cn1 CHEMBL1082786 Ki 1.9 nM
NC(=O)c1cccc(O[C@@H]2C[C@H]3CC[C@@H](C2)N3Cc2ccccn2)c1 CHEMBL1258164 IC50 1.9 nM
O=c1cc(OCc2cccc(Cl)c2)ccn1-c1ccc(OCCN2CCCC2)cc1 CHEMBL1642474 IC50 1.9 nM
CCCCCCCCc1cccc(CCCCCCCC)[n+]1C CHEMBL3590464 Kd 1.9 nM
COc1cc2nccc(CCC34CCC(NCc5ccc6c(n5)NC(=O)CO6)(CC3)CO4)c2nc1C#N CHEMBL3422971 IC50 1.96 nM
CN1C[C@@H]2C[C@H]1CN2c1ccc(-c2ccc3[nH]c(C(F)(F)F)cc3c2)cn1 CHEMBL1086481 Ki 2.0 nM
NC(=O)c1cccc(O[C@@H]2C[C@H]3CC[C@@H](C2)N3CC2CCCCC2)c1 CHEMBL1258279 IC50 2.0 nM
COc1ccc([C@H]2CN(CCc3ccc(OC)c(OC)c3)C[C@@H]2CC(=O)Nc2cccc(Cl)c2)cc1 CHEMBL1760234 IC50 2.0 nM
COc1cc(N)c(Cl)cc1C(=O)N[C@H]1CCN(CCCOc2ccc(F)cc2)C[C@H]1OC CHEMBL74656 IC50 2.0 nM
Cc1cc(C#N)nc2c(CCC34CCC(NCc5ccc6c(n5)NC(=O)CO6)(CC3)CO4)ccnc12 CHEMBL3422973 IC50 2.08 nM
COc1ccc2ncc(C#N)c(CC(O)C34CCC(NCc5ccc6c(n5)NC(=O)CO6)(CC3)CO4)c2n1 CHEMBL3422983 IC50 2.13 nM
CCCCCCCN(CC)CCCCc1ccc([N+](=O)[O-])cc1 CHEMBL182977 pIC50 2.188 nM
CN1C[C@@H]2C[C@H]1CN2c1ccc(-c2ccc3[nH]c(C(F)(F)F)cc3c2)nn1 CHEMBL1083614 Ki 2.2 nM
CN(C)c1nc2c(CCC34CCC(NCc5ccc6c(n5)NC(=O)CO6)(CC3)CO4)ccnc2cc1C(F)(F)F CHEMBL3422975 IC50 2.29 nM
O=c1cc(OCc2ccc(C(F)(F)F)cc2)ccn1-c1ccc(OCCN2CCCC2)cc1 CHEMBL1642477 IC50 2.4 nM
Fc1ccc(N(CCNCCCc2ccccc2)c2ccc(F)cc2)cc1 CHEMBL2046893 IC50 2.4 nM
COc1nc2c(CCC34CCC(NCc5ccc6c(n5)NC(=O)CO6)(CC3)CO4)ccnc2cc1F CHEMBL3422965 IC50 2.49 nM
O=C(NC1CCN(Cc2ccc3c(c2)OCO3)CC1)c1cc(=O)c2ccc(Br)cc2o1 CHEMBL217706 IC50 2.5 nM
COc1ccccc1Oc1ccccc1CN1CCC2(CC1)CCN(C(=O)c1ccc(Cl)cc1)CC2 CHEMBL409224 pIC50 2.512 nM
COC(=O)c1ccc2c(c1)NC(=O)/C2=C(\Nc1ccc(N(C)C(=O)CN2CCN(C)CC2)cc1)c1ccccc1 CHEMBL502835 IC50 2.6 nM
C[C@@H]1CN(c2sc(C(F)(F)F)nc2-c2cnc(C(F)(F)F)nc2)CCN1C(=O)Cn1cnc(C#N)n1 CHEMBL5269745 IC50 2.6 nM
CN1C[C@@H]2C[C@H]1CN2c1ccc(-c2ccc3occc3c2)cn1 CHEMBL1085089 Ki 2.7 nM
O=C1NCCN1CCN1CCC(c2cn(-c3ccc(F)cc3)c3ccc(Cl)cc23)CC1 CHEMBL12713 IC50 2.7 nM
Cc1ccc(CN2[C@@H]3CC[C@H]2C[C@H](Oc2cccc(C(N)=O)c2)C3)o1 CHEMBL1255595 IC50 2.8 nM
Cc1ccc([C@@H](C)N2[C@@H]3CC[C@H]2C[C@H](Oc2cccc(C(N)=O)c2)C3)s1 CHEMBL1257347 IC50 2.8 nM
CN1C[C@@H]2C[C@H]1CN2c1ccc(-c2ccc3cc[nH]c3c2)cn1 CHEMBL1085779 Ki 2.9 nM
O=c1cc(OCc2cccc(F)c2)ccn1-c1ccc(OCCN2CCCC2)cc1 CHEMBL1642472 IC50 2.9 nM
COc1cc(C)c2ncc(F)c(CCC34CCC(NCc5ccc6c(n5)NC(=O)CO6)(CC3)CO4)c2n1 CHEMBL3422953 IC50 2.9 nM
CCc1ccn(CC(=O)N2CCN(c3sc(C(F)(F)F)nc3-c3cnc(C(F)(F)F)nc3)C[C@H]2CCO)n1 CHEMBL5279193 IC50 2.9 nM
CC(C)(Cc1ccc2ccccc2c1)NC[C@@H](O)COc1cccc(Cl)c1C#N CHEMBL180672 IC50 3.0 nM
Cc1ccc([C@@H](C)N2[C@@H]3CC[C@H]2C[C@H](Oc2cccc(C(N)=O)c2)C3)cn1 CHEMBL1257458 IC50 3.0 nM
CC(=O)Nc1cccc(C2CCN(CCCn3c(-c4ccc(Cl)cc4)nc4ccccc43)CC2)c1 CHEMBL1761103 IC50 3.0 nM
Cc1ccccc1[C@H]1C[C@@H](NCc2ccc(Cl)cc2)CC[C@@H]1C(=O)N1CC(c2ccccc2)(c2ccccc2)C1 CHEMBL3086045 IC50 3.0 nM
CCN(CCOc1ccc([N+](=O)[O-])cc1)CCc1ccc([N+](=O)[O-])cc1 CHEMBL3590446 Kd 3.0 nM
COCCC#Cc1c(Cl)c2c(Cl)cc(C(N)=O)nc2n1[C@H]1CCCNC1 CHEMBL4540910 IC50 3.0 nM
CC1(C#Cc2c(Cl)c3c(Cl)cc(C(N)=O)nc3n2[C@H]2CCCNC2)COC1 CHEMBL4470576 IC50 3.0 nM
CC(C)(C#N)CC#Cc1c(Cl)c2c(Cl)cc(C(N)=O)nc2n1[C@H]1CCCNC1 CHEMBL4445116 IC50 3.0 nM
O=c1[nH]c2ccccc2n1C1CCN(CCCC(c2ccc(F)cc2)c2ccc(F)cc2)CC1 CHEMBL1423 pIC50(uM) 3.02 nM
CC(CN1CCN(CCc2ccc([N+](=O)[O-])cc2)CC1)c1ccc([N+](=O)[O-])cc1 CHEMBL2146865 IC50 3.1 nM
CC(C)(Cc1ccc2ccccc2c1)NC[C@@H](O)COc1ccccc1C#N CHEMBL382741 IC50 3.2 nM
Nc1ccc2ncc(F)c(CCC34CCC(NCc5ccc6c(n5)NC(=O)CO6)(CC3)CO4)c2n1 CHEMBL3422948 IC50 3.21 nM
O=C1COc2ccc(CNC34CCC(CCc5c(F)cnc6cc(Cl)cnc56)(CC3)OC4)nc2N1 CHEMBL3422961 IC50 3.27 nM
COc1ccc(CCN2CCC(Nc3nc4ccccc4n3CC3CCCCC3)CC2)cc1 CHEMBL4207128 IC50 3.27 nM
C[C@H](c1ccc(Cl)nc1)N1[C@@H]2CC[C@H]1C[C@H](Oc1cccc(C(N)=O)c1)C2 CHEMBL1257579 IC50 3.3 nM
CCCCCCCCCc1cccc(CCCCCCCCC)[n+]1C CHEMBL3590465 Ki 3.4 nM
NC(=O)c1cccc(O[C@@H]2C[C@H]3CC[C@@H](C2)N3Cc2cccnc2)c1 CHEMBL1258048 IC50 3.5 nM
O=C(NC1CCN(Cc2ccc3c(c2)OCO3)CC1)c1cc(=O)c2ccc(Cl)cc2o1 CHEMBL217789 IC50 3.6 nM
O=C(NC1CCN(Cc2ccc3c(c2)OCO3)CC1)c1cc(=O)c2ccc(OC(F)F)cc2o1 CHEMBL213715 IC50 3.6 nM
CCN1CCCc2cc3c(cc21)OC1=CC2=[N+](CCCC(=O)N(CCOc4ccc(NS(C)(=O)=O)cc4)CCc4ccc(NS(C)(=O)=O)cc4)CCCC2=CC1N3 CHEMBL390301 Ki 3.6 nM
CC(c1ccncc1)N1[C@@H]2CC[C@H]1C[C@H](Oc1cccc(C(N)=O)c1)C2 CHEMBL1258962 IC50 3.7 nM
CNC(=O)N1CCN(Cc2ccnc(Nc3ncc(C#N)s3)c2C)CC1 CHEMBL376722 Inflection point 3.83 nM
N#Cc1ccc2ncc(F)c(CCC34CCC(NCc5ccc6c(n5)NC(=O)CO6)(CC3)CO4)c2n1 CHEMBL3422947 IC50 3.87 nM
CC(Cc1ccc([N+](=O)[O-])cc1)N1CCN(CCc2ccc([N+](=O)[O-])cc2)CC1 CHEMBL2146866 IC50 3.9 nM
C[C@@H]1CN(c2sc(C(F)(F)F)nc2-c2cnc(C(F)(F)F)nc2)CCN1C(=O)Cn1cnc(C(F)(F)F)n1 CHEMBL5284001 IC50 3.9 nM
CCCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ncccc2c1=O CHEMBL2146810 pIC50 3.981 nM
O=C(NC1CCN(Cc2ccc3c(c2)OCO3)CC1)c1cc(=O)c2cc(F)ccc2o1 CHEMBL214731 IC50 4.0 nM
COC(C)(C)CC#Cc1c(Cl)c2c(Cl)cc(C(N)=O)nc2n1[C@H]1CCCNC1 CHEMBL4541837 IC50 4.0 nM
C[C@@H]1OCC2(CCN(c3cnc4c(-c5cccc(Cl)c5Cl)n[nH]c4n3)CC2)[C@@H]1N CHEMBL4475043 IC50 4.0 nM
CN(CCOc1ccc(NS(C)(=O)=O)cc1)CCc1ccc(NS(C)(=O)=O)cc1 CHEMBL473 IC50 4.1 nM
COc1nc2c(CCC34CCC(NCc5ccc6c(n5)NC(=O)CO6)(CC3)CO4)ccnc2cc1Cl CHEMBL3422963 IC50 4.2 nM
COc1cc(CCC23CCC(NCc4ccc5c(n4)NC(=O)CO5)(CC2)CO3)c2nc(OC)ccc2n1 CHEMBL3422969 IC50 4.21 nM
CN(C/C=C/c1ccc(F)cc1C(F)(F)F)Cc1ccc2c(c1)OCO2 CHEMBL4161555 IC50 4.22 nM
CN1C[C@@H]2C[C@H]1CN2c1ncc(-c2ccc3[nH]ccc3c2)cn1 CHEMBL1086524 Ki 4.3 nM
O=c1cc(OCc2ccccc2F)ccn1-c1ccc(OCCN2CCCC2)cc1 CHEMBL1642471 IC50 4.3 nM
CC(C)N(CCOc1ccc(-n2ccc(OCc3ccccc3)cc2=O)cc1)C(C)C CHEMBL1642486 IC50 4.3 nM
CCCCCCCN(CC)CCCCc1ccc(Cl)cc1 CHEMBL3093959 IC50 4.3 nM
COC(=O)[C@H]1[C@@H](OC(=O)c2ccccc2)C[C@@H]2CC[C@H]1N2C CHEMBL370805 IC50 4.4 nM
CC1=C(c2ccc(OCCCN3CCCC3)cc2)Oc2ccccc2S1 CHEMBL560923 IC50 4.4 nM
COc1cccc([C@@H](C)N2[C@@H]3CC[C@H]2C[C@H](Oc2cccc(C(N)=O)c2)C3)c1 CHEMBL1257348 IC50 4.6 nM
C[C@@H]1CN(C(=O)[C@H]2CN(c3ccccn3)C[C@@H]2c2ccc(F)cc2F)C[C@H](C)[C@@]1(O)c1ccccc1 CHEMBL1089103 Ki 4.65 nM
CC(C[C@H](NC(=O)C1CCC1)c1ccccc1)N1CCC(n2cc(-c3ccccc3)[nH]c2=O)CC1 CHEMBL460009 IC50 4.7 nM
CC(C)(c1ccccc1)N1[C@@H]2CC[C@H]1C[C@H](Oc1cccc(C(N)=O)c1)C2 CHEMBL1258846 IC50 4.7 nM
NC(=O)c1cccc(O[C@@H]2C[C@H]3CC[C@@H](C2)N3C2(c3ccccc3)CC2)c1 CHEMBL1258961 IC50 4.8 nM
O=C(COc1ccc2ccccc2c1Br)Nc1cccnc1 CHEMBL1418045 Ki 4.8 nM
O=C1COc2ccc(CNC34CCC(CCc5c(F)cnc6ccc(O)nc56)(CC3)OC4)nc2N1 CHEMBL3422765 IC50 4.83 nM
Cc1ccccc1C(C)N1[C@@H]2CC[C@H]1C[C@H](Oc1cccc(C(N)=O)c1)C2 CHEMBL1258724 IC50 4.9 nM
CCCCCCCN(CC)CC#CCc1ccc(Cl)cc1 CHEMBL3093969 IC50 4.9 nM
O=C1COc2ccc(CNC34CCC(CCc5ccnc6cc(Cl)cnc56)(CC3)OC4)nc2N1 CHEMBL3422980 IC50 4.93 nM
N#Cc1ccc2c(=O)cc(C(=O)NC3CCN(Cc4ccc5c(c4)OCO5)CC3)oc2c1 CHEMBL387417 IC50 5.0 nM
CCC[S+]([O-])CCCN(CC)CC(O)COc1ccc(C#N)cc1 CHEMBL362103 IC50 5.0 nM
C[C@@H]1Sc2ccccc2O[C@@H]1c1ccc(OCCCN2CCCC2)cc1 CHEMBL557853 IC50 5.0 nM
C[C@@H]1CN(C(=O)[C@@H]2CN(C(C)(C)C)C[C@H]2c2ccc(F)cc2F)C[C@H](C)[C@@]1(O)c1c(F)cccc1F CHEMBL1092550 Ki 5.0 nM
c1cc(-c2ccc3c(c2)OCO3)ccc1OCCCN1CCCCC1 CHEMBL1822858 Ki 5.0 nM
O=[N+]([O-])c1ccc(CCN2CCN(CCc3ccc([N+](=O)[O-])cc3)CC2)cc1 CHEMBL2146755 IC50 5.0 nM
NC(=O)c1cc(Cl)c2c(Cl)c(C#CC3CCCO3)n([C@H]3CCCNC3)c2n1 CHEMBL4518492 IC50 5.0 nM
CC1(CC#Cc2c(Cl)c3c(Cl)cc(C(N)=O)nc3n2[C@H]2CCCNC2)COC1 CHEMBL4457389 IC50 5.0 nM
Cc1ccn(CC(=O)N2CCN(c3sc(C(F)(F)F)nc3-c3cnc(C(F)(F)F)nc3)C[C@H]2CCO)n1 CHEMBL5282172 IC50 5.0 nM
C[C@@H]1CN(C(=O)[C@H]2CN(c3cccnc3)C[C@@H]2c2ccc(F)cc2F)C[C@H](C)[C@@]1(O)c1ccccc1 CHEMBL1089104 Ki 5.07 nM
Cc1ccc(CCN(C)CCOc2ccc(C)cc2)cc1 CHEMBL2324254 IC50 5.1 nM
Cc1ccn(CC(=O)N2CCN(c3sc(C(F)(F)F)nc3-c3cnc(C(F)(F)F)nc3)C[C@H]2C)n1 CHEMBL5287805 IC50 5.1 nM
COc1cc(C)c2nccc(CCC34CCC(NCc5ccc6c(n5)NC(=O)CO6)(CC3)CO4)c2n1 CHEMBL3422967 IC50 5.22 nM
CN1C[C@@H]2C[C@H]1CN2c1cnc(-c2ccc3occc3c2)cn1 CHEMBL1084021 Ki 5.3 nM
COc1ccc(CN2CCC(NC(=O)c3cc(=O)c4ccc(F)cc4o3)CC2)cc1 CHEMBL217593 IC50 5.4 nM
O=C(NC1CCN(Cc2ccc3c(c2)OC(F)(F)O3)CC1)c1cc(=O)c2ccc(F)cc2o1 CHEMBL217707 IC50 5.6 nM
O=c1cc(OCc2ccccc2)ccn1-c1ccc(OCCN2CCCCC2)cc1 CHEMBL1642482 IC50 5.8 nM
CN1CCCCC1COc1ccc(-n2ccc(OCc3ccccc3)cc2=O)cc1 CHEMBL1642490 IC50 5.8 nM
CC(C)c1ncn(CC(=O)N2CCN(c3sc(C(F)(F)F)nc3-c3cnc(C(F)(F)F)nc3)C[C@H]2CCO)n1 CHEMBL5277841 IC50 5.8 nM
C[C@@H]1CN(C(=O)[C@@H]2CN(C(C)(C)C)C[C@H]2c2ccc(F)cc2F)C[C@H](C)[C@@]1(O)c1ccccn1 CHEMBL1089830 Ki 5.84 nM
C[C@@H]1CN(C(=O)[C@H]2CN(C3CCC3)C[C@@H]2c2ccc(F)cc2F)C[C@H](C)[C@@]1(O)c1ccccc1 CHEMBL1092571 Ki 5.87 nM
CC(c1ccccc1)N1[C@@H]2CC[C@H]1C[C@H](Oc1cccc(C(N)=O)c1)C2 CHEMBL1258615 IC50 6.0 nM
CC(=O)NCCc1ccccc1-c1ccc([C@@H](CN)Cc2ccc(OCCOc3c(Cl)cc(C)cc3Cl)cc2)c(C)c1 CHEMBL1957798 IC50 6.0 nM
C[n+]1c(CCCOc2ccc(Cl)cc2)cccc1CCCOc1ccc(Cl)cc1 CHEMBL2324244 Ki 6.0 nM
NC(=O)c1cc(Cl)c2c(Cl)c(C#CC3CNCCO3)n([C@H]3CCCNC3)c2n1 CHEMBL4583118 IC50 6.0 nM
Fc1ccc(-n2cc(C3CCN(CCN4CCN=C4S)CC3)c3ccccc32)cc1 CHEMBL298978 pIC50 6.166 nM
O=C(NC1CCN(Cc2ccc3c(c2)OCO3)CC1)c1cc(=O)c2cc(F)c(F)cc2o1 CHEMBL387178 IC50 6.2 nM
Cc1ccc2c(-c3nnc(SCCCN4CCc5cc6c(cc5CC4)OCC(=O)N6)n3C)cccc2n1 CHEMBL271066 pIC50 6.31 nM
COc1cc(N)c(Cl)cc1C(=O)NC1CCN(CCCOc2ccc(F)cc2)CC1OC CHEMBL1729 Log IC50 6.457 nM
O=C(c1ccc(Cl)cc1)N1CCC2(CCN(Cc3ccccc3Oc3ccccc3)CC2)CC1 CHEMBL259243 pIC50 6.457 nM
CS(=O)(=O)Cc1ccc(CN2[C@@H]3CC[C@H]2C[C@H](Oc2cccc(C(N)=O)c2)C3)cc1 CHEMBL1258391 IC50 6.6 nM
C[C@@H]1CN(C(=O)[C@@H]2CNC[C@H]2c2ccc(F)cc2F)C[C@H](C)[C@@]1(O)c1ccccc1 CHEMBL1092209 Ki 6.65 nM
O=C(NC1CCN(Cc2ccc3c(c2)OCO3)CC1)c1cc(=O)c2ccccc2o1 CHEMBL214767 IC50 6.7 nM
Cc1cc(S(C)(=O)=O)nc2c(CCC34CCC(NCc5ccc6c(n5)NC(=O)CO6)(CC3)CO4)ccnc12 CHEMBL3422974 IC50 6.71 nM
O=C1NCCN1CCN1CCC(c2cn(-c3ccc(F)cc3)c3ccccc23)CC1 CHEMBL12780 pIC50 6.918 nM
CC1(C)C2=C3CC4C5=[N+](CCC4OC3CCN2c2ccc(CC(=O)NCCCCCCN(CCOc3ccc(NS(C)(=O)=O)cc3)CCc3ccc(NS(C)(=O)=O)cc3)cc21)c1ccc(S(=O)(=O)[O-])cc1C5(C)C CHEMBL227000 Ki 7.0 nM
CCN(CC)CCNc1ccc(-n2ccc(OCc3ccccc3)cc2=O)cc1 CHEMBL1642492 IC50 7.0 nM
COc1ccc(CCN2CCN(CCc3ccc([N+](=O)[O-])cc3)CC2)cc1 CHEMBL2146861 IC50 7.0 nM
C[C@@H]1OCC2(CCN(c3cnc4c(-c5cccc(Cl)c5Cl)c[nH]c4n3)CC2)[C@@H]1N CHEMBL4475081 IC50 7.0 nM
CC(C)c1ncn(CC(=O)N2CCN(c3sc(C(F)(F)F)nc3-c3cnc(C(F)(F)F)nc3)C[C@H]2C)n1 CHEMBL5274429 IC50 7.0 nM
NC(=O)c1cccc(O[C@@H]2C[C@H]3CC[C@@H](C2)N3CC2CC2)c1 CHEMBL1258166 IC50 7.3 nM
O=C(Cn1cnc(C2CC2)n1)N1CCN(c2sc(C(F)(F)F)nc2-c2cnc(C(F)(F)F)nc2)C[C@H]1CCO CHEMBL5284795 IC50 7.3 nM
CCc1ccc2c(=O)cc(C(=O)NC3CCN(Cc4ccc5c(c4)OCO5)CC3)oc2c1 CHEMBL214377 IC50 7.4 nM
C[C@@H]1CN(c2sc(C(F)(F)F)nc2-c2cnc(C(F)(F)F)nc2)CCN1C(=O)Cn1cnc(C(C)(C)C)n1 CHEMBL5277205 IC50 7.5 nM
CCOC(=O)c1c(OC)cnc2c(CCC34CCC(NCc5ccc6c(n5)NC(=O)CO6)(CC3)CO4)ccnc12 CHEMBL3422982 IC50 7.87 nM
C[C@@H]1CN(C(=O)[C@@H]2CN(C(C)(C)C)C[C@H]2c2ccc(F)cc2F)C[C@H](C)[C@@]1(O)c1ccc(F)cc1 CHEMBL1204061 Ki 7.91 nM
Cc1ccc2c(N3CCN(CCc4ccc5c(c4)NC(=O)CO5)CC3)cccc2n1 CHEMBL490417 pEC50 7.943 nM
O=C1N(CCN2CCC(c3ccc(Cl)cc3)CC2)CCN1c1cccc(Cl)c1 CHEMBL561128 pIC50 7.943 nM
CS(=O)(=O)Nc1ccc2c(c1)C(=O)CC1(CCN(CCc3ccc4nonc4c3)CC1)O2 CHEMBL129583 IC50 8.0 nM
c1ccc(-c2cnc(Nc3ccc(CN4CCCC4)cn3)s2)cc1 CHEMBL98475 Inflection point 8.0 nM
CCOC(=O)c1ccc(-c2ccc(OCCCN3CCCCC3)cc2)cc1 CHEMBL1822861 Ki 8.0 nM
O=c1ccc2ncc(F)c3c2n1C[C@@]3(O)CC12CCC(NC/C=C/c3cc(F)ccc3F)(CC1)CO2 CHEMBL3425935 IC50 8.0 nM
O=c1cc(OCc2ccccc2)ccn1-c1ccc(OCCN2CCCC2)cc1 CHEMBL1641614 IC50 8.1 nM
CN(C)c1ccc2ncc(F)c(CCC34CCC(NCc5ccc6c(n5)NC(=O)CO6)(CC3)CO4)c2n1 CHEMBL3422949 IC50 8.35 nM
COc1ccc(CN2CCC(NC(=O)c3cc(=O)c4ccc(F)cc4o3)CC2)cc1F CHEMBL214768 IC50 8.5 nM
CCc1ccn(CC(=O)N2CCN(c3sc(C(F)(F)F)nc3-c3cnc(C(F)(F)F)nc3)C[C@H]2CO)n1 CHEMBL5266293 IC50 8.6 nM
COc1ccc([C@H]2CC[C@@H](N3CC(NC(=O)CNc4noc5ccc(C(F)(F)F)cc45)C3)CC2)cn1 CHEMBL1834852 IC50 8.7 nM
CCc1nc(C)n(CC(=O)N2CCN(c3sc(C(F)(F)F)nc3-c3cnc(C(F)(F)F)nc3)C[C@H]2C)n1 CHEMBL5290851 IC50 8.7 nM
COC(=O)c1ccc2ncc(F)c(CCC34CCC(NCc5ccc6c(n5)NC(=O)CO6)(CC3)CO4)c2n1 CHEMBL3422768 IC50 8.75 nM
CN1C[C@@H]2C[C@H]1CN2c1ccc(-c2ccc3occc3c2)nn1 CHEMBL1083301 Ki 8.8 nM
CC(C)(C)c1ccc(C(O)CCCN2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)cc1 CHEMBL17157 IC50 8.9 nM
CN1C[C@@H]2C[C@H]1CN2c1cnc(-c2ccc3cc[nH]c3c2)cn1 CHEMBL1086506 Ki 9.0 nM
O=c1cc(OCc2ccc(F)cc2)ccn1-c1ccc(OCCN2CCCC2)cc1 CHEMBL584538 IC50 9.0 nM
N#Cc1ccc(CCN2CCN(CCc3ccc([N+](=O)[O-])cc3)CC2)cc1 CHEMBL2146757 IC50 9.0 nM
O=C(Nc1ccc(OC(F)(F)F)cc1)c1ccc(OCCN2CCCC2)c(-c2cncnc2)c1 CHEMBL3908521 IC50 9.0 nM
CN1CCCC1COc1ccc(-n2ccc(OCc3ccccc3)cc2=O)cc1 CHEMBL1642491 IC50 9.3 nM
CCCCCCCN(CC)C/C=C/Cc1ccc(Cl)cc1 CHEMBL3093986 Ki 9.5 nM
Cc1c([C@@H](O)CN2CCC3(CC2)CCN(c2cc(-c4ccccc4)ns2)C3=O)ccc2c1COC2=O CHEMBL4093627 IC50 9.5 nM
CCN(CC)CCOc1ccc(-n2ccc(OCc3ccccc3)cc2=O)cc1 CHEMBL1642485 IC50 9.8 nM
CCc1ncn(CC(=O)N2CCN(c3sc(C(F)(F)F)nc3-c3cnc(C(F)(F)F)nc3)C[C@H]2CCO)n1 CHEMBL5272415 IC50 9.8 nM
N#Cc1cnc(Nc2cc(CN3CCN(C(=O)CO)CC3)ccn2)s1 CHEMBL222852 Inflection point 9.871 nM
Clc1ccc(OCCCc2cccc(CCCOc3ccc(Cl)cc3)n2)cc1 CHEMBL2324257 IC50 9.9 nM
O=C1NCCN1CCN1CC=C(c2cn(-c3ccc(F)cc3)c3ccc(Cl)cc23)CC1 CHEMBL12186 IC50 10.0 nM
CCCCCCCN(CC)CCCC(O)c1ccc(NS(C)(=O)=O)cc1 CHEMBL533 pIC50 10.0 nM
CC1(C)C2=C3C=C4C5=[N+](CCC4OC3CCN2c2ccc(CCCCCC(=O)NCCCCCCN(CCOc3ccc(NS(C)(=O)=O)cc3)CCc3ccc(NS(C)(=O)=O)cc3)cc21)c1ccc(S(=O)(=O)[O-])cc1C5(C)C CHEMBL226704 Ki 10.0 nM
Cc1cc(-c2ccc3c(c2)CCN(CCCSc2nnc(-c4ccc(Cl)c(Cl)c4)n2C)CC3)no1 CHEMBL397222 pIC50 10.0 nM
CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O CHEMBL584549 IC50 10.0 nM
CN1C[C@@H]2C[C@H]1CN2c1ccc(-c2ccccc2)cn1 CHEMBL1085824 Ki 10.0 nM
COc1ccc(OC)c(NC(=S)NC(=O)c2ccc(Br)o2)c1 CHEMBL1335175 EC50 10.0 nM
CC(=O)N[C@@H](CCN1[C@@H]2CC[C@H]1C[C@@H](n1c(C)nc3c1CCN(c1ccncn1)C3)C2)c1cccc(F)c1 CHEMBL1649928 IC50 10.0 nM
CC(C)(C)c1cc(CN2CCC(CNCCCCCC(c3ccc(F)cc3)c3ccc(F)cc3)C2)cc(C(C)(C)C)c1O CHEMBL2031999 IC50 10.0 nM
Cn1cc2c(OCC3CCN(CCc4ccc(CO)cc4)CC3)nc3ccccc3c2c1 CHEMBL2179672 IC50 10.0 nM
CNCCC(Oc1ccc(C(F)(F)F)cc1)c1ccccc1 CHEMBL41 IC50 10.0 nM
O=C(CCCN1CCC(O)(c2ccc(Cl)cc2)CC1)c1ccc(F)cc1 CHEMBL54 IC50 10.0 nM
COc1ccc(CCN(C)CCCC(C#N)(c2ccc(OC)c(OC)c2)C(C)C)cc1OC CHEMBL6966 IC50 10.0 nM
CN(C)CCCC1(c2ccc(F)cc2)OCc2cc(C#N)ccc21 CHEMBL549 IC50 10.0 nM
Clc1cccc(N2CCN(CCCCNc3ccc4ccccc4n3)CC2)c1Cl CHEMBL1223683 Ki 10.0 nM
Cc1cccc(CCN2CCC(C(=O)c3ccc(NS(C)(=O)=O)cc3)CC2)n1 CHEMBL536480 IC50 10.0 nM
COc1cccc(CN2CCC(NC(=O)c3cc(=O)c4ccc(F)cc4o3)CC2)c1 CHEMBL217400 IC50 10.4 nM
O=C(NC1CCN(Cc2ccc3c(c2)OCO3)CC1)c1cc(=O)c2cc(F)c(Cl)cc2o1 CHEMBL387418 IC50 10.5 nM
CN(C)Cc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12 CHEMBL301956 pIC50 10.96 nM
O=C1NC(=O)C(c2nn(CCCN3CCCC3)c3ccccc23)=C1c1cn(-c2ccc3ccccc3c2)c2ccccc12 CHEMBL367107 Ki 11.0 nM
CN(C)c1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12 CHEMBL513608 IC50 11.0 nM
CC[C@@H]1Sc2ccccc2O[C@@H]1c1ccc(OCCCN2CCCC2)cc1 CHEMBL549433 IC50 11.0 nM
CN1C[C@@H]2C[C@H]1CN2c1ccc(-c2ccc3[nH]ccc3c2)cn1 CHEMBL1086480 Ki 11.0 nM
O=C(CNc1noc2ccc(C(F)(F)F)cc12)NC1CN([C@H]2CC[C@@H](c3nccs3)CC2)C1 CHEMBL1834854 IC50 11.0 nM
O=[N+]([O-])c1ccc(CCN2CCN(CCc3ccc(-n4cnnn4)cc3)CC2)cc1 CHEMBL2441429 IC50 11.0 nM
O=C(COc1ccc(C(=O)c2cc(Cl)ccc2Br)cc1)Nc1cccc(C(=O)NC2CC2)c1 CHEMBL4785272 IC50 11.2 nM
O=C1COc2ccc(CNC34CCC(CCc5c(F)cnc6ccc(N7CCOCC7)nc56)(CC3)OC4)nc2N1 CHEMBL3422950 IC50 11.46 nM
COc1ccc2c(=O)cc(C(=O)NC3CCN(Cc4ccc5c(c4)OCO5)CC3)oc2c1 CHEMBL206081 IC50 11.5 nM
COc1ccc(CC(C)(C)NC[C@H](O)COc2cccc3[nH]c(=O)[nH]c23)cc1 CHEMBL486278 IC50 11.8 nM
c1ccc([C@@H]2Sc3ccccc3O[C@@H]2c2ccc(OCCCN3CCCC3)cc2)cc1 CHEMBL564514 IC50 12.0 nM
CN1C[C@@H]2C[C@H]1CN2c1ccc(-c2ccc3cc[nH]c3c2)nn1 CHEMBL1083615 Ki 12.0 nM
Cc1cc2cc(-c3ccc(N4C[C@@H]5C[C@H]4CN5C)nn3)ccc2[nH]1 CHEMBL1083616 Ki 12.0 nM
N#Cc1ccc(CCN2CCN(CCc3ccc(C#N)cc3)CC2)cc1 CHEMBL2146868 IC50 12.0 nM
CCCCCCc1cccc(CCCCCC)[n+]1C CHEMBL3590462 Ki 12.0 nM
O=[N+]([O-])c1ccc(NCCCCN2CCC(Nc3nc4ccccc4n3Cc3ccc(F)cc3)CC2)c2nonc12 CHEMBL3805898 Ki 12.0 nM
CCc1nc(C)nn1CC(=O)N1CCN(c2sc(C(F)(F)F)nc2-c2cnc(C(F)(F)F)nc2)C[C@H]1C CHEMBL5290634 IC50 12.0 nM
CCc1ncn(CC(=O)N2CCN(c3sc(C(F)(F)F)nc3-c3cnc(C(F)(F)F)nc3)C[C@H]2C)n1 CHEMBL5276329 IC50 12.0 nM
Cc1ccn(CC(=O)N2CCN(c3sc(C(F)(F)F)nc3-c3cnc(C(F)(F)F)nc3)C[C@@H]2CCO)n1 CHEMBL5271152 IC50 12.0 nM
Cc1csc([C@@]2(CN)[C@@H]3CCN(c4cnc5c(-c6ccn7nccc7c6Cl)n[nH]c5n4)C[C@@H]32)n1 CHEMBL5282278 IC50 12.0 nM
O=C(NC1CCN(Cc2ccc3c(c2)OCCO3)CC1)c1cc(=O)c2ccc(F)cc2o1 CHEMBL425448 IC50 12.2 nM
Cc1cc(S(C)(=O)=O)nc2c(CCC34CCC(NCc5ccc6c(n5)NC(=O)CO6)(CC3)CO4)c(F)cnc12 CHEMBL3422958 IC50 12.38 nM
CCCCCCC[N+](CC)(CC)CCCCc1ccc(Cl)cc1 CHEMBL9484 pIC50 12.59 nM
Cc1ccc(O)c([C@H](CCN(C(C)C)C(C)C)c2ccccc2)c1 CHEMBL1382 pIC50 12.59 nM
N#Cc1cccc(NC(=O)COc2ccc(C(=O)c3cc(Cl)ccc3Br)cc2)c1F CHEMBL4791914 IC50 12.7 nM
Cc1ccc(C#N)cc1NC(=O)COc1ccc(C(=O)c2cc(Cl)ccc2Br)cc1 CHEMBL4799702 IC50 12.8 nM
CC1(C)C2=C3C=C4C5=[N+](CCC4OC3CCN2c2ccc(CC(=O)NCCCCCN(CCOc3ccc(NS(C)(=O)=O)cc3)CCc3ccc(NS(C)(=O)=O)cc3)cc21)c1ccc(S(=O)(=O)[O-])cc1C5(C)C CHEMBL226743 Ki 13.0 nM
CN1C[C@@H]2C[C@H]1CN2c1ncc(-c2cccc3[nH]ccc23)cn1 CHEMBL1085599 Ki 13.0 nM
C[C@H](c1ccccc1)N1[C@@H]2CC[C@H]1C[C@H](Oc1cccc(C(N)=O)c1)C2 CHEMBL1257226 IC50 13.0 nM
C[C@H](c1ccnc(Cl)c1)N1[C@@H]2CC[C@H]1C[C@H](Oc1cccc(C(N)=O)c1)C2 CHEMBL1257459 IC50 13.0 nM
c1cc(C2CCCCC2)ccc1OCCCN1CCCCC1 CHEMBL1822854 Ki 13.0 nM
CCc1ncnn1CC(=O)N1CCN(c2sc(C(F)(F)F)nc2-c2cnc(C(F)(F)F)nc2)C[C@H]1C CHEMBL5268766 IC50 13.0 nM
Cc1ccn(CC(=O)N2CCN(c3sc(C(F)(F)F)nc3-c3cnc(C(F)(F)F)nc3)C[C@H]2CO)n1 CHEMBL5291251 IC50 13.0 nM
COc1cc2nccc(CCC34CCC(NCc5ccc6c(n5)NC(=O)CO6)(CC3)CO4)c2nc1C(=O)O CHEMBL3422972 IC50 13.09 nM
O=C(NC1CCN(Cc2cc3c(cc2Cl)OCO3)CC1)c1cc(=O)c2ccc(F)cc2o1 CHEMBL217105 IC50 13.5 nM
COc1cc2ncc(F)c(CCC34CCC(NCc5ccc6c(n5)NC(=O)CO6)(CC3)CO4)c2nc1OC CHEMBL3421646 IC50 13.91 nM
CS(=O)(=O)Nc1ccc(CCCNCCNc2ccc(Cl)c(Cl)c2)cc1 CHEMBL594615 Ki 14.0 nM
CN1C[C@@H]2C[C@H]1CN2c1cnc(-c2ccc3[nH]ccc3c2)cn1 CHEMBL1082466 Ki 14.0 nM
c1csc(-c2ccc(OCCCN3CCCCC3)cc2)c1 CHEMBL1822688 Ki 14.0 nM
CN(C/C=C/C=C/c1ccc(C(F)(F)F)cc1F)Cc1ccc2c(c1)OCO2 CHEMBL4162120 IC50 14.0 nM
Cc1cnc(Nc2ccnn2C)nc1-c1cc2n(c1)C(=O)N([C@H](CO)c1cccc(Cl)c1)C2 CHEMBL5070887 IC50 14.0 nM
Cc1cnccc1NC(=O)COc1ccc(C(=O)c2cc(Cl)ccc2Br)cc1 CHEMBL4790592 IC50 14.1 nM
COc1ccc(CN2CCC(NC(=O)c3cc(=O)c4ccc(F)cc4o3)CC2)c(F)c1 CHEMBL387309 IC50 14.7 nM
CS(=O)(=O)Nc1ccc(CCN(CCCCCCNC(=O)c2ccc3c(c2)C(=O)OC32c3ccc(O)cc3Cc3cc(O)ccc32)CCOc2ccc(NS(C)(=O)=O)cc2)cc1 CHEMBL375516 Ki 15.0 nM
NC(=O)c1cccc(O[C@@H]2C[C@H]3CC[C@@H](C2)N3C2CCCCC2)c1 CHEMBL1258845 IC50 15.0 nM
CCCCCCCCc1cccc(CCCCCCCC)[n+]1C CHEMBL2325208 IC50 15.0 nM
O=C(NC1CCN(Cc2ccc3c(c2)OCO3)CC1)c1cc(=O)c2ccc(F)cc2o1 CHEMBL214021 IC50 15.1 nM
COc1cnc2c(CCC34CCC(NCc5ccc6c(n5)NC(=O)CO6)(CC3)CO4)ccnc2c1 CHEMBL3422979 IC50 15.62 nM
Cc1cccc(C)c1NC(=O)CN1CCN(CCCC(c2ccc(F)cc2)c2ccc(F)cc2)CC1 CHEMBL92870 pIC50 15.85 nM
c1ccc(CCCNCCC(c2ccccc2)c2ccccc2)cc1 CHEMBL2046889 pIC50 15.85 nM
CCCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O CHEMBL2146802 pIC50 15.85 nM
COc1cc2oc(C(=O)NC3CCN(Cc4ccc5c(c4)OCO5)CC3)cc(=O)c2cc1F CHEMBL217442 IC50 15.9 nM
CCOC(=O)C1CCCN(C(=N)c2ccc(C(=O)Nc3ccc(Cl)cc3C(=O)Nc3ccc(Cl)cn3)cc2)C1 CHEMBL218735 Ki 16.0 nM
CC(C)[C@]1(C(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC[C@@H](N2CCC(c3ccc(F)cc3)CC2)C1 CHEMBL428594 IC50 16.0 nM
OC1CCN(CCCOc2ccc(-n3c(-c4ccccn4)nc4cc(F)ccc43)cc2)CC1 CHEMBL526450 Ki 16.0 nM
COc1ccc([C@H]2CN(CCc3ccc(OC)c(OC)c3)C[C@@H]2CCc2nc3ccc(Cl)cc3[nH]2)cc1 CHEMBL1760243 IC50 16.0 nM
O=C(CNc1noc2ccc(C(F)(F)F)cc12)NC1CN([C@H]2CC[C@@H](c3cncs3)CC2)C1 CHEMBL1834853 IC50 16.0 nM
O=c1ccc2ncc(F)c3c2n1C[C@@]3(O)CC12CCC(NC/C(F)=C\c3cc(F)ccc3F)(CC1)CO2 CHEMBL3425937 IC50 16.0 nM
O=c1ccc2ncc(F)c3c2n1C[C@@]3(O)CC12CCC(NC/C(F)=C/c3cc(F)ccc3F)(CC1)CO2 CHEMBL3425938 IC50 16.0 nM
O=c1ccc2ncc(F)c3c2n1C[C@@]3(O)CC12CCC(NCc3cc(-c4cccs4)on3)(CC1)CO2 CHEMBL3425943 IC50 16.0 nM
CSc1ccccc1C(=O)NCCCC[C@H](NC(=O)c1cncs1)c1ncc(-c2ccc3ccccc3c2)[nH]1 CHEMBL4763995 IC50 16.0 nM
Cc1ncnn1CC(=O)N1CCN(c2sc(C(F)(F)F)nc2-c2cnc(C(F)(F)F)nc2)C[C@H]1C CHEMBL5273485 IC50 16.0 nM
O=C1COc2ccc(CNC34CCC(CCc5ccnc6cc(F)cnc56)(CC3)OC4)nc2N1 CHEMBL3422981 IC50 16.75 nM
CCOC(=O)C1CCN(C(=N)c2ccc(C(=O)Nc3ccc(Cl)cc3C(=O)Nc3ccc(Cl)cn3)cc2)CC1 CHEMBL218074 Ki 17.0 nM
Nc1ccnc(N2CCC(C(=O)Nc3ccc4ccccc4n3)(c3ccccc3)CC2)c1 CHEMBL521830 Ki 17.0 nM
O=C(c1ccc(CN2CCC3(CC2)OCc2cc(F)ncc23)cc1)c1ccc(F)c(F)c1 CHEMBL566257 IC50 17.0 nM
CCCCCCCCCCc1cccc(CCCCCCCCCC)[n+]1C CHEMBL3590466 Ki 17.0 nM
c1ccc(-c2ccc(-c3c[nH]c([C@H]4Cc5c([nH]c6ccccc56)[C@@H](C5CCOCC5)N4)n3)cc2)cc1 CHEMBL3775414 IC50 17.0 nM
Cc1ncn(CC(=O)N2CCN(c3sc(C(F)(F)F)nc3-c3cnc(C(F)(F)F)nc3)C[C@H]2C)n1 CHEMBL5274784 IC50 17.0 nM
CC(C)c1ncn(CC(=O)N2CCN(c3sc(C(F)(F)F)nc3-c3cnc(C(F)(F)F)nc3)C[C@@H]2CO)n1 CHEMBL5289006 IC50 17.0 nM
O=C(COc1ccc(C(=O)c2cc(Cl)ccc2Br)cc1)Nc1ccnc(C(=O)NCC2CC2)c1 CHEMBL4781787 IC50 17.5 nM
O=C(COc1ccc(C(=O)c2cc(Cl)ccc2Br)cc1)Nc1ccnc(F)c1 CHEMBL4779384 IC50 17.6 nM
c1ccc(-c2[nH]c3ccccc3c2C2CC3CCC(C2)N3c2ccccc2)cc1 CHEMBL1671894 pIC50 17.78 nM
O=C(COc1ccc(C(=O)c2cc(Cl)ccc2Br)cc1)Nc1ccc(Cl)c(C(=O)NCC2CC2)c1 CHEMBL4748494 IC50 17.8 nM
c1ccc(CCN2[C@@H]3CC[C@H]2CC(c2c(-c4ccccc4)[nH]c4ccccc24)C3)cc1 CHEMBL2113667 Ki 18.0 nM
CC1(C)C2=C3C=C4C5=[N+](CCC4OC3CCN2c2ccc(CC(=O)NCCCCN(CCOc3ccc(NS(C)(=O)=O)cc3)CCc3ccc(NS(C)(=O)=O)cc3)cc21)c1ccc(S(=O)(=O)[O-])cc1C5(C)C CHEMBL390302 Ki 18.0 nM
Nc1ccnc(N2CCC3(CC2)OC(c2ccccc2)c2ccccc23)c1 CHEMBL492553 Ki 18.0 nM
c1ccc(-c2[nH]c3ccccc3c2C2CC3CCC(C2)N3)cc1 CHEMBL501295 pKi 18.0 nM
CN(CC1CCOCC1)C1CCN(c2nc3ccccc3n2Cc2ccc(F)cc2)CC1 CHEMBL550818 Ki 18.0 nM
COc1ccc2ncc(F)c(C[C@H](O)C34CCC(NCc5ccc6c(n5)NC(=O)CO6)(CC3)CO4)c2n1 CHEMBL3305167 IC50 18.0 nM
C[N+]1(CCc2ccccc2)CCC(C(=O)c2ccc(Cl)cc2)CC1 CHEMBL3590458 Kd 18.0 nM
COCc1ncn(CC(=O)N2CCN(c3sc(C(F)(F)F)nc3-c3cnc(C(F)(F)F)nc3)C[C@H]2C)n1 CHEMBL5276903 IC50 18.0 nM
CCCCc1cc(OC2CCN(CCCCNS(=O)(=O)C3CCCCC3)CC2)c2ncccc2c1 CHEMBL4088039 pIC50 18.2 nM
CN(C)c1cnc2c(CCC34CCC(NCc5ccc6c(n5)NC(=O)CO6)(CC3)CO4)c(F)cnc2c1 CHEMBL3422960 IC50 18.37 nM
N#Cc1cncc(NC(=O)COc2ccc(C(=O)c3cc(Cl)ccc3Br)cc2)c1 CHEMBL4782998 IC50 18.9 nM
CC1(C)C2=C3C=C4C5=[N+](CCC4OC3CCN2c2ccc(CCC(=O)NCCCCCCN(CCOc3ccc(NS(C)(=O)=O)cc3)CCc3ccc(NS(C)(=O)=O)cc3)cc21)c1ccc(S(=O)(=O)[O-])cc1C5(C)C CHEMBL415005 Ki 19.0 nM
CCOC(=O)c1ccc(CCN2CCN(CCc3ccc([N+](=O)[O-])cc3)CC2)cc1 CHEMBL2146857 IC50 19.0 nM
CC(C)c1ncn(CC(=O)N2CCN(c3sc(C(F)(F)F)nc3-c3cnc(C(F)(F)F)nc3)C[C@@H]2CCO)n1 CHEMBL5269005 IC50 19.0 nM
O=C(COc1ccc(C(=O)c2cc(Cl)ccc2Br)cc1)Nc1cncc(C(=O)NCC2CC2)c1 CHEMBL4791538 IC50 19.5 nM
O=C(NC1CCN(Cc2ccccc2)CC1)c1cc(=O)c2ccc(F)cc2o1 CHEMBL213761 IC50 19.9 nM
Cc1cc(-c2ccc3c(c2)CCN(CCCSc2nnc(-c4ccc(C#N)cc4)n2C)CC3)no1 CHEMBL243896 pIC50 19.95 nM
CCCCc1cc(OC2CCN(CCCCNS(C)(=O)=O)CC2)c2ncccc2c1 CHEMBL4098192 pIC50 19.95 nM
COc1ccc2c(c1)CCC1(CCN(CCc3ccc(F)cc3F)CC1)O2 CHEMBL146233 Ki 20.0 nM
COc1ccc(CCN(C)CCCN(C(=O)c2ccc([N+](=O)[O-])cc2)c2ccc(OC)c(OC)c2)cc1OC CHEMBL182646 IC50 20.0 nM
CC(=O)Nc1ccc(CCN2CCC(COc3nc4ccccc4c4cn(C)cc34)CC2)cc1 CHEMBL2179670 IC50 20.0 nM
COCc1ccc(CCN2CCC(COc3nc4ccccc4c4cn(C)cc34)CC2)cc1 CHEMBL2179671 IC50 20.0 nM
CN(CCOc1ccc([N+](=O)[O-])cc1)CCc1ccc([N+](=O)[O-])cc1 CHEMBL3590445 Kd 20.0 nM
COc1ccc(OC)c(Cc2nc3ccccc3n2CC(=O)Nc2cc(C(C)(C)C)cc(C(C)(C)C)c2)c1 CHEMBL3899686 IC50 20.0 nM
CC(=O)c1ccc(CN2CCC(NC(=O)c3cc(=O)c4ccc(F)cc4o3)CC2)cc1 CHEMBL384487 IC50 20.3 nM
O=C(c1ccncc1)N1CCC2(CCN(Cc3ccccc3Oc3ccccc3)CC2)CC1 CHEMBL271768 pIC50 20.89 nM
CS(=O)(=O)Nc1ccc2c(c1)C(O)CC1(CCN(C3CCc4cc(C#N)ccc4C3)CC1)O2 CHEMBL52627 pIC50 20.89 nM
CN1C[C@@H]2C[C@H]1CN2c1ccc(-c2ccc3[nH]ccc3c2)nn1 CHEMBL1083304 Ki 21.0 nM
Cc1ccn(CC(=O)N2CCN(c3sc(C(F)(F)F)nc3-c3cnc(C(F)(F)F)nc3)C[C@@H]2CO)n1 CHEMBL5278881 IC50 21.0 nM
O=C(NC1CCN(Cc2cccc(F)c2)CC1)c1cc(=O)c2ccc(F)cc2o1 CHEMBL216225 IC50 21.2 nM
CS(=O)(=O)Nc1ccc2c(c1)[C@H](O)CC1(CCN([C@@H]3CCc4cc(C#N)ccc4C3)CC1)O2 CHEMBL477015 pIC50(uM) 21.38 nM
c1ccc(-c2cnc(Nc3cc(CN4CCCC4)ccn3)s2)cc1 CHEMBL221875 Inflection point 22.0 nM
CN1C[C@@H]2C[C@H]1CN2c1ncc(-c2ccccc2)cn1 CHEMBL1085581 Ki 22.0 nM
N#Cc1cccc(CCN2CCN(CCc3ccc([N+](=O)[O-])cc3)CC2)c1 CHEMBL2146852 IC50 22.0 nM
CCCN1CNc2cc(Nc3ccnc4cc(Cl)ccc34)ccc2C1 CHEMBL2181207 IC50 22.0 nM
CNC(=O)c1cccc(NC(=O)COc2ccc(C(=O)c3cc(Cl)ccc3Br)cc2)c1 CHEMBL4755955 IC50 22.0 nM
CSCC[C@@H]1NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]2CSSC[C@H](NC(=O)[C@@H](N)Cc3ccc(O)cc3)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H]3CSSC[C@H](NC(=O)[C@H](C(C)C)NC1=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c4ccccc14)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c4ccccc14)C(N)=O)CSSC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC3=O)C(=O)N2 CHEMBL3318147 IC50 22.0 nM
CC(C)COCC(CN(Cc1ccccc1)c1ccccc1)N1CCCC1 CHEMBL1008 pIC50 22.91 nM
Cc1c(CNC(C)C)nn(-c2ccc(Cl)cc2Cl)c1-c1ccc(Cl)cc1 CHEMBL494230 IC50 23.0 nM
Cc1c(CNC2CCCC2)nn(-c2ccc(Cl)cc2Cl)c1-c1ccc(Cl)cc1 CHEMBL512827 IC50 23.0 nM
Fc1cc2c(cn1)C1(CCN(Cc3ccc(Nc4ccc(F)c(F)c4)cc3)CC1)OC2 CHEMBL585509 IC50 23.0 nM
O=[N+]([O-])c1ccc(CCN2CCN(CCc3ccc(F)cc3)CC2)cc1 CHEMBL2146858 IC50 23.0 nM
O=C1NCCN1CCN1CCC(C2CN(c3ccc(F)cc3)c3ccccc32)CC1 CHEMBL556312 pIC50 23.44 nM
Cc1cc(C(=O)N2CCN(C(=O)C3CCCO3)CC2)ccc1OCc1cccc(Cl)c1 CHEMBL480226 Ki 23.9 nM
N#Cc1ccc(Cn2cncc2CN(CCCc2ccccc2)[C@H]2CCN(Cc3cccc(Cl)c3)C2=O)cc1 CHEMBL316726 IP 24.0 nM
N#Cc1ccc(Cn2cncc2CN(CCCc2ccccc2)[C@H]2CCN(Cc3ccccc3)C2=O)cc1 CHEMBL329067 pIC50 24.0 nM
Fc1cc2c(cn1)C1(CCN(Cc3ccc(Oc4ccc(F)c(F)c4)cc3)CC1)OC2 CHEMBL593521 IC50 24.0 nM
Cc1ccc(CCc2cccc(CCc3ccc(C)cc3)[n+]2C)cc1 CHEMBL2325204 IC50 24.0 nM
Cc1ccc(CCCOCc2cccc(COCCCc3ccc(C)cc3)[n+]2C)cc1 CHEMBL2325199 IC50 24.0 nM
Cc1csc([C@@]2(CN)[C@@H]3CCN(c4cnc5c(-c6ccc7nc(C)sc7c6Cl)n[nH]c5n4)C[C@@H]32)n1 CHEMBL5267582 IC50 24.0 nM
CN(C)CCCn1nc(C2=C(c3cn(-c4ccc5ccccc5c4)c4ccccc34)C(=O)NC2=O)c2ccccc21 CHEMBL368895 Ki 25.0 nM
C[C@H]1Sc2ccccc2O[C@@H]1c1ccc(OCCCN2CCCC2)cc1 CHEMBL550393 IC50 25.0 nM
CN(c1ccc(CN2CCC3(CC2)OCc2cc(F)ncc23)cc1)c1ccc(F)c(F)c1 CHEMBL585856 IC50 25.0 nM
c1ccc(-c2c[nH]c([C@H]3Cc4c([nH]c5ccccc45)C(C4CCOC4)N3)n2)cc1 CHEMBL2069504 IC50 25.0 nM
O=[N+]([O-])c1ccc(CCN2CCN(CCc3ccc4nonc4c3)CC2)cc1 CHEMBL2146853 IC50 25.0 nM
Cc1cc(-c2ccc3c(c2)CCN(CCCSc2nnc(-c4ccc(Cl)cc4)n2C)CC3)no1 CHEMBL244279 pIC50 25.12 nM
Cc1ccc(-c2nnc(SCCCN3CCc4ccc(-c5cc(C)on5)cc4CC3)n2C)cc1 CHEMBL395742 pIC50 25.12 nM
O=C(c1ccc(O)cc1OC[C@@H](O)CN1CCC2(CC1)Cc1cc(Cl)ccc1O2)N1C[C@H](O)CO1 CHEMBL439304 pIC50 25.12 nM
Cc1ccc2c(N3CCN(CCc4cccc5c4OCc4nc(C(F)(F)F)cn4-5)CC3)cccc2n1 CHEMBL1241641 pKi 25.12 nM
CC(C)[C@@H]1CCN(CCCOc2ccc(-n3c(-c4ccccn4)nc4cc(F)ccc43)cc2)C1 CHEMBL521566 Ki 26.0 nM
CN1C[C@@H]2C[C@H]1CN2c1cnc(-c2ccccc2)cn1 CHEMBL1083617 Ki 26.0 nM
O=C(COc1ccc(C(=O)c2cc(Cl)ccc2Br)cc1)Nc1cccc(C(=O)NCC2CC2)c1 CHEMBL4800393 IC50 26.0 nM
Cc1ncn(CC(=O)N2CCN(c3sc(C(F)(F)F)nc3-c3cnc(C(F)(F)F)nc3)C[C@H]2CCO)n1 CHEMBL5279308 IC50 26.0 nM
O=c1[nH]c2ccccc2n1CCCN1CCN(C(c2ccccc2)c2ccccc2)CC1 CHEMBL13828 AC50 26.0 nM
CCc1ncn(CC(=O)N2CCN(c3sc(C(F)(F)F)nc3-c3cnc(C(F)(F)F)nc3)C[C@@H]2CCO)n1 CHEMBL5281798 IC50 27.0 nM
Fc1ccc(Cn2c(NC3CCNCC3)nc3ccccc32)cc1 CHEMBL61301 pIC50(uM) 27.54 nM
COc1ccc(CCN2C[C@H](CNC(=O)c3cccc(Cl)c3)[C@@H](c3ccc(OC)cc3)C2)cc1 CHEMBL1760227 IC50 28.0 nM
COc1ccc([C@H]2CN(CCc3ccc(OC)c(OC)c3)C[C@@H]2Cc2nc3ccc(Cl)cc3[nH]2)cc1 CHEMBL1760242 IC50 28.0 nM
N#Cc1cccc(NC(=O)COc2ccc(C(=O)c3cc(Cl)ccc3Br)cc2)c1 CHEMBL4797829 IC50 28.3 nM
CCCCc1cc(OC2CCN(CCCS(=O)(=O)CCC)CC2)c2ncccc2c1 CHEMBL4080880 pIC50 28.84 nM
CN1C(=O)C=C[C@]2(C)[C@H]3CC[C@]4(C)[C@@H](O)/C(=C/c5cccc(F)c5)C[C@H]4[C@@H]3CC[C@@H]12 CHEMBL562471 Ki 29.0 nM
N#Cc1ccc(N2N=C(c3ccc4[nH]c(=O)oc4c3)C[C@@H]2c2ccc(F)cc2)cc1 CHEMBL1215691 IC50 29.0 nM
COc1ccc([C@H]2CN(CCc3ccc(OC)c(OC)c3)C[C@@H]2CC(=O)N(C)c2cccc(Cl)c2)cc1 CHEMBL1760235 IC50 29.0 nM
CC(C)c1ncn(CC(=O)N2CCN(c3sc(C(F)(F)F)nc3-c3cnc(C(F)(F)F)nc3)C[C@H]2CO)n1 CHEMBL5271415 IC50 29.0 nM
CCCCCCn1c(NC2CCN(CCc3ccc(OC)cc3)CC2)nc2ccccc21 CHEMBL4217209 IC50 29.96 nM
COc1ccc(C2CCN(CC[C@H]3CCOc4ccccc43)CC2)cc1OC CHEMBL96153 IC50 30.0 nM
Clc1ccc(-c2nc(COc3ccccc3CN3CCCCCCC3)cs2)cc1 CHEMBL195180 IC50 30.0 nM
Cn1c(=O)cc(NC2CCN(C/C=C/c3ccccc3)CC2)c2cc(Cl)ccc21 CHEMBL377884 Ki 30.0 nM
Cc1cc(-c2ccc3cc(CCN4CCC[C@H]4C)ccc3n2)nc(-c2ccccc2)n1 CHEMBL1082488 Ki 30.0 nM
C[C@H]1c2c([nH]c3ccc(C(F)(F)F)cc23)C[C@H]2CCN(CCCC3CCOCC3)C[C@@H]21 CHEMBL1922270 IC50 30.0 nM
Cc1nc2cc(F)ccc2n1[C@H]1CC[C@@H](NC[C@H]2Cc3ccc(C#N)cc3C2)CC1 CHEMBL2403866 IC50 30.0 nM
CCCCc1oc2ccccc2c1C(=O)c1cc(I)c(OCCN(CC)CC)c(I)c1 CHEMBL633 IC50 30.0 nM
Clc1cccc(N2CCN(CCCCNc3nccc4ccccc34)CC2)c1Cl CHEMBL1223749 Ki 30.0 nM
Cc1c(C(=O)CC#N)oc2ccccc12 CHEMBL4537540 IC50 30.0 nM
Cc1ccc2oc(C(=O)CC#N)c(C)c2c1 CHEMBL4577458 IC50 30.0 nM
Cc1c(C(=O)CC#N)oc2ccc(Cl)cc12 CHEMBL4443436 IC50 30.0 nM
Cc1c(C(=O)CC#N)oc2ccc(Br)cc12 CHEMBL4592743 IC50 30.0 nM
COc1ccccc1Oc1ccccc1CN1CCC2(CC1)CCN(C(=O)c1ccncc1)CC2 CHEMBL271128 pIC50 30.2 nM
COc1ccccc1N1CCN(CCCCOc2ccc3c(C)cc(=O)oc3c2)CC1 CHEMBL2387253 IC50 31.0 nM
O=C(Cn1cnc(C2CC2)n1)N1CCN(c2sc(C(F)(F)F)nc2-c2cnc(C(F)(F)F)nc2)C[C@H]1CO CHEMBL5281745 IC50 31.0 nM
Cc1cc(-c2ccc3c(c2)CCN(CCCSc2nnc(-c4ccc(C(F)(F)F)cc4)n2C)CC3)n(C)n1 CHEMBL390649 pIC50 31.62 nM
CN1C[C@@H]2C[C@H]1CN2c1ccc(-c2cccc3[nH]ccc23)cn1 CHEMBL1085778 Ki 32.0 nM
O=c1ccc2ncc(F)c3c2n1C[C@@]3(O)CC12CCC(NC/C=C/c3c(F)cccc3F)(CC1)CO2 CHEMBL3425934 IC50 32.0 nM
O=c1ccc2ncc(F)c3c2n1C[C@@]3(O)CC12CCC(NCCCc3cc(F)ccc3F)(CC1)CO2 CHEMBL3425941 IC50 32.0 nM
O=C(CCCN1CC=C(n2c(=O)[nH]c3ccccc32)CC1)c1ccc(F)cc1 CHEMBL1108 IC50 32.2 nM
CC(C)(Cc1ccc2ccccc2c1)NC[C@@H](O)COc1ccc(CCC(=O)O)cc1C#N CHEMBL570593 IC50 32.7 nM
CSc1ccc2c(c1)N(CCC1CCCCN1C)c1ccccc1S2 CHEMBL479 IC50 33.0 nM
CN(C)C(=O)C(CCN1CCC(O)(c2ccc(Cl)cc2)CC1)(c1ccccc1)c1ccccc1 CHEMBL841 IC50 33.0 nM
CN(C)CCCn1nc(C2=C(c3cn(-c4cnc5ccccc5c4)c4ccccc34)C(=O)NC2=O)c2ccccc21 CHEMBL359486 Ki 34.0 nM
COc1ccc([C@H]2CN(CCc3ccc(OC)c(OC)c3)C[C@@H]2CC(=O)NCc2cccc(Cl)c2)cc1 CHEMBL1760236 IC50 34.0 nM
Cc1ccc(C(=O)C2CCN(CCCc3ccccc3)CC2)cc1 CHEMBL3590457 Kd 34.0 nM
O=C(COc1ccc(C(=O)c2cc(Cl)ccc2Br)cc1)Nc1cccnc1 CHEMBL4750212 IC50 34.7 nM
O=C(NC1CCc2ccc(CCN3CCN(c4nsc5ccccc45)CC3)cc21)c1ccco1 CHEMBL398744 Ki 35.0 nM
O=C(NC1CCc2ccc(CCN3CCN(c4nsc5ccccc45)CC3)cc21)C1CC1 CHEMBL253024 Ki 35.0 nM
Nc1ccnc(N2CCC(C(=O)N3CCc4ccccc4C3)(c3ccccc3)CC2)c1 CHEMBL493744 Ki 35.0 nM
O=C(COc1ccc(C(=O)c2ccccc2Br)cc1)Nc1cccnc1 CHEMBL3740963 IC50 35.6 nM
COC(=O)c1ccc(-n2cc(C3CCN(CCN4CCNC4=O)CC3)c3cc(Cl)ccc32)cc1 CHEMBL52999 IC50 36.0 nM
CCc1sc(CCc2cc(N3CCOCC3)cc(NC(C)c3cc(Cl)cc(NC(=O)OC(C)C)c3)n2)nc1C CHEMBL564536 IC50 36.0 nM
O=C(c1ccc(Cl)cc1)C1CCN(CCc2ccc(Cl)c(Cl)c2)CC1 CHEMBL3590456 Kd 36.0 nM
O=[N+]([O-])c1cccc(CNc2cc(C(F)(F)F)cc3ncc(N4CCN(CCO)CC4)cc23)c1 CHEMBL3221110 IC50 37.0 nM
CN1CCN(C(=O)c2ccc(OCc3cccc(Cl)c3)c(Cl)c2)CC1=O CHEMBL480844 Ki 37.2 nM
O=C(NC1CC1)c1ccc(F)cc1OC[C@@H](O)CN1CCC2(CC1)Cc1cc(Cl)ccc1O2 CHEMBL2391939 IC50 38.0 nM
CNC(=O)c1c(-c2ccc(O)cc2)oc2ccc(O)c(CN3CCCCC3)c12 CHEMBL4443524 IC50 38.0 nM
CC(C)(Cc1ccc2ccccc2c1)NC[C@@H](O)COc1ccc(CCC(=O)O)cc1 CHEMBL572163 IC50 38.5 nM
CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)C(=O)[C@H](C)[C@@H](O)[C@]1(C)O CHEMBL532 IC50 39.0 nM
O=C(NC(c1ccc(Cl)cc1)c1ccc(Cl)cc1)[C@@H]1CC[C@@H](N2CCOCC2)C[C@H]1c1ccc(Br)cc1 CHEMBL3086035 IC50 39.0 nM
CCOC(=O)C1=C[C@]2(CC)CCCN3CCc4c(n1c1ccccc41)[C@@H]32 CHEMBL71752 IC50 39.0 nM
COc1ccc(-c2nnc(SCCCN3CCc4ccc(-c5cc(C)on5)cc4CC3)n2C)cc1 CHEMBL242600 pIC50 39.81 nM
COc1ccccc1-c1nnc(SCCCN2CCc3ccc(-c4cc(C)on4)cc3CC2)n1C CHEMBL390429 pIC50 39.81 nM
Cc1cnc(-c2ccc3c(c2)CCN(CCCSc2nnc(-c4ccc5[nH]ccc5c4)n2C)CC3)o1 CHEMBL244276 pIC50 39.81 nM
Fc1ccc(N(CCNCCc2ccccc2)c2ccc(F)cc2)cc1 CHEMBL2046892 pIC50 39.81 nM
COCCNC(=O)CCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O CHEMBL5272034 pIC50 39.81 nM
CCCCN(CCCC)CCC(O)c1cc2c(Cl)cc(Cl)cc2c2cc(C(F)(F)F)ccc12 CHEMBL1107 IC50 40.0 nM
COc1cccc(CN2CCCCCCC2)c1OCc1csc(-c2ccc(Cl)cc2)n1 CHEMBL197304 IC50 40.0 nM
Cc1n[nH]cc1-c1cc(C(F)(F)F)cc(S(=O)(=O)N2CCN(C(=O)[C@@H]3C[C@H]3c3ccc(C(F)(F)F)cc3)CC2)c1 CHEMBL487912 IC50 40.0 nM
COCCN(C)C1CCN(c2nc3ccccc3n2Cc2ccc(F)cc2)CC1 CHEMBL550337 Ki 40.0 nM
CN1c2nc(-c3ccc(Cl)cc3Cl)c(-c3ccc(Cl)cc3)cc2C(C(=O)NCO)CC1(C)C CHEMBL1082330 IC50 40.0 nM
COCCCc1cc(CN(C(=O)[C@H]2CNCC[C@@H]2c2ccc(OCCOc3c(Cl)cc(C)cc3Cl)cc2)C2CC2)cc(OC[C@H]2C[C@@H]2C(=O)OCOC(=O)C(C)(C)C)c1 CHEMBL1761528 Ki 40.0 nM
COc1cc(CNCC2CCN(CCCCCC(c3ccc(F)cc3)c3ccc(F)cc3)C2)cc(OC)c1OC CHEMBL2031983 IC50 40.0 nM
Cc1ccc(C#CCOCc2cccc(COCC#Cc3ccc(C)cc3)[n+]2C)cc1 CHEMBL2325200 IC50 40.0 nM
CCCCCCC[N+](CC)(CC)CC#Cc1ccc(Cl)cc1 CHEMBL3093965 IC50 40.0 nM
COc1cc(N)c(Cl)cc1C(=O)NC1CCN(CCCOc2ccc(F)cc2)CC1OC CHEMBL1200788 IC50 40.0 nM
O=C1NCN(c2ccccc2)C12CCN(CCCC(c1ccc(F)cc1)c1ccc(F)cc1)CC2 CHEMBL46516 AC50 40.0 nM
O=[N+]([O-])c1ccc(CCN(CCF)CCOc2ccc([N+](=O)[O-])cc2)cc1 CHEMBL3590447 Kd 41.0 nM
Fc1ccc2c(c1)nc(-c1ccccn1)n2-c1ccc(OCCCN2CCSC2)cc1 CHEMBL496523 Ki 42.0 nM
N#Cc1ccc(CCN2CCN(CCc3ccc4nonc4c3)CC2)cc1 CHEMBL2146851 IC50 42.0 nM
Cc1nc2ccccc2n1[C@@H]1C[C@H]2COC[C@@H](C1)N2CC[C@H](NC(=O)C1CCC1)c1ccccc1 CHEMBL2203612 Ki 42.0 nM
COc1ccccc1N1CCN(CCCCNC(=O)c2ccc(-c3ccccc3)cc2)CC1 CHEMBL112065 IC50 42.0 nM
NC[C@]1(c2ccccn2)[C@@H]2CCN(c3cnc4c(-c5cccc(Cl)c5Cl)n[nH]c4n3)C[C@@H]21 CHEMBL5270277 IC50 42.0 nM
CC(C(=O)N[C@]1(c2ccccc2)CC[C@@H](N2CCC(c3ccc(F)cc3)CC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 CHEMBL296397 Ki 43.0 nM
CCCCc1cc(OC2CCN(CCCCNS(=O)(=O)CC(C)C)CC2)c2ncccc2c1 CHEMBL4082646 pIC50 43.65 nM
O=C(COc1ccc(C(=O)c2cc(Cl)ccc2Br)cc1)Nc1ccncc1 CHEMBL4791562 IC50 43.7 nM
Fc1ccc(-c2c[nH]c([C@H]3Cc4c([nH]c5ccccc45)C(c4ccccc4)(c4ccccc4)N3)n2)cc1 CHEMBL2204934 Ki 44.0 nM
COCCN1CCC(CNC(=O)c2n[nH]c3ccc(-c4cccc(F)c4F)cc23)CC1 CHEMBL3735506 IC50 44.0 nM
CC(C)[C@]1(C(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC[C@@H](N2CCC(c3cccc(F)c3)CC2)C1 CHEMBL258246 IC50 45.0 nM
COc1ccc([C@H]2CN(CCc3ccc(OC)c(OC)c3)C[C@@H]2CCc2cc3ccc(Cl)cc3[nH]2)cc1 CHEMBL1760244 IC50 45.0 nM
CN1C(=O)C=C[C@]2(C)[C@H]3CC[C@]4(C)[C@@H](O)/C(=C/c5cc(F)cc(F)c5)C[C@H]4[C@@H]3CC[C@@H]12 CHEMBL556431 Ki 46.0 nM
CN1C[C@@H]2C[C@H]1CN2c1ccc(-c2ccc3[nH]ncc3c2)cn1 CHEMBL1085091 Ki 46.0 nM
O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCN(CCc2ccc([N+](=O)[O-])cc2)CC1 CHEMBL2441430 IC50 46.0 nM
COc1ccc([C@H]2CN(CCc3cccc(OC)c3)C[C@@H]2CNC(=O)c2cccc(Cl)c2)cc1 CHEMBL1760226 IC50 47.0 nM
O=[N+]([O-])c1ccc(CCN2CCN(CCc3ccc(-c4ncco4)cc3)CC2)cc1 CHEMBL2146854 IC50 47.0 nM
O=[N+]([O-])c1ccc(CCNCCOc2ccc([N+](=O)[O-])cc2)cc1 CHEMBL3590444 Ki 47.0 nM
CC(=O)Nc1ccc(CN2CCC(NC(=O)c3cc(=O)c4ccc(F)cc4o3)CC2)cc1 CHEMBL216680 IC50 47.7 nM
COC(=O)C1CCN(CCCOc2ccc(-n3c(-c4ccccn4)nc4cc(F)ccc43)cc2)CC1 CHEMBL497575 Ki 49.0 nM
CN1CCN(c2cnc3cc(C(F)(F)F)cc(NCc4cccc([N+](=O)[O-])c4)c3c2)CC1 CHEMBL1766528 IC50 49.0 nM
C=CC(=O)N1CCC[C@H]1COc1c(N)ncnc1-c1cc(F)cc(NC(=O)c2ccc(C3CC3)cc2F)c1C CHEMBL4537231 IC50 49.0 nM
Nc1ccnc(Nc2ccc(Oc3ccc(Cl)cc3)cc2)c1 CHEMBL2012014 Ki 50.0 nM
Cn1cc2c(OCC3CCN(CCc4ccc(N)cc4)CC3)nc3ccccc3c2c1 CHEMBL2179675 IC50 50.0 nM
Fc1ccc(-c2c[nH]c([C@@H]3CCc4[nH]c5ccccc5c4C3)n2)cc1 CHEMBL3582308 Ki 50.0 nM
N#Cc1ccc(CCN2CCC(Nc3nc4ccccc4n3Cc3ccc(C#N)cc3)CC2)cc1 CHEMBL4870175 IC50 50.0 nM
N#Cc1ccc(CCN2CCC(Nc3nc4ccccc4n3Cc3ccc(C#N)c(F)c3)CC2)cc1 CHEMBL4867115 IC50 50.0 nM
O=C(O)c1cc(F)c2nc(CN3CCN(c4cccc(OCc5ccc(Cl)c6c5OCC6)n4)C=N3)n(C[C@@H]3CCO3)c2c1 CHEMBL5395465 IC50 50.0 nM
N#Cc1cccc2c1CC1(CCN(c3cnc4c(N5CCCc6ncccc65)n[nH]c4n3)CC1)[C@@H]2N CHEMBL5417845 IC50 50.0 nM
Cc1cnc(-c2ccc3c(c2)CCN(CCCSc2nnc(-c4cc5ccccc5[nH]4)n2C)CC3)o1 CHEMBL397429 pIC50 50.12 nM
Cc1ccc2c(N3CCN(CCc4cccc(NC(=O)c5ccccc5)c4)CC3)cccc2n1 CHEMBL1632210 pKi 50.12 nM
O=c1c2ccccc2c(Cc2ccc(Cl)cc2)nn1C[C@H]1CCCN1CCCCc1ccc(OCCCN2CCCCCC2)cc1 CHEMBL1767164 pIC50 50.12 nM
CCCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2cnccc2c1=O CHEMBL2146806 pIC50 50.12 nM
O=C(NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O)C1CCCC1 CHEMBL5276489 pIC50 50.12 nM
CCOC(=O)C1CCN(C(=N)c2ccc(C(=O)Nc3c(OC)cc(Cl)cc3C(=O)Nc3ccc(Cl)cn3)c(F)c2)CC1 CHEMBL221746 Ki 51.0 nM
CN1CCN(CCCN(C(=O)Nc2ccc(F)c(C(F)(F)F)c2)[C@@H]2CC[C@]3(c4ccc(C#N)cc4)C[C@H]23)CC1 CHEMBL205285 IC50 52.0 nM
CCc1ncn(CC(=O)N2CCN(c3sc(C(F)(F)F)nc3-c3cnc(C(F)(F)F)nc3)C[C@H]2CO)n1 CHEMBL5272456 IC50 52.0 nM
Cc1ccc(OCc2cccc(COc3ccc(C)cc3)[n+]2C)cc1 CHEMBL2324262 IC50 53.0 nM
CCCCCCCN(CC)CC#CCCc1ccc(Cl)cc1 CHEMBL3093976 IC50 53.0 nM
CC(C)(O)[C@]1(C(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC[C@@H](N2CCC(c3ccc(F)cc3)CC2)C1 CHEMBL428602 IC50 54.0 nM
CCCOCCn1c(=O)c(N2CCN([C@@H](C)[C@@H](C)O)CC2)nc2cnc(-c3ccc(OC)nc3)cc21 CHEMBL589069 IC50 54.0 nM
Cc1c([C@@H](O)CN2CCC3(CC2)CCN(c2cc(-c4ccccc4)no2)C3=O)ccc2c1COC2=O CHEMBL4072929 IC50 54.0 nM
CNC(=O)Cn1c(=O)n(C2CCN(CCC(Oc3cc(OC)ccc3C)C(C)C)CC2)c2ccccc21 CHEMBL391487 Ki 56.0 nM
COc1ccc([C@H]2CN(CCc3ccc(OC)c(OC)c3)C[C@@H]2CCNC(=O)c2cccc(Cl)c2)cc1 CHEMBL1760237 IC50 56.0 nM
CC(C)Oc1ccc(F)cc1-c1ccc(N2CCC(CNC(=O)c3ccc(-c4nc5cc(C#N)cc(C(C)C)c5o4)cc3)CC2)nc1 CHEMBL1682748 IC50 56.0 nM
CN(C)C1CCN(c2nc3ccccc3n2Cc2ccc(F)cc2)CC1 CHEMBL558467 Ki 57.0 nM
O=c1[nH]c2ccccc2n1CCCN1CCC(n2c(=O)[nH]c3cc(Cl)ccc32)CC1 CHEMBL219916 pIC50(uM) 57.54 nM
CCCCCCCN(CC)CC#CCOc1ccc(Cl)cc1 CHEMBL3093982 IC50 58.0 nM
CCCCCCCN1CCC(Cc2ccccc2)CC1 CHEMBL3093962 IC50 58.0 nM
FC(F)(F)Oc1cccc(-c2c[nH]c([C@H]3Cc4c([nH]c5ccccc45)[C@@H](C4CCOCC4)N3)n2)c1 CHEMBL3775456 IC50 58.0 nM
Cc1csc([C@]2(CN)[C@@H]3CCN(c4cnc5c(-c6cccc(Cl)c6Cl)n[nH]c5n4)C[C@@H]32)n1 CHEMBL5281311 IC50 58.0 nM
CCC(NC(=O)c1ccc(Cl)cc1)[C@H]1[C@@H]2C[C@@H](n3cnc4cnccc43)C[C@@H]21 CHEMBL4878988 IC50 59.0 nM
Cc1cc(NC(=O)COc2ccc(C(=O)c3cc(Cl)ccc3Br)cc2)ccn1 CHEMBL4781970 IC50 59.7 nM
O=C([C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1)N1CCN(S(=O)(=O)c2cc(C(O)C(F)(F)F)cc(C(F)(F)F)c2)CC1 CHEMBL520543 IC50 60.0 nM
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(Cl)c2)cc1 CHEMBL1493051 EC50 60.0 nM
COCCCc1cc(CN(C(=O)[C@H]2CNCC[C@@H]2c2ccc(OCCOc3c(Cl)cc(C)cc3Cl)cc2)C2CC2)cc(OCC2(CC#N)CC2)c1 CHEMBL1761518 Ki 60.0 nM
C[n+]1c(CCCOc2cccc(Cl)c2)cccc1CCCOc1cccc(Cl)c1 CHEMBL2324245 IC50 60.0 nM
CC(C)(O)c1nc2cc(Cl)ccc2n1[C@H]1CC[C@@H](NC[C@H]2Cc3ccc(C#N)cc3C2)CC1 CHEMBL2403861 IC50 60.0 nM
C[n+]1c(CCc2ccc(-c3ccccc3)cc2)cccc1CCc1ccc(-c2ccccc2)cc1 CHEMBL3590470 Kd 60.0 nM
N[C@@H]1CCCC12CCN(c1cnc3c(-c4cccc(Cl)c4Cl)n[nH]c3n1)CC2 CHEMBL5192885 IC50 60.0 nM
O=C(NCc1cc(Cl)cc(Cl)c1)N(c1ccc(Br)cc1)C1CCN(C2CCCC2)CC1 CHEMBL1089681 IC50 61.0 nM
Fc1ccc2c(c1)nc(-c1ccccn1)n2-c1ccc(OCCCN2CCOCC2)cc1 CHEMBL522894 Ki 62.0 nM
c1ccc(CCNCCN(c2ccccc2)c2ccccc2)cc1 CHEMBL2046890 IC50 62.0 nM
Cc1cc(-c2ccc3c(c2)CCN(CCCSc2nnc(-c4ccccc4Cl)n2C)CC3)no1 CHEMBL244087 pIC50 63.1 nM
Cc1cc(-c2ccc3c(c2)CCN(CCCSc2nnc(-c4ccc(C(F)(F)F)cc4)n2C)CC3)no1 CHEMBL243897 pIC50 63.1 nM
Cc1ncoc1-c1nnc(SCCCN2CCc3cc4c(cc3CC2)OCC(=O)N4)n1C CHEMBL257536 pIC50 63.1 nM
C[C@@]12CC(c3ccccc3)C[C@@H](C1)N(CCN1CCN(c3cccc(Cl)c3)C1=O)C2 CHEMBL551927 pIC50 63.1 nM
O=C1N(CCN2C[C@@H]3CC[C@H]2Cc2ccccc2C3)CCN1c1cccc(Cl)c1 CHEMBL562464 pIC50 63.1 nM
COCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ncccc2c1=O CHEMBL2146811 pIC50 63.1 nM
CCCCc1cc(OC2CCN(CCCNS(=O)(=O)CC)CC2)c2ncccc2c1 CHEMBL4080166 pIC50 63.1 nM
CCCC(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O CHEMBL5269671 pIC50 63.1 nM
O=C(NC1CCN(Cc2ccc3c(c2)OCO3)CC1)c1cc(=O)c2ccc(O)cc2o1 CHEMBL215631 IC50 63.7 nM
O=c1ccc2ncc(F)c3c2n1C[C@@]3(O)CC12CCC(NC/C=C/c3ccc(F)cc3)(CC1)CO2 CHEMBL3425936 IC50 64.0 nM
O=c1ccc2ncc(F)c3c2n1C[C@@]3(O)CC12CCC(NC/C=C/c3ccccc3)(CC1)CO2 CHEMBL3425939 IC50 64.0 nM
O=c1ccc2ncc(F)c3c2n1C[C@@]3(O)CC12CCC(NC/C=C/c3ccccn3)(CC1)CO2 CHEMBL3425940 IC50 64.0 nM
O=c1ccc2ncc(F)c3c2n1C[C@@]3(O)CC12CCC(NCOc3cc(F)ccc3F)(CC1)CO2 CHEMBL3425942 IC50 64.0 nM
N#Cc1cccc2c1C=Cc1ncc(-c3ccccc3)cc1C2 CHEMBL570845 IP 65.0 nM
CC(Cc1ccccc1)NCCC(c1ccccc1)c1ccccc1 CHEMBL24072 IC50 65.0 nM
CN(CCCCOc1ccc([N+](=O)[O-])cc1)Cc1ccc([N+](=O)[O-])cc1 CHEMBL3590453 Ki 66.0 nM
CC(C)[C@]1(C(=O)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC[C@@H](N2CCC(c3cccc(O)c3)CC2)C1 CHEMBL255312 IC50 67.0 nM
c1cc2nonc2cc1CCN1CCN(CCc2ccc3nonc3c2)CC1 CHEMBL2146869 IC50 67.0 nM
N/C(CC(O)c1cc2c(F)cc(F)cc2c2cc(C(F)(F)F)ccc12)=N\N=C\c1ccc(F)cc1 CHEMBL4081080 IC50 67.0 nM
Fc1ccc(CCN2CCC3(CCc4ccccc4C3)CC2)c(F)c1 CHEMBL150210 Ki 69.0 nM
COc1ccc(-c2c[nH]c([C@H]3Cc4c([nH]c5ccccc45)[C@@H](C4CCOCC4)N3)n2)cc1 CHEMBL3775282 IC50 69.0 nM
CN1CCc2c(sc3c2c2ncnn2c(=O)n3Cc2ccc(Cl)cc2)C1 CHEMBL4068450 IC50 69.0 nM
N#Cc1cc(NC(=O)COc2ccc(C(=O)c3cc(Cl)ccc3Br)cc2)ccc1F CHEMBL4777849 IC50 69.5 nM
Fc1ccc2c(c1)nc(-c1ccccn1)n2-c1ccc(OCCCN2CCCCC2)cc1 CHEMBL495698 Ki 70.0 nM
CCCCN(CCc1ccc(Cl)c(Cl)c1)C[C@H](O)COc1ccc(NS(C)(=O)=O)cc1 CHEMBL494504 IC50 70.0 nM
COc1ccccc1Oc1ccccc1CN1CCC2(CC1)CCN(C(=O)c1ccncn1)CC2 CHEMBL573216 pIC50 70.79 nM
CCOC(=O)[C@H]1CN(S(=O)(=O)c2cc3cc(Cl)ccc3[nH]2)CC(=O)N1Cc1ccc(C(=N)N(C)C)cc1 CHEMBL386839 Ki 71.0 nM
COC(=O)c1ccc(Sc2ccc(NC(=O)c3ccc(C(=N)N(C)C)cc3)c(C(=O)Nc3ccc(Cl)cn3)c2)cc1 CHEMBL221921 Ki 71.0 nM
C[n+]1c(C#Cc2ccc(-c3ccc(Cl)cc3)cc2)cccc1C#Cc1ccc(-c2ccc(Cl)cc2)cc1 CHEMBL3590501 Ki 71.0 nM
Cc1cccc(-c2ccc(C#Cc3cccc(C#Cc4ccc(-c5cccc(C)c5)cc4)[n+]3C)cc2)c1 CHEMBL3590495 Kd 72.0 nM
Cc1ccc(Cn2c(N3CCC(N(C)C)CC3)nc3ccccc32)cc1 CHEMBL563451 Ki 73.0 nM
c1ccc(OCc2cccc(COc3ccccc3)n2)cc1 CHEMBL2324247 IC50 74.0 nM
C[n+]1c(CCCOc2ccccc2Cl)cccc1CCCOc1ccccc1Cl CHEMBL2324246 IC50 74.0 nM
CCCCc1cc(OC2CCN(CCCS(=O)(=O)CC)CC2)c2ncccc2c1 CHEMBL4098917 pIC50 75.86 nM
CCCCc1cc(OC2CCN(CCNS(=O)(=O)CC)CC2)c2ncccc2c1 CHEMBL4079248 pIC50 75.86 nM
COc1ccccc1-c1ccc(OCCCN2CCCCC2)cc1 CHEMBL1822859 Ki 76.0 nM
c1ccc(-c2c[nH]c([C@H]3Cc4c([nH]c5ccccc45)C(C4CCCCC4)N3)n2)cc1 CHEMBL2069500 IC50 77.0 nM
CC[C@]12CCCN3CCc4c(n(c5cc(Br)ccc45)[C@@](O)(C(=O)OC)C1)[C@@H]32 CHEMBL165643 AC50 77.5 nM
CCCCc1cc(OC2CCN(CCCCNS(=O)(=O)CC)CC2)c2ncccc2c1 CHEMBL4088036 pIC50 77.62 nM
O=C(NC1CCc2ccc(CCN3CCN(c4nsc5ccccc45)CC3)cc21)c1ccc(F)cc1 CHEMBL442290 Ki 78.0 nM
Cc1cc(-c2ccc3c(c2)CCN(CCCSc2nnc(-c4cccc(Cl)c4)n2C)CC3)no1 CHEMBL244278 pIC50 79.43 nM
O=C1N(CCN2CCCC(OCc3ccccc3)C2)CCN1c1cccc(Cl)c1 CHEMBL557110 pIC50 79.43 nM
c1ccc(C2=Nc3ccccc3C2C2CCN(c3ccccc3)CC2)cc1 CHEMBL1671884 pIC50 79.43 nM
CCCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2cccnc2c1=O CHEMBL2146807 pIC50 79.43 nM
O=c1[nH]c2ccccc2n1C1CCN(CCCOc2ccc(F)cc2)CC1 CHEMBL1802360 pIC50 79.43 nM
NC(=O)C(c1ccccc1)(c1ccccc1)[C@@H]1CCN(CCc2ccc3c(c2)CCO3)C1 CHEMBL1346 pIC50 79.43 nM
c1ccc(CCN2CCC(c3c(-c4ccccc4)[nH]c4ccccc34)CC2)cc1 CHEMBL40584 Ki 80.0 nM
N#Cc1ccc2cc1Oc1ccc3c(c1)[C@@H](CC3)N1CC[C@@H](NCc3cncn3C2)C1=O CHEMBL526466 IP 80.0 nM
CC1CCN(Cc2ccc3c(c2)Cc2c(-c4csc(C#CCOc5ccccc5)c4)n[nH]c2-3)CC1 CHEMBL387972 IC50 80.0 nM
CC1(C)CC(NC(=O)C(F)(F)CO)c2cc(-c3ccc(Cl)cc3)c(-c3ccc(Cl)cc3Cl)nc2O1 CHEMBL1095159 IC50 80.0 nM
CC(C)S(=O)(=O)N[C@H]1CN(c2ccccc2)C[C@@H]1c1ccc(-c2ccc(F)nc2)cc1 CHEMBL1289063 IC50 80.0 nM
COCCCc1cc(CN(C(=O)[C@H]2CNCC[C@@H]2c2ccc(OCCOc3c(Cl)cc(C)cc3Cl)cc2)C2CC2)cc(OCCOC)c1 CHEMBL1761519 Ki 80.0 nM
COCCCc1cc(CN(C(=O)[C@H]2CNCC[C@@H]2c2ccc(OCCOc3c(Cl)cc(C)cc3Cl)cc2)C2CC2)cc(OCCCNS(C)(=O)=O)c1 CHEMBL1761521 Ki 80.0 nM
CCOC(=O)[C@H]1C[C@@H]1COc1cc(CCCOC)cc(CN(C(=O)[C@H]2CNCC[C@@H]2c2ccc(OCCOc3c(Cl)cc(C)cc3Cl)cc2)C2CC2)c1 CHEMBL1761524 Ki 80.0 nM
O=S(=O)(CC1CC1)NCCOc1ccc2c(c1)[C@@H](Cc1ccccc1)[C@@H](N1CCC1)CC2 CHEMBL4173253 IC50 80.0 nM
CN(c1ccc(-c2cc3ccccc3cc2O)nn1)C1CC(C)(C)NC(C)(C)C1 CHEMBL4292990 IC50 80.0 nM
O=C(NNC(=S)Nc1ccc(Cl)c(Cl)c1)c1ccccc1O CHEMBL4476621 IC50 80.0 nM
COCCN1CCN(Cc2ccc(NC(=O)c3ccc(C)c(C#Cc4cnc5cccnn45)c3)cc2C2CC2)CC1 CHEMBL4637502 IC50 80.0 nM
CN1CCC[C@@H]1CCO[C@](C)(c1ccccc1)c1ccc(Cl)cc1 CHEMBL1626 AC50 80.0 nM
O=C(c1ccc(Cl)cc1)N1CCC2(CCN(Cc3cccc(Oc4ccccc4)c3)CC2)CC1 CHEMBL429436 pIC50 81.28 nM
N#Cc1ccc2cc1Oc1cccc(c1)C(c1cccc(Cl)c1)N1CCC(NCc3cncn3C2)C1=O CHEMBL312034 IP 82.0 nM
COc1ccc(C(=O)NC2(c3ccccc3)CCN(c3cc(N)ccn3)CC2)c(OC)c1 CHEMBL495346 Ki 82.0 nM
N#Cc1ccc2cc1Oc1cccc(c1)C(c1cccc(Cl)c1)N1CC[C@@H](NCc3cncn3C2)C1=O CHEMBL525413 pIC50 82.0 nM
CN(C)CC(C)(C)Cn1nc(-c2ccc3nc(OC4CC4)ccc3c2)c2c(N)ncnc21 CHEMBL4443394 IC50 82.0 nM
C[C@]1(COc2ccc(N3CCC(Oc4ccc(OC(F)(F)F)cc4)CC3)cc2)CN=C(N)O1 CHEMBL5202666 IC50 82.0 nM
CN(C(=O)CC[C@@H](C1CCCCC1)N1Cc2cc(Oc3ccccc3)ccc2N=C1N)C1CCCCC1 CHEMBL244347 Ki 84.0 nM
N#Cc1ccc(N2CCC3(CCN(CCc4ccccc4)C3)C2)cc1 CHEMBL5437311 IC50 85.0 nM
CC(C)(C)c1ccc(C(=O)CCCN2CCC(OC(c3ccccc3)c3ccccc3)CC2)cc1 CHEMBL305660 Ki 85.8 nM
Cc1ccccc1C1CCN(C[C@@H]2CCc3c(C)cccc3[C@@H](O)C2)CC1 CHEMBL513585 IC50 86.0 nM
Cc1ccc(OCCCc2cccc(CCCOc3ccc(C)cc3)[n+]2C)cc1 CHEMBL2325205 IC50 86.0 nM
C[n+]1c(C#Cc2ccc(-c3ccccc3)cc2)cccc1C#Cc1ccc(-c2ccccc2)cc1 CHEMBL2325212 Ki 86.0 nM
CCCCCCCN(CC)C/C=C/Cc1ccccc1 CHEMBL3093953 Kd 86.0 nM
c1ccc2c3c([nH]c2c1)[C@@H](C1CCOCC1)N[C@@H](c1nc(-c2csc4ccccc24)c[nH]1)C3 CHEMBL3775284 IC50 87.0 nM
O=C1NCCN1CCN1CCC(c2cn(-c3ccccc3)c3ccc(Cl)cc23)CC1 CHEMBL443476 pIC50 87.1 nM
CCCCc1cc(OC2CCN(CCCCNS(=O)(=O)CCC)CC2)c2ncccc2c1 CHEMBL4059750 pIC50 87.1 nM
O=c1cc(NC2CCN(Cc3ccc4ccccc4c3)CC2)c2cc(Cl)ccc2n1Cc1ccccn1 CHEMBL377084 Ki 88.0 nM
CC(C)(C)CCN1CCC(CNC(=O)Nc2cccc(Cl)c2)(c2ccccc2)CC1 CHEMBL488294 IC50 88.0 nM
CC(C)(C)CC(C)(C)c1ccc(OCCOCC[N+](C)(C)Cc2ccccc2)cc1 CHEMBL221753 Ki 88.9 nM
CN(C)C(=N)c1ccc(C(=O)Nc2ccc(Sc3ccccc3)cc2C(=O)Nc2ccc(Cl)cn2)cc1 CHEMBL221703 Ki 89.0 nM
COC(=O)N(NC(=O)c1c(OCCN(C)C)c(-c2ccccc2)nc2ccccc12)c1ccccc1 CHEMBL385738 Ki 89.0 nM
CN(C)c1ccc2c(c1)Cc1cc(N(C)C)ccc1C21OC(=O)c2cc(C(=O)NCCCCCCN(CCOc3ccc(NS(C)(=O)=O)cc3)CCc3ccc(NS(C)(=O)=O)cc3)ccc21 CHEMBL375021 Ki 89.0 nM
CN1Cc2ccccc2[C@@H](c2ccccc2)N=C1CCc1ccccc1 CHEMBL362721 IC50 90.0 nM
c1coc(-c2ccc(OCCCN3CCCCC3)cc2)c1 CHEMBL1822689 Ki 90.0 nM
NC1=N[C@]2(CO1)c1cc(OCC3CCCCC3)ccc1Oc1ccc(-c3cncnc3)cc12 CHEMBL3354696 Ki 90.0 nM
c1ccc2c3c([nH]c2c1)C(C1CCCCC1)N[C@@H](c1nc(-c2ccncc2)c[nH]1)C3 CHEMBL3582314 IC50 90.0 nM
N#Cc1ccc(CCN2CCC(Nc3nc4ccccc4[nH]3)CC2)cc1 CHEMBL4868736 IC50 90.0 nM
CC(=O)Nc1ccc2c3c(cccc13)C(=O)N(CCCCN1CCC(Nc3nc4ccccc4n3Cc3ccc(F)cc3)CC1)C2=O CHEMBL3805335 Ki 91.0 nM
CCCCc1cc(OC2CCN(CCCS(=O)(=O)C(C)C)CC2)c2ncccc2c1 CHEMBL4102287 pIC50 91.2 nM
C[C@@H]1CN(CC[S+]([O-])C(c2ccc(F)cc2)c2ccc(F)cc2)C[C@H](C)N1CC(O)Cc1ccccc1 CHEMBL4639814 IC50 91.5 nM
Fc1ccc2c(c1)nc(-c1ccccn1)n2-c1ccc(OCCCN2CCc3ccccc3C2)cc1 CHEMBL524467 Ki 94.0 nM
CCCCc1cc(OC2CCN(CCCCS(=O)(=O)NCCC)CC2)c2ncccc2c1 CHEMBL4063163 pIC50 95.5 nM
COc1ccc2nccc(CCN3CCC(NC(=O)c4ccc(I)c(F)c4)CC3)c2n1 CHEMBL5420593 IC50 96.0 nM
NC(=O)CN1CCC2(CCN(c3ccc(C(=O)Nc4cc(-c5cccs5)ccc4N)cn3)CC2)C1 CHEMBL471220 Ki 97.0 nM
CCCCCCCN(CC)CC#CC(c1ccccc1)c1ccccc1 CHEMBL3093972 Ki 97.0 nM
CC(C)N1CCN(C2CCc3ccc(OCc4noc(-c5ccc(Cl)cc5)n4)cc32)CC1 CHEMBL239596 Ki 98.1 nM
N#CCN(CCOc1ccc([N+](=O)[O-])cc1)CCc1ccc([N+](=O)[O-])cc1 CHEMBL3590448 Kd 99.0 nM