CCCC[S@@+]([O-])c1sc2nc(-c3nccs3)cc(-c3cnc(C)n3C)c2c1N CHEMBL4070789 Ki(app) 0.06 nM
CCCC[S+]([O-])c1sc2nc(-c3cccs3)cc(-c3ccccc3)c2c1N CHEMBL4061483 Ki(app) 0.1 nM
CCCC[S+]([O-])c1sc2nc(-c3cccs3)ccc2c1N CHEMBL4072253 IC50 1.0 nM
CCCC[S+]([O-])c1sc2nc(-c3nccs3)nc(-c3ccccc3)c2c1N CHEMBL4060121 IC50 1.0 nM
CCCC[S+]([O-])c1sc2nc(-c3nccs3)cc(-c3ccccc3)c2c1N CHEMBL4070824 IC50 1.4 nM
CCCC[S+]([O-])c1sc2nc(-c3ncco3)cc(-c3ccccc3)c2c1N CHEMBL4097930 IC50 1.4 nM
CCCC[S@@+]([O-])c1sc2nc(-c3cccs3)cc(-c3ccccc3)c2c1N CHEMBL4091103 IC50 1.5 nM
Nc1ncc(-c2cnc3ccc(C(=O)N4CCCCC4)cc3n2)cn1 CHEMBL5220078 IC50 1.6 nM
O=C(O)c1ccc(-c2cnc3ccc(C(=O)N4CCCCC4)cc3n2)cn1 CHEMBL5219440 IC50 1.7 nM
O=C(c1ccc2ncc(-c3ccc4cnccc4c3)nc2c1)N1CCCCC1 CHEMBL5220207 IC50 1.7 nM
CC(O)(CS(=O)(=O)c1ccccc1)C(=O)Nc1cccc(C(F)(F)F)c1 CHEMBL1361022 Potency 1.8 nM
CCCC[S+]([O-])c1sc2nc(-c3nccs3)cc(-c3nccs3)c2c1N CHEMBL4071206 IC50 1.8 nM
CCCC[S+]([O-])c1sc2nc(-c3nccs3)cc(-c3nccn3C)c2c1N CHEMBL4092806 IC50 1.8 nM
COCC[S+]([O-])c1sc2nc(-c3nccs3)cc(-c3cnc(C)n3C)c2c1N CHEMBL4065035 IC50 1.8 nM
CCCC[S+]([O-])c1sc2nc(-c3nccs3)cc(-c3ccc(OCCO)cc3)c2c1N CHEMBL4060870 IC50 1.9 nM
CCC[S+]([O-])c1sc2nc(-c3cccs3)cc(C(=O)OCC)c2c1N CHEMBL4076946 IC50 2.0 nM
CCCC[S+]([O-])c1sc2nc(-c3nccs3)cc(-c3cnc(C4CC4)n3C)c2c1N CHEMBL4076321 IC50 2.0 nM
O=C(c1ccc2ncc(-c3ccc4c(=O)[nH]ccc4c3)nc2c1)N1CCCCC1 CHEMBL5218684 IC50 2.0 nM
CCC[S+]([O-])c1sc2nc(-c3cccs3)cc(-c3ccccc3)c2c1N CHEMBL4087830 IC50 2.1 nM
COCCC[S+]([O-])c1sc2nc(-c3cccs3)cc(-c3ccccc3)c2c1N CHEMBL4090222 IC50 2.1 nM
CCCC[S+]([O-])c1sc2nc(-c3nccs3)cc(-c3ccc(CNC(=O)NCC)cc3)c2c1N CHEMBL4082770 IC50 2.1 nM
CCCC[S+]([O-])c1sc2nc(-c3nccs3)cc(-c3cnc(C)[nH]3)c2c1N CHEMBL4059682 IC50 2.3 nM
O=C(c1ccc2ncc(-c3ccc4ncccc4c3)nc2c1)N1CCCCC1 CHEMBL5219503 IC50 2.3 nM
O=C(c1ccc2ncc(-c3ccc4[nH]c(=O)ccc4c3)nc2c1)N1CCCCC1 CHEMBL5220355 IC50 2.3 nM
CCCC[S+]([O-])c1sc2nc(-c3cccs3)nc(-c3ccccc3)c2c1N CHEMBL4087985 IC50 2.4 nM
CCCC[S+]([O-])c1sc2nc(-c3nccs3)cc(-c3ccc(CNC(C)=O)cc3)c2c1N CHEMBL4078333 IC50 2.5 nM
CCCC[S+]([O-])c1sc2nc(-c3nccs3)cc(-c3ccc(CO)cc3)c2c1N CHEMBL4073304 IC50 2.5 nM
CCCCC[S+]([O-])c1sc2nc(-c3cccs3)cc(-c3ccccc3)c2c1N CHEMBL4072938 IC50 2.6 nM
CCCC[S+]([O-])c1sc2nc(-c3nccs3)cc(-c3cccnc3)c2c1N CHEMBL4065965 IC50 2.6 nM
CCCC[S+]([O-])c1sc2nc(-c3cocn3)nc(-c3ccccc3)c2c1N CHEMBL4092188 IC50 2.6 nM
CCCC[S+]([O-])c1sc2nc(-c3nc(C)cs3)cc(-c3cnc(C)n3C)c2c1N CHEMBL4091755 IC50 2.8 nM
CNc1ccc(-c2cnc3ccc(C(=O)N4CCCCC4)cc3n2)cn1 CHEMBL5220659 IC50 2.8 nM
CCCC[S+]([O-])c1sc2nc(-c3nccs3)cc(-c3ccc(CCO)cc3)c2c1N CHEMBL4083695 IC50 2.9 nM
Nc1ccc(-c2cnc3ccc(C(=O)N4CCCCC4)cc3n2)cn1 CHEMBL5220875 IC50 3.0 nM
Cn1ccc2cc(-c3cnc4ccc(C(=O)N5CCCCC5)cc4n3)ccc2c1=O CHEMBL5220884 IC50 3.0 nM
CC(C)[S+]([O-])c1sc2nc(-c3cccs3)cc(-c3ccccc3)c2c1N CHEMBL4099821 IC50 3.2 nM
CCCC[S+]([O-])c1sc2nc(-c3nccs3)cc(-c3cnc(Cl)n3C)c2c1N CHEMBL4082396 IC50 3.2 nM
COCCC[S+]([O-])c1sc2nc(-c3nccs3)cc(-c3cnc(C)n3C)c2c1N CHEMBL4074740 IC50 3.3 nM
CCCC[S+]([O-])c1sc2nc(-c3nccs3)cc(-c3ccc(COC(=O)NCC)cc3)c2c1N CHEMBL4067423 IC50 3.4 nM
CCCC[S+]([O-])c1sc2nc(-c3nccs3)cc(-c3ccc(C(=O)O)cc3)c2c1N CHEMBL4070888 IC50 3.4 nM
CCCC[S+]([O-])c1sc2nc(-c3nccs3)cc(-c3cccc(C(=O)NCCO)c3)c2c1N CHEMBL4095639 IC50 3.4 nM
CCCC[S+]([O-])c1sc2nc(-c3nccs3)cc(-c3ccc(COC(=O)CN(C)C)cc3)c2c1N CHEMBL4093974 IC50 3.5 nM
COc1ccc(-c2cnc3ccc(C(=O)N4CCCCC4)cc3n2)cn1 CHEMBL5219366 IC50 3.5 nM
CCCC[S+]([O-])c1sc2nc(-c3nccs3)cc(-c3ccc(C(C)(C)O)cc3)c2c1N CHEMBL4101700 IC50 3.6 nM
CCCC[S+]([O-])c1sc2nc(-c3nccn3C)nc(-c3ccccc3)c2c1N CHEMBL4077682 IC50 3.7 nM
O=C1NC(=O)/C(=C/c2ccc(OCCc3ccccc3)c(Br)c2)S1 CHEMBL3403240 IC50 4.0 nM
Nc1c([S+]([O-])CCCCl)sc2nc(-c3cccs3)cc(-c3ccccc3)c12 CHEMBL4082378 IC50 4.0 nM
COC(=O)c1ccc(-c2cnc3ccc(C(=O)N4CCCCC4)cc3n2)cc1 CHEMBL5218567 IC50 4.0 nM
O=C(c1ccc2ncc(-c3ccc(C(=O)N4CCOCC4)cc3)nc2c1)N1CCCCC1 CHEMBL5220811 IC50 4.0 nM
NC(=O)c1ccc(-c2cnc3ccc(C(=O)N4CCCCC4)cc3n2)cc1 CHEMBL5219737 IC50 4.0 nM
O=C(c1ccc2ncc(-c3ccncc3)nc2c1)N1CCCCC1 CHEMBL5220141 IC50 4.0 nM
COC(=O)c1ccc(-c2cnc3ccc(C(=O)N4CCCCC4)cc3n2)cn1 CHEMBL5221032 IC50 4.0 nM
O=C(c1ccc2ncc(-c3cncnc3)nc2c1)N1CCCCC1 CHEMBL5219741 IC50 4.0 nM
COc1ccc2cc(-c3cnc4ccc(C(=O)N5CCCCC5)cc4n3)ccc2n1 CHEMBL5220930 IC50 4.0 nM
COc1nccc2cc(-c3cnc4ccc(C(=O)N5CCCCC5)cc4n3)ccc12 CHEMBL5219034 IC50 4.0 nM
O=C(c1ccc2c(-c3ccncc3)nc(-c3ccccc3)nc2c1)N1CCCCC1 CHEMBL5220567 IC50 4.0 nM
O=C(c1ccc2ncc(-c3ccc4[nH]ncc4c3)nc2c1)N1CCCCC1 CHEMBL5221047 IC50 4.1 nM
CCCC[S+]([O-])c1sc2nc(-c3nccs3)cc(-c3cccc(CO)c3)c2c1N CHEMBL4064717 IC50 4.3 nM
O=C(c1ccc2ncc(-c3ccc4nc(Cl)ccc4c3)nc2c1)N1CCCCC1 CHEMBL5220646 IC50 4.4 nM
CCCC[S+]([O-])c1sc2nc(-c3nccs3)cc(-c3ccc(CNS(C)(=O)=O)cc3)c2c1N CHEMBL4104628 IC50 4.6 nM
CCOC(=O)Cn1ccc2cc(-c3cnc4ccc(C(=O)N5CCCCC5)cc4n3)ccc2c1=O CHEMBL5219985 IC50 4.8 nM
CCCC[S+]([O-])c1sc2nc(-c3ccccc3)nc(-c3ccccc3)c2c1N CHEMBL4066687 IC50 4.9 nM
CCC[S+]([O-])c1sc2nc(-c3nccs3)cc(C)c2c1N CHEMBL4099213 IC50 5.3 nM
COc1ccc(NC(S)=NCc2ccc3c(c2)cc(C)n3C)cc1 CHEMBL1467991 Potency 5.6 nM
C[n+]1ccn(C(=O)N(c2ccccc2)c2ccccc2)c1 CHEMBL1454493 Potency 5.6 nM
CN(C)c1ccc(-c2cnc3ccc(C(=O)N4CCCCC4)cc3n2)cn1 CHEMBL5219767 IC50 5.6 nM
O=C(c1ccc2ncc(-c3cccnc3)nc2c1)N1CCCCC1 CHEMBL5221121 IC50 5.8 nM
CCCC[S+]([O-])c1sc2nc(-c3nccs3)cc(-c3ccc(C(=O)N(C)C)cc3)c2c1N CHEMBL4099492 IC50 5.9 nM
Nc1c([S+]([O-])CCCF)sc2nc(-c3cccs3)cc(-c3ccccc3)c12 CHEMBL4081420 IC50 6.1 nM
O=C1N=C(O)S/C1=C\c1ccc(OCCC2CCCCC2)c(Br)c1 CHEMBL1800140 IC50 6.6 nM
CCCC[S+]([O-])c1sc2nc(-c3nccn3C)cc(-c3ccccc3)c2c1N CHEMBL4074636 IC50 6.7 nM
O=C1N=C(O)S/C1=C\c1ccc(OCCC2CCCCC2)c(Cl)c1 CHEMBL1800139 IC50 7.2 nM
N#CCCC[S+]([O-])c1sc2nc(-c3cccs3)cc(-c3ccccc3)c2c1N CHEMBL4105677 IC50 8.7 nM
O=C1NC(=O)/C(=C/c2ccc(OCC3CCC3)c(Cl)c2)S1 CHEMBL2414148 IC50 9.0 nM
CCCC[S+]([O-])c1sc2nc(-c3nccs3)cc(-c3cccc(C(=O)OC)c3)c2c1N CHEMBL4091753 IC50 9.0 nM
O=C1N=C(O)S/C1=C\c1ccc(OCCCC2CCCCC2)c(Cl)c1 CHEMBL1800143 IC50 10.0 nM
O=C1NC(=O)/C(=C/c2ccc(OCC3CCCC3)c(Cl)c2)S1 CHEMBL2414150 IC50 11.0 nM
O=C(c1ccc2ncc(-c3ccccc3)nc2c1)N1CCCCC1 CHEMBL5218730 IC50 11.0 nM
CCCC[S+]([O-])c1sc2nc(-c3nccs3)cc(-c3ccc(CN)cc3)c2c1N CHEMBL4086213 IC50 11.5 nM
O=C(c1ccc2c(c1)ncn2-c1cccc(Cl)c1)N1CCCCC1 CHEMBL3103033 IC50 12.0 nM
O=C(c1csc2ccccc12)N1CCCCCC1 CHEMBL1333643 Potency 12.6 nM
O=C1N=C(O)S/C1=C\c1ccc(OCCC2CCCCC2)cc1Cl CHEMBL2414240 IC50 13.0 nM
CCC[S+]([O-])c1sc2nc(-c3cccs3)cc(C(=O)N(C)C)c2c1N CHEMBL4076464 IC50 14.7 nM
CCCC[S+]([O-])c1sc2nc(-c3nccs3)cc(-c3ccc(C(=O)OC)cc3)c2c1N CHEMBL4063666 IC50 15.1 nM
O=C(c1ccc2nc(-c3ccccc3)c(-c3ccccc3)nc2c1)N1CCCCC1 CHEMBL1488523 IC50 17.0 nM
O=C1N=C(O)S/C1=C\c1cccc(OCCC2CCCCC2)c1Cl CHEMBL4114817 IC50 17.9 nM
CCCCCC[S+]([O-])c1sc2nc(-c3cccs3)cc(-c3ccccc3)c2c1N CHEMBL4062212 IC50 18.0 nM
CCCC[S+]([O-])c1sc2nc(-c3nccs3)cc(-c3cccc(C(=O)N(C)C)c3)c2c1N CHEMBL4085957 IC50 18.5 nM
COc1ccc(-n2cnc3cc(C(=O)N4CCCCC4)ccc32)cc1 CHEMBL3103040 IC50 19.0 nM
Cc1ccc(-n2cnc3cc(C(=O)N4CCCCC4)ccc32)cc1 CHEMBL3103038 IC50 19.0 nM
COc1cccc(-n2cnc3cc(C(=O)N4CCCCC4)ccc32)c1 CHEMBL3103034 IC50 19.0 nM
Cc1cccc(-n2cnc3cc(C(=O)N4CCCCC4)ccc32)c1 CHEMBL1343061 IC50 19.0 nM
O=C1N=C(O)S/C1=C\c1ccc(OCCc2ccccc2)c(Cl)c1 CHEMBL2414160 IC50 19.8 nM
O=C1NC(=O)/C(=C/c2ccc(OCCOC3CCCCC3)c(Cl)c2)S1 CHEMBL2414147 IC50 20.0 nM
O=C(c1ccc2nc(-c3ccccc3)c(-c3ccccc3)nc2c1)N1CCCCCC1 CHEMBL5218789 IC50 20.0 nM
O=C(c1ccc2ncc(-c3ccc(Cl)cc3)nc2c1)N1CCCCC1 CHEMBL5220136 IC50 20.0 nM
O=C(c1ccc2ncc(-c3ccccn3)nc2c1)N1CCCCC1 CHEMBL5221045 IC50 20.0 nM
O=C(c1ccc2ncc(-c3ccc(N4CCOCC4)nc3)nc2c1)N1CCCCC1 CHEMBL5220469 IC50 20.0 nM
O=C(c1ccc2ncc(-c3nccs3)nc2c1)N1CCCCC1 CHEMBL5219340 IC50 20.0 nM
O=C(c1ccc2cnc(-c3ccccc3)nc2c1)N1CCCCC1 CHEMBL5220653 IC50 20.0 nM
O=C(c1ccc2c(-c3cccnc3)nc(-c3ccccc3)nc2c1)N1CCCCC1 CHEMBL5219719 IC50 20.0 nM
O=C1N=C(O)S/C1=C\c1ccc(OCC2CCC(C(=O)CO)CC2)cc1 CHEMBL4114745 IC50 20.4 nM
CCCC[S+]([O-])c1sc2nc(-c3nccs3)cc(-c3cnc(C(C)C)n3C)c2c1N CHEMBL4081747 IC50 20.5 nM
Nc1ncc(-c2cnc3ccc(C(=O)N4CCCCC4)cc3n2)cc1Cl CHEMBL5218901 IC50 21.0 nM
O=C(c1ccc2c(c1)ncn2-c1ccc(Cl)cc1)N1CCCCC1 CHEMBL3103039 IC50 22.0 nM
O=C(c1ccc2c(c1)ncn2-c1ccccc1)N1CCCCC1 CHEMBL3103032 IC50 22.0 nM
Cc1cccc(-n2cnc3cc(C(=O)N4CCCC(C)C4)ccc32)c1 CHEMBL3103018 IC50 22.0 nM
Cc1cc(-c2nnc3n2CCCCC3)c(C)n1-c1ccc(Cl)c(Cl)c1 CHEMBL3102994 IC50 22.0 nM
COc1cc(/C=C2\SC(O)=NC2=O)ccc1OCCCC1CCCCC1 CHEMBL4114682 IC50 22.1 nM
Cc1nnc(SCC(=O)Nc2cccc(S(=O)(=O)N(C)c3ccccc3)c2)s1 CHEMBL1570553 Potency 22.4 nM
O=C1N=C(O)S/C1=C\c1ccc(OCCC2CCCCC2)c(CO)c1 CHEMBL4114752 IC50 23.0 nM
O=C1N=C(O)S/C1=C\c1ccc(OCCCCC2CCCCC2)c(Cl)c1 CHEMBL1800144 IC50 24.0 nM
COc1cc(/C=C2\SC(=O)NC2=O)ccc1OCCC1CCCCC1 CHEMBL1800138 IC50 25.0 nM
CCCCS(=O)(=O)c1sc2nc(-c3cccs3)cc(-c3ccccc3)c2c1N CHEMBL4060524 IC50 25.0 nM
O=C(C1CC(c2cccc(Br)c2)=NO1)N1CCc2ccccc2C1 CHEMBL1583985 Potency 25.1 nM
Brc1ccc(-c2csc(N3CCC(c4ccccc4)C3)n2)cc1 CHEMBL1309272 Potency 25.1 nM
O=C1N=C(O)S/C1=C\c1ccc(OCC2CCCCC2)c(Cl)c1 CHEMBL1800142 IC50 26.9 nM
COc1ccccc1-n1cnc2cc(C(=O)N3CCCCC3)ccc21 CHEMBL3102860 IC50 27.0 nM
O=C(NC(=S)NNC(=O)c1ccccc1O)c1ccco1 CHEMBL1583127 Potency 28.2 nM
CC1=CCC(CC(C)Oc2ccc(/C=C3\SC(O)=NC3=O)cc2)CC1 CHEMBL4115685 IC50 28.4 nM
O=C1N=C(O)S/C1=C\c1ccc(OCCc2cccs2)cc1 CHEMBL590265 IC50 31.0 nM
CC1CCC(COc2ccc(/C=C3\SC(O)=NC3=O)cc2C(F)(F)F)CC1 CHEMBL4114683 IC50 31.4 nM
O=C(Nc1ccc(Nc2ccccc2)cc1)N1CCOCC1 CHEMBL1335485 Potency 31.6 nM
CCCCS(=O)(=O)c1sc2nc(-c3nccs3)cc(-c3cnc(C)n3C)c2c1N CHEMBL4075972 IC50 32.0 nM
CC(C)(C)n1cnc2cc(C(=O)N3CCCCC3)ccc21 CHEMBL3103043 IC50 34.0 nM
Cc1ccc(-n2c(C)cc(-c3nnc4n3CCCCC4)c2C)cc1 CHEMBL3103000 IC50 34.0 nM
Cc1cc(-c2nnc3n2CCCCC3)c(C)n1-c1cccc(Cl)c1 CHEMBL3102995 IC50 34.0 nM
O=C(c1ccc2nc(-c3ccccc3)c(-c3ccccc3)nc2c1)N1CCC(F)CC1 CHEMBL5218695 IC50 34.0 nM
Nc1c([S+]([O-])CCCO)sc2nc(-c3cccs3)cc(-c3ccccc3)c12 CHEMBL4100389 IC50 37.0 nM
CC1CCN(C(=O)c2ccc3nc(-c4ccccc4)c(-c4ccccc4)nc3c2)CC1 CHEMBL5219132 IC50 37.0 nM
O=C1N=C(O)S/C1=C\c1ccc(OCCCc2ccccc2)c(Cl)c1 CHEMBL2414161 IC50 38.0 nM
CCOC(=O)c1ccc(-n2c(C)cc(-c3nnc4n3CCCCC4)c2C)cc1 CHEMBL3103006 IC50 38.0 nM
Cc1cc(-c2nnc3n2CCCCC3)c(C)n1-c1ccc(Cl)cc1 CHEMBL3102996 IC50 38.0 nM
O=C1NC(=O)/C(=C/c2ccc(OCCC3CCCC3)cc2Cl)S1 CHEMBL2414244 IC50 42.0 nM
O=C1N=C(O)S/C1=C\c1ccc(OCC2CCCC2)cc1 CHEMBL84603 IC50 42.5 nM
O=C(CCc1ccc(Oc2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)cc1)N1CCCCC1 CHEMBL1340021 Potency 44.7 nM
O=C(c1ccc(COc2ccccc2Br)cc1)N1CCCCC1 CHEMBL1471007 Potency 44.7 nM
O=C1N=C(O)S/C1=C\c1cccc(OCCCc2ccccc2)c1Cl CHEMBL4114746 IC50 44.9 nM
O=C1N=C(O)S/C1=C\c1ccc(OC2CCCCC2)c(Cl)c1 CHEMBL1800141 IC50 47.0 nM
O=C1N=C(O)S/C1=C\c1ccc(OCc2ccccc2)c(Cl)c1 CHEMBL2414159 IC50 47.5 nM
O=C1N=C(O)S/C1=C\c1ccc(OCCCCc2ccccc2)c(Cl)c1 CHEMBL2414162 IC50 47.5 nM
O=C(c1ccc2c(c1)ncn2-c1cccc(C(F)(F)F)c1)N1CCCCC1 CHEMBL3103035 IC50 48.0 nM
Cc1cccc(-n2cnc3cc(C(=O)N4CCCC(C(C)C)C4)ccc32)c1 CHEMBL3103020 IC50 48.0 nM
Cc1cc(-c2nnc3n2CCCCC3)c(C)n1-c1cccc(C(F)(F)F)c1 CHEMBL3102998 IC50 48.0 nM
Cc1cc(-c2nnc3n2CCCCC3)c(C)n1-c1ccc(Br)cc1 CHEMBL3102997 IC50 48.0 nM
Cc1cc(/C=C2\SC(O)=NC2=O)ccc1OCC1CCCCC1 CHEMBL4114657 IC50 49.8 nM
COc1cc(/C=C2\SC(O)=NC2=O)cc(Cl)c1OCCC1CCCCC1 CHEMBL4114816 IC50 50.6 nM
O=C1N=C(O)S/C1=C\c1ccc(OCCC2CCCCC2)c(F)c1 CHEMBL3685339 IC50 50.8 nM
O=C1N=C(O)S/C1=C\c1ccc(OCCC2CCCCC2)cc1 CHEMBL599406 IC50 50.9 nM
CC1CCC(COc2ccc(/C=C3\SC(O)=NC3=O)cc2)CC1 CHEMBL599018 IC50 52.0 nM
O=C1N=C(O)S/C1=C\c1ccc(OCCCc2ccccc2)cc1Cl CHEMBL2414165 IC50 52.0 nM
CC(C)(C)c1ccc(-n2cnc3cc(C(=O)N4CCCCC4)ccc32)cc1 CHEMBL3103042 IC50 54.0 nM
Cc1cc(-c2nnc3n2CCCCC3)c(C)n1-c1ccccc1 CHEMBL1408258 IC50 54.0 nM
O=C1N=C(O)S/C1=C\c1cccc(OCCCCc2ccccc2)c1Cl CHEMBL4114781 IC50 54.3 nM
Cc1cc(/C=C2\SC(O)=NC2=O)ccc1OCCC1CCCCC1 CHEMBL4114728 IC50 55.0 nM
O=C1N=C(O)S/C1=C\c1cccc(OCC2CCCCC2)c1Cl CHEMBL4115691 IC50 57.6 nM
O=C1NC(=O)/C(=C/c2ccc(Oc3cccc(/C=C/[N+](=O)[O-])c3)c(Cl)c2)S1 CHEMBL2414156 IC50 59.0 nM
O=C1N=C(O)S/C1=C\c1cccc(OCCCC2CCCCC2)c1Cl CHEMBL4114756 IC50 59.0 nM
O=C1N=C(O)S/C1=C\c1ccc(OCCC2CCCCC2)c([N+](=O)[O-])c1 CHEMBL3685346 IC50 59.5 nM
O=C1N=C(O)S/C1=C\c1ccc(OCCc2ccsc2)cc1 CHEMBL610221 IC50 60.0 nM
O=C1N=C(O)S/C1=C\c1ccc(OCCCC2CCCCC2)cc1 CHEMBL3685344 IC50 62.2 nM
O=C(c1ccc2c(c1)OCO2)N1CCCCC1 CHEMBL103469 Potency 63.1 nM
CCCCn1cnc2cc(C(=O)N3CCCCC3)ccc21 CHEMBL3103044 IC50 68.0 nM
CC(C)c1cccc(-n2cnc3cc(C(=O)N4CCCCC4)ccc32)c1 CHEMBL3103036 IC50 68.0 nM
Cc1cccc(-n2cnc3cc(C(=O)N4CCCC(C(F)(F)F)C4)ccc32)c1 CHEMBL3103022 IC50 68.0 nM
Cc1cccc(-n2cnc3cc(C(=O)N4CCCC(C)(C)C4)ccc32)c1 CHEMBL3103021 IC50 68.0 nM
Cc1cc(-c2nnc3n2CCCCC3)c(C)n1-c1ccc(C(F)(F)F)cc1 CHEMBL3102999 IC50 68.0 nM
O=P1(NC2CCCC2)COc2ccccc2OC1 CHEMBL1451386 Potency 70.8 nM
O=C1NC(=O)/C(=C/c2ccc(Oc3cccc4c3CCCC4=O)c(Cl)c2)S1 CHEMBL2414154 IC50 71.0 nM
CCC[S+]([O-])c1sc2nc(-c3cccs3)cc(C(=O)O)c2c1N CHEMBL4097312 IC50 71.0 nM
O=C1N=C(O)S/C1=C\c1ccc(OCCC2CCCCC2)c(C(F)(F)F)c1 CHEMBL3685338 IC50 71.9 nM
C=C(C)C1CCC(COc2ccc(/C=C3\SC(=O)NC3=O)cc2Cl)CC1 CHEMBL2414149 IC50 75.0 nM
Cc1cccc(-n2cnc3cc(C(=O)N4CCC(Br)CC4)ccc32)c1 CHEMBL3103023 IC50 76.0 nM
Cc1cc(-c2nnc3n2CCCCC3)c(C)n1-c1cccc(C#N)c1 CHEMBL3103001 IC50 76.0 nM
O=C1N=C(O)S/C1=C\c1ccc(OCCCCc2ccccc2)cc1Cl CHEMBL2414166 IC50 81.0 nM
O=C1N=C(O)S/C1=C\c1ccc(OCCc2cccs2)c(Cl)c1 CHEMBL2414140 IC50 84.0 nM
O=C(c1ccc2c(c1)ncn2-c1ccc(C(F)(F)F)cc1)N1CCCCC1 CHEMBL3103041 IC50 86.0 nM
COc1ccc(-n2c(C)cc(-c3nnc4n3CCCCC4)c2C)cc1 CHEMBL3103003 IC50 86.0 nM
CC1CCCN(C(=O)c2ccc(COc3ccccc3Br)cc2)C1 CHEMBL1389685 Potency 89.1 nM
CCCC[S+]([O-])c1cc2c(-c3ccccc3)nc(-c3ccccc3)nc2s1 CHEMBL4065303 IC50 93.0 nM
COc1cc(/C=C2\SC(O)=NC2=O)cc(CO)c1OCCC1CCCCC1 CHEMBL4114768 IC50 94.5 nM
O=C1N=C(O)S/C1=C\c1cccc(OCCCCC2CCCCC2)c1Cl CHEMBL4115690 IC50 94.5 nM
Cc1cc(-c2nnc3n2CCCCC3)c(C)n1-c1ccc(C#N)cc1 CHEMBL3103002 IC50 96.0 nM
O=C1N=C(O)S/C1=C\c1ccc(OCCC2CCCC2)c(Cl)c1 CHEMBL2414145 IC50 99.0 nM
Cc1nc2cc3c(cc2c(C)c1C(=O)OC(C)C)OCO3 CHEMBL1382331 Potency 100.0 nM
O=C1NC(=O)/C(=C/c2ccc(Oc3cccc([N+](=O)[O-])c3)c(Cl)c2)S1 CHEMBL2414153 IC50 100.0 nM
COC1CCN(C(=O)c2ccc3nc(-c4ccccc4)c(-c4ccccc4)nc3c2)CC1 CHEMBL5218598 IC50 100.0 nM
Cc1nn(C)cc1-c1cnc2ccc(C(=O)N3CCCCC3)cc2n1 CHEMBL5219801 IC50 100.0 nM
O=C(c1ccc2nccnc2c1)N1CCCCC1 CHEMBL136800 IC50 100.0 nM
O=C(c1ccc2c(=O)[nH]c(-c3ccccc3)nc2c1)N1CCCCC1 CHEMBL5221101 IC50 100.0 nM
Cc1cc(/C=C2\SC(O)=NC2=O)ccc1OCCCC1CCCCC1 CHEMBL4114786 IC50 104.3 nM
Cc1cc(-c2nnc3n2CCCCC3)c(C)n1-c1cccc2ccccc12 CHEMBL3103010 IC50 108.0 nM
Cc1cc(-c2nnc3n2CCCCC3)c(C)n1-c1ccc([N+](=O)[O-])cc1 CHEMBL3103004 IC50 108.0 nM
COc1ccc(/C=C2\SC(O)=NC2=O)c(Cl)c1OCCC1CCCCC1 CHEMBL3685368 IC50 109.8 nM
CN(C)C(=O)c1ccc(-c2nc(Nc3ccncc3)c3ccccc3n2)cc1 CHEMBL1446335 Potency 112.2 nM
CC12CCC(C(=O)N(CSC(=S)N/N=C\c3ccccc3O)C1=O)C2(C)C CHEMBL3195488 Potency 112.2 nM
Cc1cc(=O)oc2cc(OC(=O)CCN3C(=O)c4ccccc4C3=O)ccc12 CHEMBL1458939 Potency 112.2 nM
O=C1N=C(O)S/C1=C\c1ccc(OCCC2CCCC2)cc1 CHEMBL598397 IC50 114.6 nM
O=C1N=C(O)S/C1=C\c1ccc(OCCc2ccccc2)cc1 CHEMBL3685350 IC50 117.0 nM
Cc1cc(-c2nnc3n2CCCCC3)c(C)n1-c1ccc(F)cc1 CHEMBL2132150 IC50 121.0 nM
O=C1N=C(O)S/C1=C\c1cccc(OCCc2ccccc2)c1Cl CHEMBL4115688 IC50 122.2 nM
O=C1NC(=O)/C(=C/c2ccc(OCCc3ccc([N+](=O)[O-])o3)c(Cl)c2)S1 CHEMBL2414155 IC50 123.0 nM
O=C1N=C(O)S/C1=C\c1ccc(OCc2ccc(CCl)cc2)cc1 CHEMBL591466 IC50 124.0 nM
C[S+]([O-])c1sc2nc(-c3cccs3)cc(-c3ccccc3)c2c1N CHEMBL4066507 IC50 125.0 nM
O=c1[nH]c(O)c(Cc2ccc(OCC3CCCCC3)c(Cl)c2)s1 CHEMBL3685395 IC50 125.1 nM
O=S(=O)(Nc1ccc(-c2nnc3n2CCCCC3)cc1)c1ccc2nc(O)oc2c1 CHEMBL1595431 Potency 125.9 nM
O=C(CNc1ccccc1)N/N=C/c1c[nH]c2ccccc12 CHEMBL3195741 Potency 125.9 nM
COc1ccc2cc(C(=O)N3CCCCCC3)sc(=O)c2c1OC CHEMBL1426552 Potency 125.9 nM
O=C(c1ccc2c(c1)OCCO2)N1CCCCC1 CHEMBL1255648 Potency 125.9 nM
Cc1ccc(-n2c(-c3ccco3)nc3nc4ccccc4nc32)cc1F CHEMBL1598654 Potency 125.9 nM
O=c1oc2c(O)c(O)cc3c(=O)oc4c(O)c(O)cc1c4c23 CHEMBL6246 Potency 125.9 nM
CC(Oc1ccc(/C=C2\SC(=O)NC2=O)cc1Cl)C1CC1 CHEMBL2414151 IC50 132.0 nM
CC1CCC(COc2cccc(/C=C3\SC(O)=NC3=O)c2Cl)CC1 CHEMBL3685375 IC50 135.0 nM
Cc1cc(-c2nnc3n2CCCCC3)c(C)n1-c1ccc(C(C)(C)C)cc1 CHEMBL3103005 IC50 136.0 nM
CCC[S+]([O-])c1sc2nc(N3CCOCC3)cc(C)c2c1N CHEMBL4101333 IC50 136.0 nM
O=C1N=C(O)S/C1=C\c1ccc(OCCC2CCCCC2)cc1C(F)(F)F CHEMBL3685369 IC50 136.5 nM
N#Cc1ccccc1CSc1nc2cc(Br)c[nH]c-2n1 CHEMBL1332617 Potency 141.3 nM
CCCc1ccc(OCc2ccc(C(=O)N3CCN(c4ccccn4)CC3)o2)c(OC)c1 CHEMBL1460497 Potency 141.3 nM
COc1ccc(NC(=O)C(C)N2c3cccc4cccc(c34)S2(=O)=O)cc1 CHEMBL1380498 Potency 141.3 nM
O=C(CP(=O)(c1ccccc1)c1ccccc1)N/N=C/c1cc(Br)cc(Br)c1O CHEMBL2311878 Potency 141.3 nM
O=c1[nH]c(O)c(Cc2ccc(OCCCC3CCCCC3)c(Cl)c2)s1 CHEMBL3685400 IC50 142.8 nM
CCC[S+]([O-])c1sc2ncccc2c1N CHEMBL4102600 IC50 151.0 nM
O=C1N=C(O)S/C1=C\c1cccc(OCCC2CCCC2)c1Cl CHEMBL4114747 IC50 153.9 nM
O=c1[nH]c(O)c(Cc2ccc(OCCC3CCCCC3)cc2Cl)s1 CHEMBL3685401 IC50 157.8 nM
O=[N+]([O-])c1cccc(-c2ccc(/C=N/n3c(S)nnc3-c3ccccc3)o2)c1 CHEMBL3195280 Potency 158.5 nM
Cc1ccc(-c2nc(N3CCOCC3)s[n+]2-c2ccccc2)cc1 CHEMBL1581385 Potency 158.5 nM
O=C1NC(=O)/C(=C/c2ccc(OCC3CC4CCC3C4)c(Cl)c2)S1 CHEMBL2414158 IC50 165.0 nM
CCCC[S@+]([O-])c1sc2nc(-c3nccs3)cc(-c3cnc(C)n3C)c2c1N CHEMBL4091908 IC50 165.0 nM
CC(C)(C)c1cccc(-n2cnc3cc(C(=O)N4CCCCC4)ccc32)c1 CHEMBL3103037 IC50 171.0 nM
O=C1NC(=O)/C(=C\c2ccc(OCC3COc4ccccc4O3)cc2)S1 CHEMBL598880 IC50 172.0 nM
O=C1N=C(O)S/C1=C\c1ccc(OCC2COc3ccccc3O2)cc1 CHEMBL242919 IC50 172.4 nM
CC(C)OCCOc1cccc(/C=C2\SC(O)=NC2=O)c1Cl CHEMBL3685376 IC50 172.8 nM
O=c1[nH]c(O)c(Cc2ccc(OCCC3CCCCC3)c(Cl)c2)s1 CHEMBL3685398 IC50 172.9 nM
O=C1N=C(O)S/C1=C\c1cc(F)c(OCCC2CCCCC2)c(Cl)c1 CHEMBL3685365 IC50 177.2 nM
N#C/C(=C\c1ccc(N2CCOCC2)o1)c1ccccc1 CHEMBL1419714 Potency 177.8 nM
CCOc1ncccc1C(=O)Nc1ccc2c(C)cc(=O)oc2c1 CHEMBL1491207 Potency 177.8 nM
O=C1N=C(O)S/C1=C\c1ccc(OCCc2ccccc2)cc1Cl CHEMBL2414164 IC50 178.0 nM
O=C1N=C(O)S/C1=C\c1ccc(OCCCc2ccccc2)cc1 CHEMBL3685351 IC50 186.0 nM
Cc1cc(-c2nnc3n2CCCC3)c(C)n1-c1ccccc1 CHEMBL3103012 IC50 192.0 nM
O=C1NC(=O)/C(=C/c2ccc(OCc3ccc4c(c3)OCO4)c(Cl)c2)S1 CHEMBL2414157 IC50 193.0 nM
COc1ccc(OC)c(C(=O)c2ccc(C(=O)N3CCCCC3)cc2)c1 CHEMBL1610843 Potency 199.5 nM
C=CCOC(=O)COc1cc(C)cc2oc(=O)c3c(c12)CCC3 CHEMBL1596384 Potency 199.5 nM
COCCNC(=O)c1nc(O)c2nnn(Cc3cc(C)ccc3C)c2n1 CHEMBL1446149 Potency 199.5 nM
CCOc1cc2[nH]c(=S)n(CCCCC(=O)NCc3ccco3)c(=O)c2cc1OCC CHEMBL1491907 Potency 199.5 nM
Cc1ccc(CNC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1 CHEMBL1343518 Potency 199.5 nM
c1cnc(SCCOc2cccc3ccccc23)nc1 CHEMBL1486156 Potency 199.5 nM
C[Si](C)(c1ccc(C(=O)O)cc1)c1ccc(C(=O)O)cc1 CHEMBL1337836 Potency 199.5 nM
O=c1[nH]c(O)c(Cc2ccc(OCC3CCCC3)cc2)s1 CHEMBL3685394 IC50 204.8 nM
O=C1NC(=O)/C(=C/c2ccc(OCCOC3CCCCC3)cc2Cl)S1 CHEMBL2414245 IC50 211.0 nM
O=C1N=C(O)S/C1=C\c1cccc(OC2CCCCC2)c1Cl CHEMBL4114776 IC50 211.8 nM
O=C1N=C(O)S/C1=C\c1ccc(OCC2CCCCC2)cc1 CHEMBL432768 IC50 217.2 nM
O=C1N=C(O)S/C1=C\c1ccc(OCCOC2CCCCC2)cc1 CHEMBL599019 IC50 218.7 nM
O=C1N=C(O)S/C1=C\c1ccc(OCCN2CCS(=O)(=O)CC2)c(Cl)c1 CHEMBL2414139 IC50 223.0 nM
O=C(c1ccc(CSc2ccccc2)cc1)N1CCCCCC1 CHEMBL1489314 Potency 223.9 nM
O=c1c2ccccc2sn1-c1cc(S(=O)(=O)N2CCOCC2)ccc1N1CCCC1 CHEMBL1338317 Potency 223.9 nM
O=C(c1ccc(N2CCCC2=O)cc1)N1CCCCCC1 CHEMBL1536448 Potency 223.9 nM
O=C1N=C(O)S/C1=C\c1ccc(OCCCCc2ccccc2)cc1 CHEMBL3685352 IC50 225.0 nM
Cc1ccc(COc2ccc(/C=C3\SC(O)=NC3=O)cc2)cc1 CHEMBL597576 IC50 232.0 nM
O=C1N=C(O)S/C1=C\c1ccc(OC2CCCCC2)cc1Cl CHEMBL3685378 IC50 233.0 nM
O=C1N=C(O)S/C1=C\c1cccc(OCCOC2CCCCC2)c1Cl CHEMBL4114787 IC50 233.0 nM
Cc1cc(-c2nnc3n2CCCCCC3)c(C)n1-c1ccccc1 CHEMBL3103013 IC50 242.0 nM
O=C1N=C(O)S/C1=C\c1ccc(OCc2cccs2)cc1 CHEMBL598182 IC50 250.8 nM
O=C(c1ccc(N2C(=O)C3CC=C(Cl)CC3C2=O)cc1)N1CCCCC1 CHEMBL1568889 Potency 251.2 nM
COCc1cc(C)nc2sc(C(=O)N3CCCCC3)c(N)c12 CHEMBL1569327 Potency 251.2 nM
O=C1N=C(O)S/C1=C\c1ccc(OCc2ccc3c(c2)OCO3)cc1 CHEMBL607870 IC50 252.0 nM
O=C1N=C(O)S/C1=C\c1cccc(OCc2ccccc2)c1Cl CHEMBL4114705 IC50 257.0 nM
CCOc1cc(/C=C2\SC(O)=NC2=O)ccc1OCCC1CCCCC1 CHEMBL4114810 IC50 258.9 nM
O=C1NC(=O)/C(=C/c2ccc(OC(=O)c3cccs3)c(Cl)c2)S1 CHEMBL2414146 IC50 264.0 nM
Cc1cccc(-n2cnc3cc(C(=O)N4CC(C)CC(C)C4)ccc32)c1 CHEMBL3103019 IC50 271.0 nM
Cc1cc(-c2nnc3n2CCCCC3)c(C)n1-c1cccnc1 CHEMBL3103008 IC50 271.0 nM
O=C1N=C(O)S/C1=C\c1ccc(OCCN2CCS(=O)(=O)CC2)cc1 CHEMBL599407 IC50 274.0 nM
COc1ccc(-c2cc(C(F)(F)F)n3nc(C(=O)N4CCCCC4)cc3n2)cc1OC CHEMBL1406538 Potency 281.8 nM
Cc1ccc(C(=O)N2CCSCC2)cc1 CHEMBL1571177 Potency 281.8 nM
CCn1c(O)cc(=O)nc1SCC(=O)N1CCCCC1 CHEMBL1438652 Potency 281.8 nM
Cc1cnc(C(=O)Nc2ccc(C(=O)N3CCCCC3)cc2)cn1 CHEMBL1467403 Potency 281.8 nM
COc1ccc(-c2cnnc(N/N=C/c3c(C)nn(-c4ccccc4)c3Cl)n2)cc1 CHEMBL1968580 Potency 281.8 nM
CCS(=O)(=O)Nc1ccc(C(=O)c2ccccc2)cc1 CHEMBL1369265 Potency 281.8 nM
CC1CCCN(C(=O)c2ccc(CNc3c(N4CCCCC4)c(=O)c3=O)cc2)C1 CHEMBL1988603 Potency 281.8 nM
O=C1N=C(O)S/C1=C\c1ccc(OCCCC2CCCCC2)cc1Cl CHEMBL3685380 IC50 284.0 nM
Nc1cc(/C=C2\SC(O)=NC2=O)ccc1OCCC1CCCCC1 CHEMBL4114751 IC50 285.5 nM
Cc1ccc(C)c(Cn2nnc3c(O)nc(C(=O)NCc4ccco4)nc32)c1 CHEMBL1511082 Potency 316.2 nM
CN(C)C(=O)c1ccc(-c2nc(N(C)C)c3ccccc3n2)cc1 CHEMBL1363920 Potency 316.2 nM
Sc1nnc(-c2ccncc2)n1/N=C/c1cccc2ccccc12 CHEMBL3207741 Potency 316.2 nM
O=C1NC(=O)N(CCC2=CCCCC2)C(=O)/C1=C\c1cccs1 CHEMBL1427726 Potency 316.2 nM
C=CCn1c(SCC(=O)N2CCCCC2)nc(O)cc1=O CHEMBL1557172 Potency 316.2 nM
COc1cccc(-c2cc(C(=O)Nc3ccccc3SC)no2)c1 CHEMBL1546895 Potency 316.2 nM
O=C(Cn1sc2ccccc2c1=O)NC12CC3CC(CC(C3)C1)C2 CHEMBL1471698 Potency 316.2 nM
O=C1N=C(O)S/C1=C\c1ccc(OCCCC2CCCCC2)c([N+](=O)[O-])c1 CHEMBL3685336 IC50 326.7 nM
O=C(Nc1ccc(C(=O)N2CCCCC2)cc1)c1ccc(Br)cc1 CHEMBL1540304 Potency 354.8 nM
COc1ccc(S(=O)(=O)Nc2cc(Sc3nc[nH]n3)c(O)c3ccccc23)cc1 CHEMBL1540929 Potency 354.8 nM
O=C(NCc1ccco1)c1nc(O)c2nnn(Cc3cccc(Cl)c3)c2n1 CHEMBL1559193 Potency 354.8 nM
CCN(CC)C(=O)c1ccc(COc2ccccc2Cl)cc1 CHEMBL1599433 Potency 354.8 nM
CN(C)C(=O)c1ccccc1Sc1cc(Cl)ccc1Cl CHEMBL1430836 Potency 354.8 nM
COc1ccc(OC)c(-n2nnnc2SCC(=O)Nc2ccc(C(=O)N3CCCCC3)cc2)c1 CHEMBL1569072 Potency 354.8 nM
O=c1c2ccccc2[se]n1-c1ccccc1 CHEMBL51085 Potency 354.8 nM
Cc1cccc(-n2cnc3cc(C(=O)N4CCCC4)ccc32)c1 CHEMBL3103026 IC50 383.0 nM
CCN(CC)C(=O)c1ccc2c(c1)ncn2-c1cccc(C)c1 CHEMBL3103025 IC50 383.0 nM
Cc1cc(-c2nnc3n2CCCCCCC3)c(C)n1-c1ccccc1 CHEMBL3103014 IC50 383.0 nM
Cc1cc(-c2nnc3n2CCCCC3)c(C)n1-c1ccncc1 CHEMBL3103009 IC50 383.0 nM
O=C1N=C(O)S/C1=C\c1ccc(OCc2ccsc2)cc1 CHEMBL598183 IC50 391.7 nM
Cc1cc(Cc2sc(=O)[nH]c2O)ccc1OCCC1CCCCC1 CHEMBL3685399 IC50 397.4 nM
Cc1ccc(C)c(S(=O)(=O)Nc2cc(SCC(=O)O)c(O)c3ccccc23)c1 CHEMBL1342410 Potency 398.1 nM
O=C(CCc1ccc(Oc2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)cc1)N1CCCCCC1 CHEMBL1387773 Potency 398.1 nM
Cc1ccc(C)c(Cn2nnc3c(O)nc(C(=O)NCC4CCCO4)nc32)c1 CHEMBL1588426 Potency 398.1 nM
O=C(C1CCC(CNc2c(N3CCCCC3)c(=O)c2=O)CC1)N1CCCCC1 CHEMBL1365592 Potency 398.1 nM
Cn1c(-c2ccc(F)cc2)cnc1NCc1ccc(F)cc1 CHEMBL1589340 Potency 398.1 nM
O=C(c1ccc2c(=O)n(Cc3ccc4c(c3)OCO4)c(=S)[nH]c2c1)N1CCCCC1 CHEMBL1480787 Potency 398.1 nM
COC(=O)c1ccc(CCc2cc(O)ccc2O)cc1 CHEMBL1491288 Potency 398.1 nM
Cn1cc([N+](=O)[O-])c(C(=O)Nc2ccc(C(=O)N3CCCCC3)cc2)n1 CHEMBL1607967 Potency 398.1 nM
CC1CCN(C(=O)c2ccc3c(c2)OCCO3)CC1 CHEMBL1563733 Potency 398.1 nM
O=C(c1cc2nc(-c3ccco3)cc(C(F)(F)F)n2n1)N1CCCCCC1 CHEMBL1602465 Potency 398.1 nM
Cc1ccc(S(=O)(=O)N(C)c2ccc(C(=O)N3CCCCC3)cc2)cc1 CHEMBL1528533 Potency 398.1 nM
Cc1sc2ncnc(SCc3nnc(-c4ccccc4)o3)c2c1C CHEMBL1559999 Potency 398.1 nM
Cc1cc(/C=C2\SC(O)=NC2=O)ccc1OCCCCC1CCCCC1 CHEMBL4114815 IC50 399.3 nM
Cc1cccc(-n2cnc3cc(C(=O)N4CCCC(c5ccccc5)C4)ccc32)c1 CHEMBL3103027 IC50 429.0 nM
CC1=NOC(=O)/C1=C\c1ccc(-c2cc(Cl)ccc2Cl)o1 CHEMBL1595121 Potency 446.7 nM
O=c1c2ccccc2sn1-c1ccccc1 CHEMBL45152 Potency 446.7 nM
O=C1ON=C(c2ccccc2)/C1=C/c1ccc(-c2ccccc2[N+](=O)[O-])o1 CHEMBL1585191 Potency 446.7 nM
CN(c1ccc(C(=O)N2CCCCC2)cc1)S(=O)(=O)c1ccccc1 CHEMBL1376345 Potency 446.7 nM
O=C(O)CCCC(=O)Nc1ccc(C(=O)N2CCCCC2)c(Cl)c1 CHEMBL1441513 Potency 446.7 nM
O=C(O)C1C2C=CC(C2)C1C(=O)Nc1ccc(C(=O)N2CCCCC2)c(Cl)c1 CHEMBL1537349 Potency 446.7 nM
Cc1cc(C(=O)N2CCCCCC2)cs1 CHEMBL1448554 Potency 446.7 nM
CC1CCCN(C(=O)c2sc3cc([N+](=O)[O-])ccc3c2Cl)C1 CHEMBL1605811 Potency 446.7 nM
O=C(NCC1CCCO1)c1sc(=S)n2c1[nH]c(=O)c1ccc(C(=O)N3CCCCC3)cc12 CHEMBL1523322 Potency 446.7 nM
COc1ccccc1-c1ccc2ncnc(NCc3cccnc3)c2c1 CHEMBL1436169 Potency 446.7 nM
COCCCNC(=O)c1nc(O)c2nnn(Cc3cc(C)ccc3C)c2n1 CHEMBL1461785 Potency 446.7 nM
O=C(c1ccc2c(c1)OCO2)N1CCc2ccccc2C1 CHEMBL1432063 Potency 446.7 nM
CCC(C)c1ccccc1NC(=O)COC(=O)c1ccc(C)c(NC(=O)c2ccco2)c1 CHEMBL1457574 Potency 446.7 nM
Nc1nc(C(F)(F)F)cc(=O)n1/N=C/c1ccc2ccccc2c1 CHEMBL3209663 Potency 446.7 nM
CCCC[S@+]([O-])c1sc2nc(-c3cccs3)cc(-c3ccccc3)c2c1N CHEMBL4070142 IC50 450.0 nM
O=C1N=C(O)S/C1=C\c1ccc(OCc2ccccc2)cc1Cl CHEMBL2414163 IC50 487.0 nM
Cc1ccc(-c2nnc(S)n2/N=C/C=C\c2ccccc2[N+](=O)[O-])cc1 CHEMBL3208556 Potency 501.2 nM
Cc1ccc(-c2nnc(S)n2/N=C/c2c(C)nn(-c3ccccc3)c2C)cc1 CHEMBL1968458 Potency 501.2 nM
CCOc1ccc(OCC)c(Nc2cc(C)nc3nc(C)nn23)c1 CHEMBL1525925 Potency 501.2 nM
CCN(CC)C(=O)c1ccc(NC(=O)COc2ccc([N+](=O)[O-])cc2Cl)cc1 CHEMBL1576125 Potency 501.2 nM
CSc1ccccc1C(=O)NCc1ccc2c(c1)OCO2 CHEMBL1580594 Potency 501.2 nM
CC1CCN(c2c(NCC3CCC(C(=O)N4CCCCC4)CC3)c(=O)c2=O)CC1 CHEMBL1343704 Potency 501.2 nM
COc1ccc(C(=O)c2ccccc2O)c(O)c1 CHEMBL1326877 Potency 501.2 nM
O=C1N=C(O)S/C1=C\c1ccc(OCCN2CCOCC2)cc1 CHEMBL599002 IC50 514.8 nM
O=C1S/C(=C\c2ccc(OCCC3CCCCC3)cc2)C(=O)N1CCO CHEMBL598787 IC50 526.0 nM
COc1ccc(COc2ccc(/C=C3\SC(=O)NC3=O)cc2)cc1 CHEMBL608142 IC50 529.0 nM
CC1(COc2ccc(/C=C3\SC(O)=NC3=O)cc2)CCCCC1 CHEMBL260373 IC50 546.6 nM
O=C(c1ccc(N2C(=O)C3CCCCC3C2=O)cc1)N1CCCCC1 CHEMBL1340885 Potency 562.3 nM
O=C(c1sc2cc([N+](=O)[O-])ccc2c1Cl)N1CCCCC1 CHEMBL1459903 Potency 562.3 nM
Cc1ccc(-n2sc3ccccc3c2=O)cc1 CHEMBL1336959 Potency 562.3 nM
Cc1ccc(C)c(Cn2nnc3c(O)nc(C4CCN(C(=O)c5cccs5)CC4)nc32)c1 CHEMBL1419567 Potency 562.3 nM
O=C(CSc1nc(-c2ccco2)cc(C(F)(F)F)n1)Nc1ccc(C(=O)N2CCCCC2)cc1 CHEMBL1508699 Potency 562.3 nM
CCOC(=O)CC(=O)CSc1nc(-c2ccc3c(c2)OCO3)cc(C(F)(F)F)c1C#N CHEMBL1348866 Potency 562.3 nM
CC(C)(C)NC(=O)NC(=O)COC(=O)c1ccc(OC(F)(F)F)cc1 CHEMBL1311362 Potency 562.3 nM
O=C(c1ccc(F)cc1)C1CCN(CCn2c(=O)[nH]c3ccccc3c2=O)CC1 CHEMBL51 Potency 562.3 nM
O=C(C1CCC(CNc2c(N3CCCCC3)c(=O)c2=O)CC1)N1CCc2ccccc2C1 CHEMBL1306866 Potency 562.3 nM
Cc1c(C)c2cc(Cl)c(O)c(CN3CCCC(C)C3)c2oc1=O CHEMBL1537860 Potency 562.3 nM
O=C(c1ccc(CSc2nc3cc[nH]cc-3n2)cc1)N1CCCCC1 CHEMBL1537891 Potency 562.3 nM
CCNS(=O)(=O)c1ccc2nc(NC(=O)/C=C/c3cc(OC)c(OC)c(OC)c3)sc2c1 CHEMBL1493531 Potency 562.3 nM
Cc1oc(-c2cccc(Cl)c2)nc1CSc1nc(O)c2c(n1)CCC2 CHEMBL1601377 Potency 562.3 nM
N#Cc1c(-c2cccc(Br)c2)cc(-c2cccnc2)nc1N CHEMBL1534306 Potency 562.3 nM
COc1ccc(-c2cc(=O)c3cc(OC)ccc3o2)cc1 CHEMBL1410006 Potency 562.3 nM
O=c1c(/C=N/O)c(Nc2ccccc2)nc2ccccn12 CHEMBL3194875 Potency 562.3 nM
COc1ccc(Br)cc1C(=O)N/N=C/c1ccc2c(c1)n(C)c(=O)n2C CHEMBL3212379 Potency 562.3 nM
Cc1nn(-c2ccc(F)cc2)c2c1cc(C#N)c1nc3ccccc3n12 CHEMBL1529320 Potency 562.3 nM
Oc1cccc2ccc(SSc3ccc4cccc(O)c4n3)nc12 CHEMBL239439 Potency 562.3 nM
O=C1N=C(O)S/C1=C\c1ccc(OCCc2ccccn2)cc1 CHEMBL599004 IC50 592.2 nM
c1ccc(-n2ccc(-c3nnc4n3CCCCC4)c2)cc1 CHEMBL3103015 IC50 607.0 nM
COC(=O)C1CCC(COc2ccc(/C=C3\SC(=O)NC3=O)cc2)CC1 CHEMBL599220 IC50 620.0 nM
O=S(=O)(Nc1cc(Sc2cccc3cccnc23)c(O)c2ccccc12)c1ccccc1 CHEMBL1576791 Potency 631.0 nM
Fc1ccccc1CSc1nc2cc(Br)c[nH]c-2n1 CHEMBL1489593 Potency 631.0 nM
CC1CCN(C(=O)c2ccc(CSc3ccc(Cl)cc3)cc2)CC1 CHEMBL260370 Potency 631.0 nM
O=C(c1ccc(C(F)(F)F)cc1)N1CCC(=O)N(C(COCc2ccc(C(F)(F)F)cc2)Cc2ccccc2)CC1 CHEMBL1390462 Potency 631.0 nM
Fc1ccc(CSc2nc3cc(Br)c[nH]c-3n2)cc1 CHEMBL1393460 Potency 631.0 nM
CCc1cccc(CC)c1NC(=O)CO/N=C(\C)c1cccs1 CHEMBL3213891 Potency 631.0 nM
O=[N+]([O-])c1ccc(Cl)c(/C=N/n2c(S)nnc2C2CCCCC2)c1 CHEMBL3194032 Potency 631.0 nM
O=c1ccc2cc(O[C@H]3OC(CO)C(O)C(O)C3O)c(O)cc2o1 CHEMBL1514329 Potency 631.0 nM
CCN(C(=O)c1cc2cc(OC)ccc2oc1=O)c1cccc(C)c1 CHEMBL1430408 Potency 631.0 nM
CCNc1ncc2nc(-c3ccc(F)cc3)c(=O)n(CCC#N)c2n1 CHEMBL1317306 Potency 631.0 nM
CN(C)CCNC(=O)c1cc2c(s1)-c1ccccc1OC2 CHEMBL1469859 Potency 631.0 nM
Cc1ccccc1C(=O)N1CCc2ccccc2C1 CHEMBL1337096 Potency 631.0 nM
CC1CCN(c2c(NCC3CCC(C(=O)N4CCCC(C)C4)CC3)c(=O)c2=O)CC1 CHEMBL1559682 Potency 631.0 nM
CCN(CC)C(=O)c1ccc(-c2ccccc2)cc1 CHEMBL1332724 Potency 631.0 nM
COc1cc(/N=c2\ssnc2Cl)cc(OC)c1 CHEMBL3197242 Potency 631.0 nM
O=C(NCc1ccco1)c1cc2ccc(O)cc2oc1=O CHEMBL1531320 Potency 631.0 nM
CCn1c(C(=O)N2CCc3ccccc3C2)cc2oc3ccccc3c21 CHEMBL1454428 Potency 631.0 nM
N#C/C(=C\c1c(N2CCCCC2)nc2ccccn2c1=O)C(=O)NC1CCS(=O)(=O)C1 CHEMBL1521053 Potency 631.0 nM
COC1(NS(=O)(=O)c2ccc(C)cc2)C(Cl)=C(Cl)C(=O)c2ccccc21 CHEMBL1392651 Potency 631.0 nM
Cc1ncsc1CCOc1ccc(/C=C2\SC(O)=NC2=O)cc1 CHEMBL590988 IC50 636.0 nM
Cc1cc(Cc2sc(=O)[nH]c2O)ccc1OCCCC1CCCCC1 CHEMBL3685402 IC50 667.4 nM
c1ccc(-n2cc(-c3nnc4n3CCCCC4)c3ccccc32)cc1 CHEMBL3103017 IC50 681.0 nM
COc1cc(/C=C2\SC(O)=NC2=O)ccc1OCCc1cccs1 CHEMBL4114681 IC50 681.7 nM
OC1=NC(=S)/C(=C/c2ccc(OCCC3CCCCC3)cc2)S1 CHEMBL3685337 IC50 689.4 nM
CC1CCN(C(=O)c2ccc(NC(=O)C3CCCO3)cc2)CC1 CHEMBL1332304 Potency 707.9 nM
COc1ccc(-c2nsc3c(SCc4ccccc4)ncnc23)cc1 CHEMBL1334774 Potency 707.9 nM
Cn1c(C(=O)N2CCc3ccccc3C2)cc2oc3ccccc3c21 CHEMBL1378138 Potency 707.9 nM
COc1ccc2cc(CN(CC3COCCO3)S(=O)(=O)c3ccc(Cl)cc3)c(O)nc2c1 CHEMBL1523338 Potency 707.9 nM
O=C(NC(=S)Nc1ccc(C(=O)N2CCOCC2)cc1)c1ccc([N+](=O)[O-])cc1 CHEMBL1459217 Potency 707.9 nM
CN(C)C(=S)SSC(=S)N(C)C CHEMBL120563 Potency 707.9 nM
Cc1cccc(-n2c(C)cc(C(=O)NC3CCCCC3)c2C)c1 CHEMBL1510089 Potency 707.9 nM
Oc1nc(SCc2nc3ccccc3n2Cc2ccccc2)nc2ccccc12 CHEMBL1459632 Potency 707.9 nM
O=c1c2ccccc2sn1-c1ccc(S(=O)(=O)N2CCCC2)cc1 CHEMBL1392315 Potency 707.9 nM
CNc1nnc(-c2ccncc2)s1 CHEMBL1407862 Potency 707.9 nM
Nc1nc(N)c2nc(-c3ccccc3)c(N)nc2n1 CHEMBL585 Potency 707.9 nM
COC(=O)c1ccc2c(=O)n(Cc3ccc(C(=O)NC4CCCC4)cc3)c(=S)[nH]c2c1 CHEMBL1421127 Potency 707.9 nM
O=C(O)CCC(=O)Nc1ccc(C(=O)N2CCCCC2)cc1 CHEMBL1441188 Potency 707.9 nM
O=C(/C(=C/c1ccccc1)c1ccccc1)N1CCCCC1 CHEMBL1466586 Potency 707.9 nM
O=C1NC(=O)/C(=C/c2ccc(OCCC3CCCCO3)cc2)S1 CHEMBL598175 IC50 750.0 nM
O=C1N=C(O)S/C1=C\c1ccc(OCC2CCCCO2)cc1 CHEMBL85579 IC50 750.4 nM
O=c1[nH]c(O)c(Cc2ccc(OCCC3CCCC3)cc2)s1 CHEMBL3685396 IC50 776.9 nM
CC1=CCC2C(=O)N(c3ccc(C(=O)N4CCCCCC4)cc3)C(=O)C2C1 CHEMBL1458760 Potency 794.3 nM
CC1CCCC(C)N1C(=O)c1cc2ncc(CCCl)cn2n1 CHEMBL1320088 Potency 794.3 nM
COc1ccc(CCN(Cc2cccs2)S(=O)(=O)c2ccc(-n3cnnn3)c(OC)c2)cc1OC CHEMBL1444218 Potency 794.3 nM
CN1CCN(C(=O)CSc2nc(-c3cccs3)cc(-c3cccs3)c2C#N)CC1 CHEMBL1390573 Potency 794.3 nM
CCC(CC)NC(=O)/C=C/c1ccccc1Cl CHEMBL1556111 Potency 794.3 nM
CCS(=O)(=O)Nc1ccc(-c2nnc(SCC(=O)c3ccc(NC(C)=O)c(OC)c3)o2)cc1 CHEMBL1504428 Potency 794.3 nM
O=C(CSc1n[nH]c(-c2ccccc2)n1)Nc1ncc(Br)cc1Br CHEMBL1498551 Potency 794.3 nM
O=C(NNc1nc2ccccc2s1)Nc1ccccc1 CHEMBL1582450 Potency 794.3 nM
Cc1ccnc(-n2sc3ccccc3c2=O)n1 CHEMBL608699 Potency 794.3 nM
Oc1nc(SCc2nc(O)c3cnn(-c4ccccc4)c3n2)nc2ccccc12 CHEMBL1562459 Potency 794.3 nM
COc1cc(C(=O)Nc2cccc3cccnc23)cc(OC)c1OC CHEMBL1613368 Potency 794.3 nM
C=CCNC(=O)c1cc(-c2ccccc2O)on1 CHEMBL1343332 Potency 794.3 nM
O=c1c2ccccc2sn1-c1cc(S(=O)(=O)N2CCOCC2)ccc1N1CCOCC1 CHEMBL1371792 Potency 794.3 nM
CCc1c(C)c2ccc(O)c(CN(C)C)c2oc1=O CHEMBL1536252 Potency 794.3 nM
Cc1ccc(C(=O)N2CCC(C)CC2)cc1C CHEMBL1389590 Potency 794.3 nM
CN[C@@H](C)[C@H](O)c1ccccc1 CHEMBL1523964 Potency 794.3 nM
C=CCCCCCCCCCCCc1ccco1 CHEMBL1608830 Potency 794.3 nM
O=C(O)CCCNc1c([N+](=O)[O-])cc([N+](=O)[O-])c2ccccc12 CHEMBL1577428 Potency 794.3 nM
CC1CCN(C(=O)c2ccc(CSc3nc4ccncc4n3Cc3ccc(F)cc3)cc2)CC1 CHEMBL1383599 Potency 794.3 nM
N=C1S/C(=C\c2ccc(-c3cccc(Cl)c3)o2)C(=O)N1c1nccs1 CHEMBL1493936 Potency 794.3 nM
CCNc1ncc2nc(-c3ccc(OC)cc3)c(=O)n(-c3ccc(OC)cc3)c2n1 CHEMBL1445473 Potency 794.3 nM
O=C(NCCc1csc(-c2ccccc2)n1)c1ccc(Br)o1 CHEMBL1525651 Potency 794.3 nM
CCCCOc1ccc(C(=O)N2CCCCCC2)cc1 CHEMBL1460256 Potency 794.3 nM
Fc1cccc(-n2c(-c3ccco3)nc3nc4ccccc4nc32)c1 CHEMBL1540836 Potency 794.3 nM
O=C1NC(=O)/C(=C\c2ccc(OCc3ccc(-c4ccccc4)cc3)cc2)S1 CHEMBL599395 IC50 814.0 nM
O=C1N=C(O)S/C1=C\c1ccc(OCc2ccc(-c3ccccc3)cc2)cc1 CHEMBL3685364 IC50 814.2 nM
O=C1N=C(O)S/C1=C\c1ccc(OC2CCCCC2)cc1 CHEMBL3685343 IC50 821.6 nM
O=C1NC(=O)/C(=C/c2ccc(OCCC3CCCCC3)cc2)N1 CHEMBL606032 IC50 865.0 nM
CC1CCN(C(=O)CCc2ccc(Oc3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)cc2)CC1 CHEMBL1579618 Potency 891.3 nM
Cc1ccc(O)c(-c2cc(C(=O)Nc3ccc(S(=O)(=O)Nc4nc(C)cc(C)n4)cc3)[nH]n2)c1 CHEMBL1383820 Potency 891.3 nM
COc1ccc(-c2nnc(S)n2/N=C/C=C\c2ccccc2OC)cc1 CHEMBL1977509 Potency 891.3 nM
CC1CCN(C(=O)C2CCC(CNS(=O)(=O)c3cccc4cccnc34)CC2)CC1 CHEMBL1409757 Potency 891.3 nM
O=P(Nc1nccs1)(c1ccccc1)c1nc2ccccc2s1 CHEMBL1410147 Potency 891.3 nM
CCOC(=O)C1=C(O)c2ccccc2C(=O)/C1=C\c1ccc(CC)cc1 CHEMBL1487834 Potency 891.3 nM
O=c1cc(-c2ccc(O)cc2)oc2cccc(O)c12 CHEMBL484662 Potency 891.3 nM
O=C1C(Cl)=C(Cl)C(=O)C(Cl)=C1Cl CHEMBL192627 Potency 891.3 nM
CC1CCCN(C(=O)c2ccc3c(c2)C(=O)N(CCC2=CCCCC2)C3=O)C1 CHEMBL1361422 Potency 891.3 nM
CC1=C(Br)C(=O)C(C)=C(Br)C1=O CHEMBL1566105 Potency 891.3 nM
CC(=O)c1cc2cc(O)ccc2o1 CHEMBL1408894 Potency 891.3 nM
Cc1cc(C)c(S(=O)(=O)/N=C2/C=C(Sc3nc[nH]n3)C(=O)c3ccccc32)cc1C CHEMBL2003806 Potency 891.3 nM
Cc1ccc(S(=O)(=O)/N=C2/C=C(Sc3nc[nH]n3)C(=O)c3ccccc32)cc1 CHEMBL1968732 Potency 891.3 nM
CC(C)CCn1c(N)c(C(=O)NCc2cccs2)c2nc3ccccc3nc21 CHEMBL1565888 Potency 891.3 nM
CCN(CC)C(=O)c1ccc2nc3ccccc3nc2c1 CHEMBL1341731 Potency 891.3 nM
Cc1nn(-c2ccccc2)c2c1C(c1ccc(F)cc1)C(C#N)=C(N)O2 CHEMBL1348016 Potency 891.3 nM
Cc1c(C(=O)O)cnc2cc(-c3ccc(Cl)cc3)nn12 CHEMBL1350119 Potency 891.3 nM
[O-][n+]1c(CN2CCCCC2)nc2cccc3c2c1-c1ccccc1-3 CHEMBL1358007 Potency 891.3 nM
O=C1N=C(O)S/C1=C\c1ccc(OCc2ccco2)cc1 CHEMBL601089 IC50 893.0 nM
O=C1NC(=O)/C(=C/c2ccc(OCc3ccc([N+](=O)[O-])cc3)c(Cl)c2)S1 CHEMBL2414142 IC50 930.0 nM
Cc1cccc(-n2cnc3cc(C(=O)NC4CCCC4)ccc32)c1 CHEMBL3103028 IC50 961.0 nM
CC(C)OCCOc1ccc(/C=C2\SC(O)=NC2=O)cc1 CHEMBL599003 IC50 961.4 nM
O=c1[nH]c(O)c(Cc2ccc(OCCC3CCCCC3)cc2)s1 CHEMBL3685392 IC50 977.0 nM