CN1CCN(c2cc(C(=O)Nc3cc4cc(-c5cnn(C)c5)ccc4cn3)ccn2)CC1 CHEMBL4784318 Kd 0.018 nM
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)/N=C/c1cnc2ccc(Br)cn12 CHEMBL393525 Kd 0.056 nM
Cc1nc2ccc(-c3cc(N)nc(N)c3)nc2n1C(C)C CHEMBL4441878 Kd 0.228 nM
CC(C)Oc1ccc(F)c(-c2cnc(N)c(C(=O)Nc3cnccc3N3CCC[C@@H](C(=O)O)C3)n2)c1 CHEMBL4647659 Kd 0.254 nM
Cc1nc2ccc(-c3cc(N)nc(N)c3)nc2n1CC(F)(F)F CHEMBL5070553 Kd 0.326 nM
COC[C@@H](CC(C)C)NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1 CHEMBL5426285 Kd 0.388 nM
O=C1N=C(Nc2c(Cl)cccc2Cl)S/C1=C\c1ccc2nccnc2c1 CHEMBL5081787 Kd 0.395 nM
O=C(O)c1ccc2c(c1)nc(Nc1cccc(Cl)c1)c1ccncc12 CHEMBL1230165 Kd 0.54 nM
COC1=CC2C(=O)NC3=Cc4ccc(OC)cc4C(=C1OC)C32 CHEMBL5279705 Kd 0.58 nM
Cn1cc(-c2ccc3cnc(NC(=O)C4CCN(S(C)(=O)=O)CC4)cc3c2)cn1 CHEMBL5285332 Kd 0.62 nM
CN1CCN(C(=O)C(C)(C)c2ccc(C(=O)Nc3cn4cc(-c5ccncc5)ccc4n3)cc2)CC1 CHEMBL4531334 IC50 0.67 nM
CCN1CCN(Cc2ccc(Nc3ncc(F)c(-c4cc(F)c5nc(C)n(C(C)C)c5c4)n3)nc2)CC1 CHEMBL3301610 Kd 0.851 nM
CC(C)CN1CCC(C(=O)Nc2cc3cc(-c4cnn(C)c4)ccc3cn2)CC1 CHEMBL5289681 Kd 0.968 nM
COC[C@@H](CC(C)C)NC1=N/C(=C\c2ccc3c(c2)OCO3)C(=O)N1 CHEMBL5428750 IC50 1.0 nM
CC(C)(C)c1ccc(C(=O)Nc2cn3cc(-c4cn[nH]c4)ccc3n2)cn1 CHEMBL5200367 IC50 1.1 nM
CC(C)(C)c1ccc(C(=O)Nc2cn3cc(-c4ccncc4)ccc3n2)cn1 CHEMBL5283453 IC50 1.1 nM
CC(C)(CO)c1ccc(C(=O)Nc2cn3cc(-c4cn[nH]c4)ccc3n2)cn1 CHEMBL5286791 IC50 1.1 nM
CCN1/C(=C/C(C)=O)Sc2ccc(O)cc21 CHEMBL1232500 Kd 1.273 nM
Oc1ccc(-c2n[nH]c3ncc(-c4ccc(O)c(O)c4)cc23)cc1 CHEMBL4873449 Kd 1.306 nM
CCNc1cc(Nc2ccc(C(=O)N3CCC(N4CCOCC4)CC3)cc2OC)nc2[nH]cc(C(F)(F)F)c12 CHEMBL5273528 Kd 1.387 nM
Cc1n[nH]c2ccc(-c3cncc(OC[C@@H](N)Cc4ccccc4)c3)cc12 CHEMBL379218 Kd 1.4 nM
COc1ccc2sc(C(=O)NNc3cc(F)cc(F)c3)cc2c1 CHEMBL5424488 IC50 1.4 nM
c1ccc(-c2ccc3[nH]ncc3c2)cc1 CHEMBL3298236 Kd 1.626 nM
COc1ccc2sc(C(=O)NNc3cc(Cl)cc(Cl)c3)cc2c1 CHEMBL5424844 IC50 1.7 nM
O=C1NC(NC2CCCCCC2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5283849 Kd 1.754 nM
Clc1cc(Cl)cc(CNc2nccc(-c3ccc4c(c3)OCO4)n2)c1 CHEMBL2392364 IC50 2.0 nM
COCCN1CCN(Cc2ccc(-c3n[nH]c4c3C(=O)c3c(NC(=O)NN5CCOCC5)cccc3-4)cc2)CC1 CHEMBL3545083 Kd apparent 2.0 nM
C[C@@H](c1ccc(F)cc1)n1nnc2cnc3ccc(-c4ccc5ocnc5c4)cc3c21 CHEMBL4083249 IC50 2.0 nM
Cc1nc(NCc2c(F)cccc2F)c2c(-c3ccnc(N)c3)c[nH]c2n1 CHEMBL5093650 Kd 2.6 nM
O=C1NC(NC23CC4CC(CC(C4)C2)C3)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5091238 Kd 2.607 nM
CCOC(=O)c1ccc(-c2ccc3ncnc(NCc4ccc(C)o4)c3c2)o1 CHEMBL1329627 AC50 2.72 nM
CCOC(=O)c1c(/C(C#N)=C\N)c2ccc(Cl)c(Cl)c2n1C CHEMBL1236620 Kd 2.789 nM
CCCNc1ncnc2ccc(-c3ccc4c(c3)OCO4)cc12 CHEMBL1702086 AC50 3.14 nM
c1nc(NCC2CCCC2)c2cc(-c3ccc4c(c3)OCO4)ccc2n1 CHEMBL1354134 AC50 3.61 nM
COc1cccc(NNC(=O)c2cc3cc(OC)ccc3s2)c1 CHEMBL5411169 IC50 3.7 nM
COc1ccc(CNC(=O)c2cnc3ccc(-c4ccc5ncccc5c4)cn23)cc1 CHEMBL4853178 IC50 4.0 nM
COc1ccc2sc(C(=O)NC(=O)c3ccc(F)cc3OC)cc2c1 CHEMBL5205505 IC50 4.0 nM
Cn1cc2cc(/C=C3\N=C(NC45CC6CC(CC(C6)C4)C5)NC3=O)ccc2n1 CHEMBL5408531 IC50 4.0 nM
O=C1NC(N[C@H]2C3CC4CC2C[C@](O)(C4)C3)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5428651 IC50 4.0 nM
Cc1nc2ccc(-c3cc(N)nc(N)c3)nc2n1C1CC1 CHEMBL4460561 K 4.7 nM
CNc1nc(NCc2ncccn2)c2c(-c3ccc4ncccc4c3)c[nH]c2n1 CHEMBL4797564 Kd 4.8 nM
Brc1ccc(CNc2nccc(-c3ccc4c(c3)OCO4)n2)cc1Br CHEMBL1899256 AC50 4.9 nM
COC(=O)C1=C(Nc2ccccc2Cl)O/C(=C\c2c[nH]c3ncccc23)C1=O CHEMBL4089159 IC50 5.0 nM
COc1ccc(NNC(=O)c2cnc3ccc(-c4ccc5ncccc5c4)cn23)cc1 CHEMBL4861035 IC50 5.0 nM
O=C1NC(NC23CC4CC(CC(C4)C2)C3)=N/C1=C\c1ccc2[nH]cnc2c1 CHEMBL5404416 IC50 5.0 nM
O=C1NC(NC23CC4CC(CC(C4)C2)C3)=N/C1=C\c1ccc2[nH]ncc2c1 CHEMBL5405572 IC50 5.0 nM
COC[C@H](NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1)c1ccccc1 CHEMBL5439392 IC50 5.0 nM
COc1cncc(-c2c[nH]c3ncc(NC(=O)c4ccc(Cl)cc4OC)cc23)c1 CHEMBL5417631 IC50 5.0 nM
CN1CCN(c2ccc(C(=O)Nc3cnc4[nH]cc(-c5cncc(F)c5)c4c3)cc2)CC1 CHEMBL5418859 IC50 5.0 nM
CN(C)c1nccc(-c2cnn3ncccc23)n1 CHEMBL4848254 Kd 5.381 nM
COc1ccc2sc(C(=O)NNc3cccc(C#N)c3)cc2c1 CHEMBL5435820 IC50 5.4 nM
CC(C)CC(=O)Nc1cncc(-c2ccc3[nH]nc(-c4nc5cncc(-c6cccc(F)c6)c5[nH]4)c3c2)c1 CHEMBL4297639 Kd 5.889 nM
c1cc(OCCN2CCCCC2)cc(-c2n[nH]c3ccc(-c4nnc[nH]4)cc23)c1 CHEMBL1614713 Kd 5.966 nM
Cc1cc(-c2ccc3ncc4nnn([C@@H](C)c5ccccc5)c4c3c2)ccn1 CHEMBL4094600 IC50 6.0 nM
COc1ccc(CNC(=O)c2cnc3ccc(-c4cnn(C)c4)cn23)cc1 CHEMBL4853617 IC50 6.0 nM
C[C@@H](NC(=O)c1cnc2ccc(-c3ccc4ncccc4c3)cn12)c1ccccc1 CHEMBL4878376 IC50 6.0 nM
COc1ccc([C@@H](C)NC(=O)c2cnc3ccc(-c4ccc5ncccc5c4)cn23)cc1 CHEMBL4878682 IC50 6.0 nM
O=C1NC(NC2CCCCC(F)(F)C2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5396550 IC50 6.0 nM
COC(=O)[C@@H](NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1)C(C)O CHEMBL5401116 IC50 6.0 nM
CC(=O)NC12CC3CC(C1)CC(NC1=N/C(=C\c4ccc5ncsc5c4)C(=O)N1)(C3)C2 CHEMBL5422654 IC50 6.0 nM
O=C1NC(NCc2ccccc2C(F)(F)F)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5430415 IC50 6.0 nM
O=C1NC(N[C@@H](CO)c2ccccc2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5404544 IC50 6.0 nM
O=C(O)c1nc2ccccc2c2[nH]c3c(I)cccc3c12 CHEMBL3589662 Kd 6.22 nM
Clc1ccc(CNc2nccc(-c3ccc4[nH]ncc4c3)n2)cc1Cl CHEMBL1892019 AC50 6.77 nM
COc1ccc2sc(C(=O)N(C)Cc3cccc(F)c3)cc2c1 CHEMBL4082113 IC50 6.9 nM
COc1ccc(-c2nccc(NCc3ccc(C)cc3)n2)cc1 CHEMBL1901314 AC50 6.97 nM
Cc1cc(-c2ccc3ncc4nnn(Cc5ccc(F)cc5)c4c3c2)ccn1 CHEMBL4096379 IC50 7.0 nM
COc1ccc(NC(=O)c2cnc3ccc(-c4cnn(C)c4)cn23)cc1 CHEMBL4871915 IC50 7.0 nM
O=C1NC(N[C@@H]2CCCCC[C@@H]2O)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5414514 IC50 7.0 nM
CC(C)C[C@@H](CF)NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1 CHEMBL5438412 IC50 7.0 nM
O=C1NC(NC23CC4CC(CC(O)(C4)C2)C3)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5405059 IC50 7.0 nM
COC12CC3CC(CC(NC4=N/C(=C\c5ccc6ncsc6c5)C(=O)N4)(C3)C1)C2 CHEMBL5417147 IC50 7.0 nM
O=C1NC(NC23CC4CC(CC(F)(C4)C2)C3)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5438158 IC50 7.0 nM
CS(=O)(=O)NC12CC3CC(CC(NC4=N/C(=C\c5ccc6ncsc6c5)C(=O)N4)(C3)C1)C2 CHEMBL5409574 IC50 7.0 nM
O=C1NC(NC2CCCSC2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5405233 IC50 7.0 nM
COc1cc(N2CCN(C)CC2)ccc1Nc1nccc(-c2cn(C)c3cnccc23)n1 CHEMBL3421968 Kd 7.353 nM
CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)NC4 CHEMBL388978 IC50 7.45 nM
CCN1/C(=C/C(C)=O)Sc2ccc(OC)cc21 CHEMBL408982 AC50 7.49 nM
COC(=N)c1nc2ccc3ncnc(Nc4ccc(OC)cc4F)c3c2s1 CHEMBL3894571 Kd 7.635 nM
Clc1ccc(CNc2ccnc(-c3ccc4[nH]ncc4c3)n2)cc1Cl CHEMBL1898211 AC50 7.84 nM
c1cncc(CNc2nccc(-c3ccc4c(c3)OCO4)n2)c1 CHEMBL1877990 AC50 7.91 nM
Clc1ccc(CNc2nccc(-c3ccc4c(c3)OCO4)n2)cc1Cl CHEMBL1898197 IC50 8.0 nM
CNC(=O)c1nn(C)c2c1C(C)(C)Cc1cnc(Nc3ccc(N4CCN(C)CC4)cc3)nc1-2 CHEMBL564829 Kd apparent 8.0 nM
Cn1cc(-c2ccc3occ(-c4cccc(-c5ccncc5)c4)c3n2)cn1 CHEMBL4754195 IC50 8.0 nM
COc1ccc([C@@H](C)NC(=O)c2cnc3ccc(-c4cnn(C)c4)cn23)cc1 CHEMBL4861593 IC50 8.0 nM
CC(C)Oc1ccc(CNC(=O)c2cnc3ccc(-c4cnn(C)c4)cn23)cc1 CHEMBL4876285 IC50 8.0 nM
CC1N=CC(c2ccc3occ(-c4cccc(-c5ccncc5)c4)c3n2)=N1 CHEMBL5178079 IC50 8.0 nM
O=C1NC(NC23CC4CC(CC(C4)C2)C3)=N/C1=C\c1ccc2ncoc2c1 CHEMBL5438293 IC50 8.0 nM
O=C1NC(NC23CC4CC(CC(NC(=O)C5CC5)(C4)C2)C3)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5418722 IC50 8.0 nM
O=C1NC(Nc2ccccc2)=N/C1=C\c1ccc2c(c1)OCO2 CHEMBL1802358 Kd 8.51 nM
COc1ccc2c3ccnc(Cl)c3n(CC#N)c2c1 CHEMBL4283240 Kd 8.703 nM
COC(=O)c1ccc2c(c1)NC(=O)/C2=C(\Nc1ccc(N(C)C(=O)CN2CCN(C)CC2)cc1)c1ccccc1 CHEMBL502835 Kd 8.8 nM
Nc1nc(Nc2ccc(S(N)(=O)=O)cc2)nn1C(=S)Nc1c(F)cccc1F CHEMBL261720 IC50 8.9 nM
Cn1cnc2ccc(/C=C3\N=C(NC45CC6CC(CC(C6)C4)C5)NC3=O)cc21 CHEMBL5420645 IC50 9.0 nM
O=C1NC(NC2CCC(F)(F)C2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5427398 IC50 9.0 nM
O=C1NC(N[C@@H]2CCC[C@@H](O)CC2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5420497 IC50 9.0 nM
CO[C@@H]1CCC[C@@H](NC2=N/C(=C\c3ccc4ncsc4c3)C(=O)N2)C1 CHEMBL5440139 IC50 9.0 nM
CC(C)C[C@H](CF)NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1 CHEMBL5426735 IC50 9.0 nM
CN(C)C12CC3CC(CC(NC4=N/C(=C\c5ccc6ncsc6c5)C(=O)N4)(C3)C1)C2 CHEMBL5412565 IC50 9.0 nM
C[C@]12O[C@H](C[C@]1(O)CO)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)CNC4=O CHEMBL603469 Kd 9.6 nM
COc1ccc2sc(C(=O)NC(=O)c3cc(Cl)ccc3OC)cc2c1 CHEMBL5206943 IC50 9.7 nM
c1csc(CNc2ncnc3ccc(-c4ccoc4)cc23)c1 CHEMBL1410859 AC50 9.79 nM
Cc1ccsc1CNc1ncnc2ccc(-c3ccc4c(c3)OCO4)cc12 CHEMBL1396654 AC50 9.94 nM
COC(=O)[C@@]1(O)C[C@H]2O[C@]1(C)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)NC4 CHEMBL281948 Kd apparent 10.0 nM
O=C1NC(NC2CCCCCCC2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5430192 IC50 10.0 nM
O=C1NC(N[C@@H]2CCCCC[C@H]2O)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5439952 IC50 10.0 nM
O=C1NC(N[C@H]2CCC[C@H](O)CC2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5438325 IC50 10.0 nM
CO[C@H]1CCC[C@@H]1NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1 CHEMBL5427842 IC50 10.0 nM
O=C1NC(NC23CC4CC(CC2C4)C3)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5400230 IC50 10.0 nM
Cc1ccc(CNC2=N/C(=C\c3ccc4ncsc4c3)C(=O)N2)c(C)c1 CHEMBL5423063 IC50 10.0 nM
O=C1NC(NCc2cccnc2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5395707 IC50 10.0 nM
c1nc(NCC2CCCOC2)c2cc(-c3ccc4c(c3)OCO4)ccc2n1 CHEMBL1734733 AC50 10.1 nM
c1ccc(CNc2nc(Nc3cc(C4CC4)[nH]n3)c3sccc3n2)cc1 CHEMBL1997924 Kd 10.19 nM
COc1ccc2nc3ccc(OC)cc3c(SCCCN)c2c1 CHEMBL5095897 Kd 10.4 nM
CN(Cc1cccs1)c1ncnc2ccc(-c3ccc4c(c3)OCO4)cc12 CHEMBL1591577 IC50 11.0 nM
CN(Cc1ccco1)c1ncnc2ccc(-c3ccc4c(c3)OCO4)cc12 CHEMBL1374544 AC50 11.0 nM
CC(=O)c1cnc2ccc(-c3cc(Cl)c(O)c(Cl)c3)nc2c1N[C@H]1CC[C@H](CN(C)C)CC1 CHEMBL3688339 Kd apparent 11.0 nM
Cc1ccc(-n2cc(COc3cccc4cnc(Nc5cccc(Cl)c5)nc34)nn2)c([N+](=O)[O-])c1 CHEMBL4783398 IC50 11.0 nM
C[C@@H](NC(=O)c1cnc2ccc(-c3cnn(C)c3)cn12)c1ccc(Cl)cc1 CHEMBL4861868 IC50 11.0 nM
COc1cccc(CNC(=O)c2cnc3ccc(-c4cnn(C)c4)cn23)c1 CHEMBL4847017 IC50 11.0 nM
O=[N+]([O-])c1ccccc1-n1cc(COc2cccc3cnc(Nc4cccc(Cl)c4)nc23)nn1 CHEMBL5282544 IC50 11.0 nM
O=C1NC(NC2CC23CCCCC3)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5434921 IC50 11.0 nM
O=C1NC(NC2CCCCC2(F)F)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5396991 IC50 11.0 nM
CO[C@H]1CCCCC[C@H]1NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1 CHEMBL5411157 IC50 11.0 nM
O=C1NC(NC23CC4(F)CC(F)(CC(F)(C4)C2)C3)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5422486 IC50 11.0 nM
O=C1NC(N[C@H]2c3ccccc3C[C@@H]2O)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5429404 IC50 11.0 nM
CN1CCN(c2ccc(NC3=N/C(=C\c4ccc5ncsc5c4)C(=O)N3)cc2)CC1 CHEMBL5397343 IC50 11.0 nM
CN1CC[C@@](C)(NC2=N/C(=C\c3ccc4ncsc4c3)C(=O)N2)C1=O CHEMBL5429707 IC50 11.0 nM
c1nc(NCC2CCCO2)c2cc(-c3ccc4c(c3)OCO4)ccc2n1 CHEMBL1552755 AC50 11.3 nM
COc1ccc2c(c1)[nH]c1c(C)nccc12 CHEMBL269538 AC50 11.6 nM
Cc1occc1CNc1ncnc2ccc(-c3ccc4c(c3)OCO4)cc12 CHEMBL1476499 AC50 11.8 nM
COc1cc(N2CCC(N3CCN(C)CC3)CC2)ccc1Nc1ncc(Cl)c(Nc2ccccc2S(=O)(=O)C(C)C)n1 CHEMBL509032 Kd 12.0 nM
Cn1cc(-c2ccc3ncc(C(=O)NCc4ccccc4)n3c2)cn1 CHEMBL4850174 IC50 12.0 nM
O=C1NC(NCC(O)C2CCCCC2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5436133 IC50 12.0 nM
O=C1NC(NC2C3CC4CC(C3)CC2C4)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5417207 IC50 12.0 nM
O=C1NC(NC[C@H](O)c2ccccc2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5430262 IC50 12.0 nM
COc1ccc(/C=C2\N=C(Nc3ccc(N4CCN(C)CC4)cc3)NC2=O)cc1O CHEMBL5416942 IC50 12.0 nM
COc1ccc2sc(C(=O)N(C)Cc3cc(F)cc(F)c3)cc2c1 CHEMBL5191395 IC50 12.7 nM
COc1ccc2sc(C(=O)N(C)N(C)c3cccc(Br)n3)cc2c1 CHEMBL5421447 IC50 12.9 nM
Brc1cc(Br)cc(CNc2nccc(-c3ccc4c(c3)OCO4)n2)c1 CHEMBL2392365 IC50 13.0 nM
O=C(NCC1CCOCC1)c1n[nH]c2ccc(-c3cncc(CO)c3)cc12 CHEMBL4640019 IC50 13.0 nM
COc1ccc(CNC(=O)c2cnc3ccc(-c4ccncc4)cn23)cc1 CHEMBL4874981 IC50 13.0 nM
COc1cc(Nc2nccc(-c3cnn4nc(OC)ccc34)n2)cc(C(F)(F)F)c1 CHEMBL187139 IC50 13.0 nM
CO[C@@H]1CCCC[C@@H](NC2=N/C(=C\c3ccc4ncsc4c3)C(=O)N2)C1 CHEMBL5440511 IC50 13.0 nM
CCOC[C@@H](CC(C)C)NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1 CHEMBL5409730 IC50 13.0 nM
O=C1NC(NC[C@@H](O)c2ccccc2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5428132 IC50 13.0 nM
O=C1NC(Nc2ccccc2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5418020 IC50 13.0 nM
O=C1NC(Nc2ccccn2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5417527 IC50 13.0 nM
CN1CCN(c2ccc(CNc3cnc4[nH]cc(-c5cccnc5)c4c3)cc2)CC1 CHEMBL5401218 IC50 13.0 nM
COC[C@@H](CC(C)C)NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1C CHEMBL5085086 IC50 13.4 nM
Cc1ccsc1CN(C)c1ncnc2ccc(-c3ccoc3)cc12 CHEMBL1612677 AC50 13.8 nM
CC(C)C[C@H](CO)NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1 CHEMBL5412105 IC50 13.9 nM
CCN(Cc1cccs1)c1ncnc2ccc(-c3ccc4c(c3)OCO4)cc12 CHEMBL1515144 IC50 14.0 nM
Cn1cc(-c2ccc3occ(-c4cccc(-c5cc[nH]n5)c4)c3n2)cn1 CHEMBL4762964 IC50 14.0 nM
C[C@@H](NC(=O)c1cnc2ccc(-c3cnn(C)c3)cn12)c1ccccc1 CHEMBL4877125 IC50 14.0 nM
Cn1cc(-c2ccc3ncc(C(=O)NCc4ccc(Cl)cc4)n3c2)cn1 CHEMBL4878429 IC50 14.0 nM
O=C1NC(NC2CCCC(F)(F)C2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5411888 IC50 14.0 nM
O=C1NC(N[C@@H]2CCCC[C@H](O)C2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5401675 IC50 14.0 nM
CO[C@H]1CCCC[C@@H](NC2=N/C(=C\c3ccc4ncsc4c3)C(=O)N2)C1 CHEMBL5422857 IC50 14.0 nM
COC[C@@H](CC(C)C)NC1=N/C(=C\c2ccc3ncoc3c2)C(=O)N1 CHEMBL5435855 IC50 14.2 nM
COc1ccc2sc(C(=O)N(C)N(C)c3cccc(Cl)c3)cc2c1 CHEMBL5420003 IC50 14.6 nM
COc1ccc2c(c1)CC(n1c(C)nc3ccc(-c4cc(N)nc(N)c4)nc31)C2 CHEMBL4284240 IC50 15.0 nM
CC1(C)C2CCC1(C)[C@H](NC1=N/C(=C\c3ccc4ncsc4c3)C(=O)N1)C2 CHEMBL5412900 IC50 15.0 nM
O=C1NC(N[C@@H]2CCC[C@H]2O)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5429789 IC50 15.0 nM
O=C1NC(NC(CF)c2ccccc2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5404644 IC50 15.0 nM
O=C1NC(NCc2ccccn2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5406568 IC50 15.0 nM
O=C1NC(NC2CCCCOC2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5424272 IC50 15.0 nM
Cc1n[nH]c2ccc(-c3nnc4n3[C@H](c3ccc(Cl)cc3)CC4)cc12 CHEMBL5434183 Kd 15.0 nM
COc1ccc(-c2c[nH]c3ncc(NCc4cc(F)cc(F)c4)cc23)cc1 CHEMBL5413622 IC50 15.0 nM
Fc1cccc(CNc2cnc3[nH]cc(-c4cccnc4)c3c2)c1 CHEMBL5401689 IC50 15.0 nM
COc1cncc(-c2c[nH]c3ncc(NCc4ccc(F)cc4)cc23)c1 CHEMBL5395734 IC50 15.0 nM
Cn1cc(C2=C(c3cccc(NCC(O)CO)c3)C(=O)NC2=O)c2cc(F)ccc21 CHEMBL1082152 Kd 16.0 nM
Clc1ccc(CNc2nccc(-c3ccc4c(c3)OCCO4)n2)cc1Cl CHEMBL1904905 IC50 16.0 nM
N#C/C(=C\c1cccnc1)c1c[nH]c2ncccc12 CHEMBL3753668 IC50 16.0 nM
Cn1cc(-c2ccc3occ(-c4cccc(-c5cn[nH]c5)c4)c3n2)cn1 CHEMBL4789951 IC50 16.0 nM
O=C1NC(N[C@@H]2CCC[C@@H](O)C2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5415622 IC50 16.0 nM
CO[C@@H]1CCC[C@H]1NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1 CHEMBL5408907 IC50 16.0 nM
CO[C@H]1CCC[C@H](NC2=N/C(=C\c3ccc4ncsc4c3)C(=O)N2)C1 CHEMBL5436754 IC50 16.0 nM
COC(=O)[C@@H](NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1)C(C)C CHEMBL5416274 IC50 16.0 nM
O=C1NC(NCc2ccccc2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5405969 IC50 16.0 nM
COC(CNC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1)c1ccccc1 CHEMBL5424074 IC50 16.0 nM
NC[C@H](NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1)c1ccccc1 CHEMBL5406081 IC50 16.0 nM
O=C1NC(Nc2cccnc2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5427325 IC50 16.0 nM
O=C1NC(NC2COCCOC2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5421636 IC50 16.0 nM
COc1cncc(-c2c[nH]c3ncc(NCc4cc(F)cc(F)c4)cc23)c1 CHEMBL5439632 IC50 16.0 nM
Cc1ccsc1CN(C)c1ncnc2ccc(-c3ccc(CO)o3)cc12 CHEMBL1476609 AC50 16.1 nM
COc1ccc2sc(C(=O)NNc3cccc(Br)n3)cc2c1 CHEMBL5411227 IC50 16.7 nM
CC(C)n1cnc2c(Nc3cc(N)cc(Cl)c3)nc(N[C@@H]3CCCC[C@@H]3N)nc21 CHEMBL4078898 IC50 17.0 nM
Cc1nc(OCc2ccsc2)c2c(-c3ccnc(N)c3)c[nH]c2n1 CHEMBL5091510 IC50 17.0 nM
CC(C)n1cnc2c(Nc3cc(N)cc(Cl)c3)nc(NC3CCCCC3N)nc21 CHEMBL5276465 IC50 17.0 nM
CC(=O)/C=C1\Sc2ccc(O)cc2N1CCc1ccccc1 CHEMBL5410811 IC50 17.0 nM
Cn1cnc2ccc(/C=C3\N=C(NC4CCCCCC4)NC3=O)cc21 CHEMBL5423245 IC50 17.0 nM
O=C1NC(NC23CC4CC(CC(C4)C2)C3)=N/C1=C\c1ccc2c(c1)OCO2 CHEMBL5420724 IC50 17.0 nM
C[C@@H]1CCCC[C@H]1NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1 CHEMBL5433142 IC50 17.0 nM
O=C1NC(NC2CC3(CCC3)C2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5427895 IC50 17.0 nM
O=C1NC(N[C@@H]2CCCC[C@@H](O)C2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5437778 IC50 17.0 nM
O=C1NC(N[C@@H](CO)CC2CC2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5397157 IC50 17.0 nM
CC(C)C[C@H](COC1CC1)NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1 CHEMBL5396386 IC50 17.0 nM
NCC(NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1)c1ccccc1 CHEMBL5438728 IC50 17.0 nM
Cc1csc(CNC2=N/C(=C\c3ccc4ncsc4c3)C(=O)N2)n1 CHEMBL5434349 IC50 17.0 nM
CN1CCN(c2ccc(NC3=N/C(=C\c4ccc5c(c4)OCCO5)C(=O)N3)cc2)CC1 CHEMBL5414801 IC50 17.0 nM
CC1(NC2=N/C(=C\c3ccc4ncsc4c3)C(=O)N2)CCNC1=O CHEMBL5423406 IC50 17.0 nM
COc1cncc(-c2c[nH]c3ncc(NCc4cccc(F)c4)cc23)c1 CHEMBL5424114 IC50 17.0 nM
c1csc(CNc2ncnc3ccc(-c4ccc5c(c4)OCO5)cc23)c1 CHEMBL567331 AC50 17.1 nM
Cc1nc(CN(C)c2ncnc3ccc(-c4ccc5c(c4)OCO5)cc23)cs1 CHEMBL1474834 Kd 18.0 nM
C[C@@H](N)c1ccc(C(=O)Nc2ccnc3[nH]ccc23)cc1 CHEMBL571948 Kd apparent 18.0 nM
C[C@@H](c1ccc(F)cc1)n1nnc2cnc3ccc(-c4ccc5c(c4)OCO5)cc3c21 CHEMBL4072795 IC50 18.0 nM
Cn1cc(-c2cccc(-c3coc4ccc(-c5cnn(C)c5)nc34)c2)cn1 CHEMBL4797457 IC50 18.0 nM
O=c1c2c(ccc3nc(-c4cccnc4)sc32)ncn1C1CC1 CHEMBL4798624 IC50 18.0 nM
O=C1NC(NC2CCCCCC2)=N/C1=C\c1ccc2ncoc2c1 CHEMBL5430824 IC50 18.0 nM
O=C1NC(N[C@@H]2CCC[C@H](O)CC2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5403037 IC50 18.0 nM
CO[C@@H]1CCCCC[C@H]1NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1 CHEMBL5428629 IC50 18.0 nM
COC(CNC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1)C1CCCCC1 CHEMBL5423402 IC50 18.0 nM
CC(C)(C)NC(=O)OC12CC3CC(CC(NC4=N/C(=C\c5ccc6ncsc6c5)C(=O)N4)(C3)C1)C2 CHEMBL5421442 IC50 18.0 nM
Cc1ccc(CNC2=N/C(=C\c3ccc4ncsc4c3)C(=O)N2)cc1C CHEMBL5413503 IC50 18.0 nM
O=C1NC(NCC(O)Cc2ccccc2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5398512 IC50 18.0 nM
CC(C)(C)OC[C@H](NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1)c1ccccc1 CHEMBL5411626 IC50 18.0 nM
Fc1cc(F)cc(CNc2cnc3[nH]cc(-c4cccnc4)c3c2)c1 CHEMBL5410464 IC50 18.0 nM
COc1ccc2sc(C(=O)NC(=O)c3cc(F)ccc3OC)cc2c1 CHEMBL5172542 IC50 18.4 nM
COC[C@@H](CC(C)C)NC1=N/C(=C/c2ccc3ncoc3c2)C(=O)N1C CHEMBL5401556 IC50 18.8 nM
CC(=O)Nc1cc(Cl)cc(Nc2nc(N[C@@H]3CCCC[C@@H]3N)nc3c2ncn3C(C)C)c1 CHEMBL4094492 IC50 19.0 nM
Cc1nc2ccc(-c3cc(N)nc(N)c3)nc2n1C[C@@H](C)Oc1ccccc1 CHEMBL4575900 IC50 19.0 nM
CO[C@H]1CCCC[C@@H]1NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1 CHEMBL5413743 IC50 19.0 nM
O=C1NC(N[C@H]2CN3CCC2CC3)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5428107 IC50 19.0 nM
COc1ccc2sc(C(=O)N(C)Nc3cccc(Cl)c3)cc2c1 CHEMBL5402166 IC50 19.3 nM
CCOC(=O)c1c(/C(C#N)=C/N)c2ccc(Cl)c(Cl)c2n1C CHEMBL4090007 IC50 19.7 nM
O=C1NC(=S)N/C1=C\c1ccc2ncsc2c1 CHEMBL3775754 IC50 20.0 nM
CCS(=O)(=O)c1ccc(OC)c(Nc2ncc(-c3ccc4cc(OC)ccc4c3)o2)c1 CHEMBL4103030 IC50 20.0 nM
Cc1nc(NCc2c(F)cccc2F)c2c(-c3ccnc(N)n3)c[nH]c2n1 CHEMBL5073598 IC50 20.0 nM
Cc1nc(NCc2ncccc2F)c2c(-c3ccnc(N)c3)c[nH]c2n1 CHEMBL5088687 IC50 20.0 nM
Cn1cnc2ccc(/C=C3\N=C(NC4CCCCC4)NC3=O)cc21 CHEMBL5394278 IC50 20.0 nM
O=C1NC(N[C@@H](CO)CC2CCCC2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5422295 IC50 20.0 nM
COC(=O)[C@H](C)NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1 CHEMBL5423907 IC50 20.0 nM
COC(=O)[C@H](CC(C)C)NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1 CHEMBL5428794 IC50 20.0 nM
O=C1NC(NCC23CC4CC(CC(C4)C2)C3)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5422100 IC50 20.0 nM
COc1ccc2sc(C(=O)NC(=O)c3cccc(F)n3)cc2c1 CHEMBL5191525 IC50 20.9 nM
CNC(=O)c1c(F)cccc1Nc1nc(Nc2cc3c(cc2OC)CCN3C(=O)CN(C)C)nc2[nH]ccc12 CHEMBL464552 Kd 21.0 nM
CC(C)n1cnc2c(Nc3cc(N)cc(Cl)c3)nc(N[C@H]3CCCC[C@H]3N)nc21 CHEMBL4104657 IC50 21.0 nM
O=C1NC(NC2CCCCC2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5430357 IC50 21.0 nM
O=C1NC(NC2CCC(F)(F)CC2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5432739 IC50 21.0 nM
O=C1NC(NCc2ccncc2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5434728 IC50 21.0 nM
N=C1NC(=O)/C(=C/c2ccc3c(c2)CCO3)S1 CHEMBL4283751 IC50 21.6 nM
CCN(CC)CCNC(=O)c1c(C)[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c1C CHEMBL535 Kd 22.0 nM
O=C1NC(NC2CC3CCC2C3)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5412998 IC50 22.0 nM
O=C1NC(N[C@@H]2CCCC[C@@H]2O)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5427523 IC50 22.0 nM
Cc1ccc(CNc2ncnc3ccc(-c4ccc5c(c4)OCO5)cc23)o1 CHEMBL1473127 AC50 22.6 nM
COC(=N)c1nc2ccc3ncnc(Nc4ccc(Cl)cc4Cl)c3c2s1 CHEMBL2386747 IC50 22.8 nM
COc1ccc2c(c1)[nH]c1c3ccncc3cc(C#N)c21 CHEMBL3883660 IC50 23.0 nM
COc1ccc2c(c1)[nH]c1c3c(OC)cncc3cc(C#N)c21 CHEMBL3884821 IC50 23.0 nM
CNC(=O)c1cnc2ccc(-c3cnn(C)c3)cn12 CHEMBL4867596 IC50 23.0 nM
C[C@@H]1[C@H]2C[C@@H](C[C@H]1NC1=N/C(=C\c3ccc4ncsc4c3)C(=O)N1)C2(C)C CHEMBL5416470 IC50 23.0 nM
O=C1NC(N[C@H](CO)c2ccccc2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5429783 IC50 23.0 nM
COC(CNC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1)Cc1ccccc1 CHEMBL5421200 IC50 23.0 nM
CN1CCN(c2ccc(NC3=N/C(=C\c4ccc5c(c4)OCO5)C(=O)N3)cc2)CC1 CHEMBL5179655 IC50 23.0 nM
CC(C)c1cccc(CNc2cnc3[nH]cc(-c4cccnc4)c3c2)c1 CHEMBL5417336 IC50 23.0 nM
Cc1cc(-c2ccc3ncc4nnn([C@H](C)c5ccccc5)c4c3c2)ccn1 CHEMBL4067143 IC50 24.0 nM
Cc1nc(OCc2cncs2)c2c(-c3ccnc(N)c3)c[nH]c2n1 CHEMBL5090676 IC50 24.0 nM
O=C1NC(NC2CCCCCC2)=N/C1=C\c1ccc2c(c1)CCO2 CHEMBL5425748 IC50 24.0 nM
CO[C@H]1CCC[C@@H](NC2=N/C(=C\c3ccc4ncsc4c3)C(=O)N2)C1 CHEMBL5396081 IC50 24.0 nM
O=C1NC(NC2CCOCC2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5430718 IC50 24.0 nM
COc1cncc(-c2c[nH]c3ncc(NC(=O)c4ccc(F)cc4)cc23)c1 CHEMBL5418822 IC50 24.0 nM
COc1ccc2sc(C(=O)N(C)N(C)c3cc(F)cc(F)c3)cc2c1 CHEMBL5426802 IC50 24.5 nM
O=C1NC(=O)/C(=C/c2ccc3nccc(-c4ccncc4)c3c2)S1 CHEMBL3544966 Kd apparent 25.0 nM
O=C1NC(NC(CO)C2CCCCC2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5415462 IC50 25.0 nM
CO[C@@H]1Cc2ccccc2[C@H]1NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1 CHEMBL5414635 IC50 25.0 nM
O=C1NC(Nc2cncnc2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5407276 IC50 25.0 nM
COc1cc(Cl)ccc1C(=O)Nc1cnc2[nH]cc(-c3cccnc3)c2c1 CHEMBL5411649 IC50 25.0 nM
Nc1ncc(I)c(-c2c[nH]c3c(N)cccc23)n1 CHEMBL1802410 IC50 26.0 nM
CC(=O)Nc1cc(Cl)cc(Nc2nc(N[C@H]3CCCC[C@H]3N)nc3c2ncn3C(C)C)c1 CHEMBL4067013 IC50 26.0 nM
COCC(Cc1ccccc1)NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1 CHEMBL5406461 IC50 26.0 nM
NC[C@@H](NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1)c1ccccc1 CHEMBL5441121 IC50 26.0 nM
O=C1NC(NCCCn2ccnc2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5398474 IC50 26.0 nM
O=C1NC(N[C@@H](CO)CC2CCC2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5402979 IC50 27.0 nM
O=C1NC(N[C@@H](CO)Cc2ccccc2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5435490 IC50 27.0 nM
CC1(C)CCC(NC2=N/C(=C\c3ccc4ncsc4c3)C(=O)N2)CO1 CHEMBL5436147 IC50 27.0 nM
CN(Cc1nccs1)c1ncnc2ccc(-c3ccc4c(c3)OCO4)cc12 CHEMBL1396483 IC50 28.0 nM
CC[C@@H](CO)Nc1ccc2ncc(-c3cccc(NC(C)=O)c3)n2n1 CHEMBL4061526 IC50 28.0 nM
CO[C@H]1CCC[C@H](NC2=N/C(=C\c3ccc4ncsc4c3)C(=O)N2)CC1 CHEMBL5396280 IC50 28.0 nM
COC(=O)[C@H](Cc1ccccc1)NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1 CHEMBL5434955 IC50 28.0 nM
Cc1cc(-c2ccc3ncc4nnn([C@@H](C)c5ccc(F)cc5)c4c3c2)ccn1 CHEMBL4060440 IC50 29.0 nM
O=C1NC(N[C@H]2CC[C@H](O)CC2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5422936 IC50 29.0 nM
O=C1NC(N[C@H]2CCCCC[C@@H]2O)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5423580 IC50 29.0 nM
O=c1c2c(O)cc(O)cc2oc2c(O)ccc(O)c12 CHEMBL184574 Kd 29.74 nM
Nc1ncc(I)c(-c2c[nH]c3ccccc23)n1 CHEMBL1802406 IC50 30.0 nM
CCS(=O)(=O)c1ccc(OC)c(Nc2ncc(-c3cc4ccccc4s3)o2)c1 CHEMBL4078755 IC50 30.0 nM
C[C@@H](c1ccc(F)cc1)n1nnc2cnc3ccc(-c4ccc5occc5c4)cc3c21 CHEMBL4093503 IC50 30.0 nM
O=C1NC(N[C@@H](CO)CC2CCCCC2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5431535 IC50 30.0 nM
COc1cncc(-c2c[nH]c3ncc(NCc4ccc(N5CCOCC5)cc4)cc23)c1 CHEMBL5416327 IC50 30.0 nM
Clc1cc(Cl)cc(CNc2ncncc2-c2ccc3c(c2)OCO3)c1 CHEMBL1885748 AC50 30.5 nM
COc1ccc2sc(C(=O)NNc3cccc(Cl)n3)cc2c1 CHEMBL5437281 IC50 30.5 nM
CC(C)n1cnc2c(Nc3cc(N)cc(Cl)c3)nc(N[C@H]3CCCNC3)nc21 CHEMBL4064123 IC50 31.0 nM
COC(=N)c1nc2ccc3ncn(C4CC4)c(=O)c3c2s1 CHEMBL4279616 IC50 31.0 nM
COc1cc2c(=O)c3c4ccc(C#N)cc4[nH]c3n(C(C)C)c2c(F)c1N1C[C@@H](C)N(C)[C@@H](C)C1 CHEMBL4764610 IC50 31.0 nM
O=C1NC(NC2CCCCCC2)=N/C1=C\c1ccc2[nH]cnc2c1 CHEMBL5408457 IC50 31.0 nM
O=C(Nc1cnc2[nH]cc(-c3cccnc3)c2c1)c1ccc(F)cc1 CHEMBL5412339 IC50 31.0 nM
Cc1nc(CNc2ncnc3ccc(-c4ccoc4)cc23)cs1 CHEMBL1473855 AC50 31.1 nM
Nc1ncc(I)c(-c2c[nH]c3cc(Br)ccc23)n1 CHEMBL1802966 IC50 32.0 nM
Fc1cccc(CNc2ncnc3ccc(-c4ccc5c(c4)OCO5)cc23)c1 CHEMBL566722 AC50 32.0 nM
CO[C@H]1CCC[C@@H](NC2=N/C(=C\c3ccc4ncsc4c3)C(=O)N2)CC1 CHEMBL5429272 IC50 32.0 nM
CC(=O)OC12CC3CC(CC(NC4=N/C(=C\c5ccc6ncsc6c5)C(=O)N4)(C3)C1)C2 CHEMBL5412101 IC50 32.0 nM
O=C1NC(NCC2CCOCC2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5425492 IC50 32.0 nM
O=C1NC(N[C@H]2CCCOC2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5413726 IC50 32.0 nM
COc1ccc2sc(C(=O)N(C)N(C)c3cccc(C#N)c3)cc2c1 CHEMBL5439262 IC50 32.1 nM
Cc1nc(OCc2cc(C)on2)c2c(-c3ccnc(N)c3)c[nH]c2n1 CHEMBL5090159 IC50 33.0 nM
CC(=O)/C=C1\Sc2ccc(O)cc2N1Cc1cccc(Cl)c1 CHEMBL5408228 IC50 33.0 nM
COC[C@@H](CC(C)C)NC1=N/C(=C\c2ccc3ncsc3n2)C(=O)N1 CHEMBL5429359 IC50 33.6 nM
FC(F)(F)c1cccc(Nc2nccc(-c3ccc4c(c3)OCO4)n2)c1 CHEMBL1868723 IC50 34.0 nM
COc1ccc2[nH]cc(-c3cc4cnccc4cc3NC(C)=O)c2c1 CHEMBL3885335 IC50 34.0 nM
Cc1ccc([C@@H](C)n2nnc3cnc4ccc(-c5ccnc(C)c5)cc4c32)cc1 CHEMBL4104765 IC50 34.0 nM
O=C1NC(NCc2ccccc2OC(F)(F)F)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5431414 IC50 34.0 nM
O=C1NC(N[C@@H]2c3ccccc3C[C@H]2O)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5398161 IC50 34.0 nM
O=C1NC(Nc2ccc(F)cc2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5424064 IC50 34.0 nM
Nc1ccc(-c2cnc3[nH]cc(-c4ccc(O)cc4)c3c2)cc1 CHEMBL4096575 IC50 34.0 nM
COc1ccc2sc(C(=O)NC(=O)c3ccccc3OC)cc2c1 CHEMBL5183331 IC50 34.6 nM
CN1Cc2nn(C)c(C#N)c2-c2cnc3[nH]cc(c3c2)-c2cn(nc2C(F)(F)F)CCCC1=O CHEMBL5093741 Kd 34.81 nM
CNCC(NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1)c1ccccc1 CHEMBL5439276 IC50 35.0 nM
Cc1nc(CNc2ncnc3ccc(-c4ccc5c(c4)OCO5)cc23)cs1 CHEMBL1435542 AC50 35.4 nM
Cc1cc(-c2ccc3ncc4nnn([C@H](C)c5ccc(F)cc5)c4c3c2)ccn1 CHEMBL4088668 IC50 36.0 nM
O=C1NC(N[C@@H]2CCC[C@H](O)C2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5393925 IC50 36.0 nM
CN1C(=O)/C(=C/c2ccc3c(c2)OCO3)N=C1N CHEMBL485053 Kd 36.89 nM
CC[C@H](CO)NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1 CHEMBL5426049 IC50 37.0 nM
CN1CCN(c2ncc(NC3=N/C(=C\c4ccc5ncsc5c4)C(=O)N3)cn2)CC1 CHEMBL5407057 IC50 37.0 nM
COC[C@@H](CC(C)C)NC1=N/C(=C\c2ccc3ncn(C)c3c2)C(=O)N1C CHEMBL5397088 IC50 37.6 nM
COc1ccc2sc(C(=O)NNc3cccc(Br)c3)cc2c1 CHEMBL5417563 IC50 37.7 nM
CC(C)n1cnc2c(Nc3cccc(Cl)c3)nc(N[C@@H]3CCCC[C@@H]3N)nc21 CHEMBL4066861 IC50 38.0 nM
COC[C@@H](CC(C)C)NC1=N/C(=C\c2ccc3ncn(C)c3c2)C(=O)N1 CHEMBL5414174 IC50 38.2 nM
CC(C)C[C@@H](CO)NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1 CHEMBL5408047 IC50 38.7 nM
CC(=O)/C=C1\Sc2ccc(O)cc2N1Cc1cccc(C)c1 CHEMBL5410094 IC50 39.0 nM
O=C1NC(N[C@@H]2CCCOC2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5397281 IC50 39.0 nM
CCS(=O)(=O)c1ccc(OC)c(Nc2ncc(/C=C/c3ccccc3)o2)c1 CHEMBL4065167 IC50 40.0 nM
Cc1nc(-c2ccc3c(c2)OCO3)c2c(-c3ccnc(N)c3)c[nH]c2n1 CHEMBL5078833 IC50 40.0 nM
CC(=O)/C=C1\Sc2ccc(O)cc2N1Cc1ccc(Cl)cc1 CHEMBL5428809 IC50 40.0 nM
COc1ccc2sc(C(=O)NNc3cccc(Cl)c3)cc2c1 CHEMBL5400814 IC50 40.0 nM
Cn1ccc(NC2=N/C(=C\c3ccc4ncsc4c3)C(=O)N2)n1 CHEMBL5407529 IC50 40.0 nM
c1cncc(CNc2nccc(-c3ccc4[nH]ncc4c3)n2)c1 CHEMBL1902528 AC50 40.2 nM
Nc1ncc(I)c(-c2c[nH]c3c([N+](=O)[O-])cccc23)n1 CHEMBL1802405 IC50 41.0 nM
Nc1ncc2cc3cnccc3c(N)c2n1 CHEMBL3823483 IC50 41.0 nM
COc1cccc2c1[nH]c1c3ccncc3cc(C#N)c21 CHEMBL3885431 IC50 41.0 nM
CN1Cc2nn(C)c(C#N)c2-c2cnc3[nH]c(F)c(c3c2)-c2cn(nc2C(F)(F)F)CCCC1=O CHEMBL5086263 Kd 41.81 nM
Nc1ncc(I)c(-c2c[nH]c3c(Br)cccc23)n1 CHEMBL1802967 IC50 42.0 nM
O=C1NC(NC2CCCCCC2)=N/C1=C\c1ccc2c(c1)OCO2 CHEMBL5410991 IC50 42.0 nM
CN1CCN(c2ccc(CNc3cnc4[nH]cc(-c5cncc(F)c5)c4c3)cc2)CC1 CHEMBL5395267 IC50 42.0 nM
CO[C@@H]1CCCC[C@H]1NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1 CHEMBL5394394 IC50 43.0 nM
Cc1n[nH]c2ccc(-c3nnc(C)n3Cc3ccc(Cl)cc3)cc12 CHEMBL5414359 Kd 43.0 nM
COc1ccc([C@H](C)NC(=O)c2cnc3ccc(-c4ccc5ncccc5c4)cn23)cc1 CHEMBL4868417 IC50 44.0 nM
O=C(Nc1ccc2[nH]cnc2c1)c1csc(Nc2ccccc2)n1 CHEMBL5185809 IC50 44.0 nM
C[C@@H](NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1)C1CCCCC1 CHEMBL5430485 IC50 44.0 nM
O=C1NC(N[C@@H]2CCCC[C@H]2O)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5417693 IC50 44.0 nM
COc1ccc2sc(C(=O)N(C)Cc3ccccc3)cc2c1 CHEMBL4085557 IC50 45.0 nM
CN1CCC(NC2=N/C(=C\c3ccc4ncsc4c3)C(=O)N2)C1=O CHEMBL5405521 IC50 45.0 nM
FC(F)(F)c1cccc(CNc2cnc3[nH]cc(-c4cccnc4)c3c2)c1 CHEMBL5426335 IC50 45.0 nM
CC(C)(C)c1cccc(CNc2cnc3[nH]cc(-c4cccnc4)c3c2)c1 CHEMBL5416086 IC50 45.0 nM
c1cncc(-c2c[nH]c3ncc(NCc4ccc(N5CCOCC5)cc4)cc23)c1 CHEMBL5415866 IC50 46.0 nM
COc1ccc2[nH]c3c(=O)[nH]c(-c4cccnc4)c(C#N)c3c2c1 CHEMBL3885036 IC50 47.0 nM
O=C1NC(NC2CCCCC2)=N/C1=C\c1ccc2ncoc2c1 CHEMBL5394477 IC50 47.0 nM
O=C1NC(N[C@H]2CCOC2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5424363 IC50 47.0 nM
O=C1NC(N[C@@H]2COCC[C@H]2O)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5431345 IC50 47.0 nM
Nc1ncnc2c1oc1cc(-c3ccc(Cl)cc3Cl)cnc12 CHEMBL3091797 IC50 49.0 nM
COc1ccc2sc(C(=O)NC(=O)c3ccccc3OC(F)(F)F)cc2c1 CHEMBL5177305 IC50 49.0 nM
Cc1ccc(C(=O)c2cc3cc(O)ccc3s2)cc1O CHEMBL3335356 IC50 50.0 nM
O=C(c1cc2cc(O)ccc2s1)c1cc(O)ccc1F CHEMBL3335358 IC50 50.0 nM
c1nc(N[C@H]2CC[C@H](N3CCOCC3)CC2)c2c(C3CCOCC3)c[nH]c2n1 CHEMBL4064608 IC50 50.0 nM
O=C1NC(NC2CCCC2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5439694 IC50 50.0 nM
COc1ccc2[nH]c3c4ccncc4cc(C#N)c3c2c1 CHEMBL3883639 IC50 51.0 nM
Cc1nc2ccc3sc(NC(=O)c4ccc5scnc5c4)nc3c2s1 CHEMBL5287646 IC50 51.0 nM
COc1ccc2sc(C(=O)NNc3ccccc3OC)cc2c1 CHEMBL5399401 IC50 51.5 nM
C[C@H](NC(=O)c1cnc2ccc(-c3ccc4ncccc4c3)cn12)c1ccccc1 CHEMBL4864799 IC50 52.0 nM
CO[C@H]1CCCC[C@H]1NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1 CHEMBL5395027 IC50 52.0 nM
O=C1NC(NC2Cc3ccccc3C2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5430988 IC50 52.0 nM
O=C1NC(NC2COC2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5412372 IC50 52.0 nM
O=C1NC(N[C@H]2CCCC[C@H]2O)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5429703 IC50 53.0 nM
COc1nc(C)ccc1NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1 CHEMBL5413447 IC50 53.0 nM
CC(=O)/C=C1\Sc2ccc(O)cc2N1Cc1ccccc1 CHEMBL5403328 IC50 54.0 nM
COC[C@H](CC(C)C)NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1 CHEMBL5403642 IC50 55.0 nM
COC(=O)[C@@H](CC(C)C)NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1 CHEMBL5405680 IC50 55.0 nM
CN1CCN(c2cnc(NC3=N/C(=C\c4ccc5ncsc5c4)C(=O)N3)cn2)CC1 CHEMBL5426807 IC50 55.0 nM
COc1ccc2[nH]c3c4c(OC)cncc4cc(C#N)c3c2c1 CHEMBL3884932 IC50 56.0 nM
CC(C)n1cnc2c(Nc3cc(N)cc(Cl)c3)nc(N[C@H]3CCCC[C@@H]3N)nc21 CHEMBL4082309 IC50 56.0 nM
COC[C@@H](CC(C)C)NC1=N/C(=C\c2ccc3c(c2)CCO3)C(=O)N1 CHEMBL5395833 IC50 56.7 nM
Fc1c(-c2ccc3ncnc(NCc4cccs4)c3c2)ccc2c1OCO2 CHEMBL1555138 AC50 57.0 nM
Cc1ccc(CNC2=N/C(=C\c3ccc4ncsc4c3)C(=O)N2)o1 CHEMBL5439185 IC50 58.0 nM
Cn1cc(-c2ccc3occ(-c4cccc(C5CCNCC5)c4)c3n2)cn1 CHEMBL4791451 IC50 59.0 nM
CC(=O)c1cc2cc(O)ccc2s1 CHEMBL3335363 IC50 60.0 nM
O=C1NC(NC2CCC2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5429595 IC50 61.0 nM
O=C1NC(N[C@@H]2CCOC2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5425635 IC50 63.0 nM
COc1ccc2sc(C(=O)N(C)N(C)c3cc(Cl)cc(Cl)c3)cc2c1 CHEMBL5420179 IC50 63.5 nM
O=C(c1ccc(/C=C/c2n[nH]c3ccccc23)cc1)N1CCNCC1 CHEMBL1908397 Kd 64.0 nM
Cc1cc(-c2ccc3ncc4nnn(C(C)C)c4c3c2)ccn1 CHEMBL4069124 IC50 64.0 nM
COC[C@@H](NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1)c1ccccc1 CHEMBL5401217 IC50 64.0 nM
O=C1CC[C@H](NC2=N/C(=C\c3ccc4ncsc4c3)C(=O)N2)CN1 CHEMBL5433242 IC50 64.0 nM
Cn1cncc1C1=CN(c2ncnc3[nH]cnc23)CCS1 CHEMBL5433617 IC50 64.0 nM
O=C(Nc1cnc2[nH]cc(-c3cncc(F)c3)c2c1)c1ccc(F)cc1 CHEMBL5411492 IC50 64.0 nM
COC[C@@H](CC(C)C)NC1=N/C(=C/c2ccc3ncsc3c2)C(=O)N1 CHEMBL5432405 IC50 64.1 nM
Nc1nccc(-c2c[nH]c3c(Br)cccc23)n1 CHEMBL1802963 IC50 65.0 nM
COc1ccc(F)c(F)c1C(=O)c1cnc(NC2CCN(S(C)(=O)=O)CC2)nc1N CHEMBL384304 Kd 66.0 nM
CC(C)n1cnc2c(Nc3cc(N)cc(Cl)c3)nc(N[C@@H]3CCCNC3)nc21 CHEMBL4091876 IC50 66.0 nM
CCn1nnc2cnc3ccc(-c4ccnc(C)c4)cc3c21 CHEMBL4104122 IC50 66.0 nM
O=C1NC(Nc2cccc(OC(F)F)c2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5409693 IC50 66.0 nM
O=C1NC(Nc2ncccn2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5409992 IC50 66.0 nM
Nc1cccc(-c2c[nH]c3ncc(NCc4cc(F)cc(F)c4)cc23)c1 CHEMBL5402600 IC50 66.0 nM
COc1cc(Cl)ccc1C(=O)Nc1cnc2[nH]cc(-c3cncc(F)c3)c2c1 CHEMBL5432630 IC50 66.0 nM
COc1ccc2sc(C(=O)NNc3cccc(F)c3)cc2c1 CHEMBL5434309 IC50 66.5 nM
Nc1ncc(I)c(-c2c[nH]c3cc([N+](=O)[O-])ccc23)n1 CHEMBL1802404 IC50 67.0 nM
Cn1cc2cc(/C=C3\N=C(NC4CCCCCC4)NC3=O)ccc2n1 CHEMBL5425792 IC50 67.0 nM
CC[C@@H](CO)NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1 CHEMBL5437946 IC50 67.0 nM
C=C(C)c1ccc(-c2coc3ccc(-c4cn[nH]c4)nc23)cc1 CHEMBL4743730 IC50 68.0 nM
Nc1ncc2cc3cnccc3c([N+](=O)[O-])c2n1 CHEMBL3823532 IC50 69.0 nM
O=C1NC(NCc2nc3ccccc3s2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5417975 IC50 69.0 nM
Nc1nccc(-c2c[nH]c3c([N+](=O)[O-])cccc23)n1 CHEMBL1802401 IC50 70.0 nM
O=C1NC(=O)/C(=C/c2ccc3nccnc3c2)S1 CHEMBL568150 IC50 70.0 nM
COc1ccc2sc(C(=O)NC(=O)c3cc(F)ccc3F)cc2c1 CHEMBL5206862 IC50 70.0 nM
CCN(CC)c1ccc(CNc2cnc3[nH]cc(-c4cccnc4)c3c2)cc1 CHEMBL5401513 IC50 70.0 nM
Oc1ccc(-c2cnc3[nH]cc(-c4ccc(F)cc4)c3c2)cc1O CHEMBL4292553 Kd 70.8 nM
COc1ccc(-c2cnc3sc4c(N)ncnc4c3c2)c(F)c1 CHEMBL3408804 IC50 71.0 nM
COCCN1CCC(CNC(=O)c2n[nH]c3ccc(-c4cccc(F)c4F)cc23)CC1 CHEMBL3735506 IC50 71.0 nM
CC(C)n1cnc2c(Nc3cc(N)cc(Cl)c3)nc(N[C@H]3CCNC3)nc21 CHEMBL4102101 IC50 71.0 nM
Cc1nc2ccc(/C=C3\N=C(NC45CC6CC(CC(C6)C4)C5)NC3=O)cc2s1 CHEMBL5407040 IC50 71.0 nM
Cc1n[nH]c2ccc(-c3nnc4n3[C@H](c3ccc(Cl)cc3)CC4)nc12 CHEMBL5416758 Kd 71.0 nM
O=C(O[C@@H]1Cc2c(O)cc(O)cc2O[C@@H]1c1cc(O)c(O)c(O)c1)c1cc(O)c(O)c(O)c1 CHEMBL297453 IC50 71.6 nM
c1nc(NCC2CCOC2)c2cc(-c3ccc4c(c3)OCO4)ccc2n1 CHEMBL1436585 Kd 72.0 nM
COc1ccc2sc(C(=O)NNc3cccc(C(F)(F)F)c3)cc2c1 CHEMBL5402730 IC50 73.0 nM
COc1ccc2sc(C(=O)N(C)N(C)c3cccc(Br)c3)cc2c1 CHEMBL5414189 IC50 73.8 nM
CC(C)n1cnc2c(Nc3cccc(Cl)c3)nc(N[C@H]3CCCC[C@H]3N)nc21 CHEMBL4073318 IC50 74.0 nM
O=C1NC(NC23CC4CC(CC(C4)C2)C3)=N/C1=C\c1ccc2nnsc2c1 CHEMBL5434048 IC50 74.0 nM
CCN1/C(=C\C(C)=O)Sc2ccc(OC)cc21 CHEMBL1349996 Kd 75.0 nM
COc1ccc2sc(C(=O)NC(=O)c3ccc(Br)cc3OC)cc2c1 CHEMBL5174345 IC50 75.0 nM
Cc1cnc(CNC2=N/C(=C\c3ccc4ncsc4c3)C(=O)N2)cn1 CHEMBL5422096 IC50 75.0 nM
Nc1ncc(-c2c[nH]c3ncc(NCc4cc(F)cc(F)c4)cc23)cn1 CHEMBL5412760 IC50 75.0 nM
c1cncc(CNc2nccc(-c3ccc4cn[nH]c4c3)n2)c1 CHEMBL1894742 AC50 75.4 nM
COc1ccc(-c2ccnc(NCc3ccc(Cl)c(Cl)c3)n2)cc1 CHEMBL2392360 IC50 76.0 nM
COc1cccc(CN2/C(=C/C(C)=O)Sc3ccc(O)cc32)c1 CHEMBL5412688 IC50 76.0 nM
O=C1NC(N[C@@H]2CCC[C@@H]2O)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5423395 IC50 76.0 nM
CC(C)n1cnc2c(Nc3cccc(Cl)c3)nc(N[C@H]3CCCC[C@@H]3N)nc21 CHEMBL4088144 IC50 78.0 nM
CCOc1ccccc1C(=O)NC(=O)c1cc2cc(OC)ccc2s1 CHEMBL5181998 IC50 79.4 nM
Nc1ccc2c(-c3nc(N)ncc3I)c[nH]c2c1 CHEMBL1802409 IC50 80.0 nM
CCS(=O)(=O)c1ccc(OC)c(Nc2ncc(-c3ccc(CC#N)c(-c4ccccn4)c3)o2)c1 CHEMBL4086603 IC50 80.0 nM
O=C1NC(Nc2nncs2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5424295 IC50 81.0 nM
COc1ccc2sc(C(=O)N(C)Cc3cccnc3)cc2c1 CHEMBL4070477 IC50 81.6 nM
O=C1NC(NCCc2ccccn2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5401073 IC50 83.0 nM
CN1CCCC(NC2=N/C(=C\c3ccc4ncsc4c3)C(=O)N2)C1=O CHEMBL5413138 IC50 83.0 nM
COc1ccc2sc(C(=O)NCc3ccccc3)cc2c1 CHEMBL4103654 IC50 84.0 nM
CC(=O)N1CCc2ccc(NC3=N/C(=C\c4ccc5ncsc5c4)C(=O)N3)cc21 CHEMBL5433644 IC50 85.0 nM
COc1ccc2sc(C(=O)NNc3cccc([N+](=O)[O-])c3)cc2c1 CHEMBL5421375 IC50 85.6 nM
COc1ccc2c(n1)[nH]c1c3ccncc3cc(C#N)c21 CHEMBL3885316 IC50 86.0 nM
CC(C)C[C@H](COC(C)(C)C)NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1 CHEMBL5398683 IC50 86.0 nM
Cc1n[nH]c2ncc(-c3nnc4n3[C@H](c3ccc(Cl)cc3)CC4)cc12 CHEMBL5425043 Kd 86.0 nM
CC(=O)Nc1ccc(-c2cnc(N)nc2-c2c[nH]c3c(Br)cccc23)cc1 CHEMBL1802391 IC50 87.0 nM
Nc1ncnc2c1sc1ncc(-c3ccc(Cl)cc3Cl)cc12 CHEMBL3408799 IC50 88.0 nM
O=C1NCc2ccc3c(-c4cccc(Cl)c4)c[nH]c3c21 CHEMBL4796016 IC50 88.0 nM
Cc1ccsc1CN(C)c1ncnc2ccc(-c3ccc4c(c3)OCO4)cc12 CHEMBL1318637 IC50 89.0 nM
Cc1n[nH]c2ccc(-c3nnc(C)n3Cc3ccc(C(F)(F)F)cc3)cc12 CHEMBL5396725 Kd 89.0 nM
Nc1ccc(-c2c[nH]c3ncc(NCc4cc(F)cc(F)c4)cc23)cc1 CHEMBL5436022 IC50 89.0 nM
O=C(Nc1cnc2[nH]cc(-c3cccnc3)c2c1)c1ccc(C(F)(F)F)c(F)c1 CHEMBL5404932 IC50 89.0 nM
O=C(Nc1ccc2[nH]ncc2c1)c1csc(Nc2ccccc2)n1 CHEMBL5284529 IC50 89.6 nM
CCCOc1ccccc1C(=O)NC(=O)c1cc2cc(OC)ccc2s1 CHEMBL5194284 IC50 89.8 nM
Cc1nc(Nc2n[nH]c3c2CN(C(=O)N[C@H](CN(C)C)c2ccccc2)C3(C)C)c2sccc2n1 CHEMBL3128043 Kd apparent 90.0 nM
O=C1NC(N[C@H]2COCC[C@@H]2O)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5396752 IC50 90.0 nM
CO[C@H]1CCC[C@H]1NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1 CHEMBL5425381 IC50 91.0 nM
COCC(NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1)C1CCCCC1 CHEMBL5418629 IC50 91.0 nM
COc1ccc2sc(C(=O)NC(=O)c3ccccc3Cl)cc2c1 CHEMBL5200302 IC50 92.0 nM
O=C1NC(NC2CCCCC2)=N/C1=C\c1ccc2c(c1)OCO2 CHEMBL5395680 IC50 92.0 nM
CC(C)(C)CN1CCC(NC(=O)c2csc(NC(=O)c3ccc4cc5n(c4c3)C3(CCC3)CNC5=O)n2)CC1 CHEMBL257834 IC50 93.0 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 93.0 nM
O=C1NC(NC2CCNC2=O)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5429357 IC50 97.0 nM
COc1ccc2sc(C(=O)N(C)N(C)c3cccc(N)c3)cc2c1 CHEMBL5411288 IC50 97.4 nM
Cc1nnc(CN(C)c2ncnc3ccc(-c4ccc5c(c4)OCO5)cc23)o1 CHEMBL1437638 IC50 98.0 nM
O=C(c1cccc(O)c1)c1cc2cc(O)ccc2s1 CHEMBL3335350 IC50 100.0 nM
COc1ccc2sc(C(=O)N(C)OC)cc2c1 CHEMBL3335365 IC50 100.0 nM
Nc1ncnc2c1sc1nc(-c3ccc(Cl)cc3Cl)ccc12 CHEMBL3408810 IC50 100.0 nM
O=C1NC(=S)S/C1=C\c1ccc2ncsc2c1 CHEMBL3775393 IC50 100.0 nM
CN1C(=O)/C(=C\c2ccc3c(c2)OCO3)N=C1N CHEMBL4291088 IC50 100.0 nM
CC(C)c1cnn2c(NCc3ccc(-c4ccccn4)cc3)nc(N[C@H]3CC[C@H](N)CC3)nc12 CHEMBL4284209 IC50 100.0 nM
CO[C@H]1CC[C@H](NC2=N/C(=C\c3ccc4ncsc4c3)C(=O)N2)CC1 CHEMBL5429086 IC50 100.0 nM
CC1(C)CNC(=O)C1NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1 CHEMBL5411344 IC50 100.0 nM
FC(F)(F)c1cc(Br)cc(Nc2nccc(-c3ccc4c(c3)OCO4)n2)c1 CHEMBL2392368 IC50 102.0 nM
O=C1NC(NC23CC4CC(CC(C4)C2)C3)=N/C1=C\c1ccc2c(c1)CCO2 CHEMBL5394613 IC50 102.0 nM
O=C1NC(NC2CCCCC2)=N/C1=C\c1ccc2c(c1)CCO2 CHEMBL5419006 IC50 104.0 nM
COC[C@@H](CC(C)C)NC1=N/C(=C\c2ccc3[nH]cnc3c2)C(=O)N1 CHEMBL5417699 IC50 104.0 nM
CN1CCN(C(=O)C(C)(C)c2ccc(C(=O)Cc3cn4cc(-c5ccncc5)ccc4n3)cc2)CC1 CHEMBL5288391 IC50 106.8 nM
COc1ccc2sc(C(=O)NCCc3ccccc3)cc2c1 CHEMBL4064016 IC50 107.0 nM
CCN1CCN(Cc2ccc(NC(=O)Nc3ccc(Oc4cc(NC)ncn4)cc3)cc2C(F)(F)F)CC1 CHEMBL574738 Kd 110.0 nM
Nc1ncnc2c1sc1ncc(-c3ccc(Cl)cc3F)cc12 CHEMBL3408802 IC50 110.0 nM
c1nc(NCc2ccoc2)c2cc(-c3ccc4c(c3)OCO4)ccc2n1 CHEMBL566900 IC50 111.0 nM
COC[C@@H](CC(C)C)NC1=N/C(=C\c2ccc3[nH]cnc3c2)C(=O)N1C CHEMBL5429691 IC50 112.0 nM
c1cc(-c2ccc3[nH]ncc3c2)ccn1 CHEMBL5180549 IC50 112.6 nM
c1ccc(-c2ccc(-c3coc4ccc(-c5cn[nH]c5)nc34)cc2)cc1 CHEMBL4778370 IC50 114.0 nM
Cc1c(-c2ccnc(NCc3cccnc3)n2)sc(=O)n1C CHEMBL1901114 AC50 116.0 nM
CCn1nnc(CCNC(=O)Nc2nc(C)c(-c3ccc(S(C)(=O)=O)c(F)c3)s2)n1 CHEMBL2071342 IC50 118.0 nM
CC(C)n1cnc2c(Nc3cc(N)cc(Cl)c3)nc(N[C@@H]3CCNC3)nc21 CHEMBL4084116 IC50 118.0 nM
Nc1ncc(I)c(-c2c[nH]c3ccc([N+](=O)[O-])cc23)n1 CHEMBL1802403 IC50 120.0 nM
Nc1nccc(-c2c[nH]c3cc(Br)ccc23)n1 CHEMBL46440 IC50 120.0 nM
COc1ccc(CNC(=O)c2cnc3ccc(-c4ccc5ocnc5c4)cn23)cc1 CHEMBL4855417 IC50 122.0 nM
COC(=O)[C@@H](Cc1ccccc1)NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1 CHEMBL5416947 IC50 122.0 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 125.0 nM
Cc1cccc(N(C)c2nccc(-c3cnn4ncccc34)n2)c1 CHEMBL4637319 IC50 125.0 nM
CN1CC[C@](C)(NC2=N/C(=C\c3ccc4ncsc4c3)C(=O)N2)C1=O CHEMBL5428562 IC50 125.0 nM
O=C1NC(NC2CCCNC2=O)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5401201 IC50 125.0 nM
Cc1csc(CN(C)c2ncnc3ccc(-c4ccc5c(c4)OCO5)cc23)n1 CHEMBL1704879 IC50 128.0 nM
c1coc(CCNc2ncnc3ccc(-c4ccc5c(c4)OCO5)cc23)c1 CHEMBL1357975 IC50 130.0 nM
Nc1ncnc2c1sc1ncc(-c3ccc(F)cc3F)cc12 CHEMBL3408801 IC50 130.0 nM
O=C(O)c1nc2ccccc2c2[nH]c3c(Cl)cccc3c12 CHEMBL3589660 IC50 130.0 nM
COC[C@@H](CC(C)C)NC1=N/C(=C\c2ccc3c(c2)OCO3)C(=O)N1C CHEMBL5406864 IC50 131.4 nM
C1=N/C2=N/c3ccc(OCCN4CCCC4)c(c3)COC/C=C/COCc3cccc(c3)C(=C1)N2 CHEMBL2035187 Kd apparent 138.0 nM
Cc1cc(-c2ccc3ncc4nnn(C)c4c3c2)ccn1 CHEMBL4079878 IC50 139.0 nM
O=C1NC(NC2CCCCCC2)=N/C1=C\c1ccc2[nH]ncc2c1 CHEMBL5413427 IC50 139.0 nM
Nc1nc(N)c2nc(-c3cccc(O)c3)c(-c3cccc(O)c3)nc2n1 CHEMBL230011 Kd 140.0 nM
Cn1c2c(c3ccc(Cl)c(Cl)c31)C(C#N)C1(CCNCC1)NC2=O CHEMBL1945559 Ki 140.0 nM
Cn1ncc2cc(/C=C3\N=C(NC45CC6CC(CC(C6)C4)C5)NC3=O)ccc21 CHEMBL5416744 IC50 142.0 nM
Cc1nc2ccc(/C=C3\N=C(NC4CCCCCC4)NC3=O)cc2s1 CHEMBL5435753 IC50 145.0 nM
CN1CCC2(CC1)CC(NC1=N/C(=C\c3ccc4ncsc4c3)C(=O)N1)C2 CHEMBL5426588 IC50 145.0 nM
O=C1NC(NC2CC2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5400270 IC50 146.0 nM
C[C@]12CC3CC(NC4=N/C(=C\c5ccc6ncsc6c5)C(=O)N4)(C1)C[C@@](C)(C3)C2 CHEMBL5435495 IC50 146.0 nM
CCn1cnc2c(Nc3cccc(Cl)c3)nc(N[C@@H]3CCCC[C@@H]3N)nc21 CHEMBL367625 IC50 148.0 nM
O=S(=O)(c1cccc2cnccc12)N1CCCNCC1 CHEMBL38380 Kd apparent 152.0 nM
Cc1cc(-c2ccc3ncc4nnn([C@@H](C)c5ccc(Cl)cc5)c4c3c2)ccn1 CHEMBL4064426 IC50 155.0 nM
c1cncc(CNc2ncnc3ccc(-c4ccc5c(c4)OCO5)cc23)c1 CHEMBL566701 AC50 157.0 nM
Cc1csc(CNc2ncnc3ccc(-c4ccoc4)cc23)c1 CHEMBL1610597 AC50 160.0 nM
N#Cc1cc2cnccc2c2[nH]c3ncccc3c12 CHEMBL3884015 IC50 160.0 nM
O=C1NC(Nc2ccc3c(c2)CCC3)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5409218 IC50 163.0 nM
CN1CCC(NC2=N/C(=C\c3ccc4ncsc4c3)C(=O)N2)CC1 CHEMBL5415615 IC50 167.0 nM
CN1CCC(c2cccc(-c3coc4ccc(-c5cnn(C)c5)nc34)c2)CC1 CHEMBL4741919 IC50 169.0 nM
COc1c(O)ccc2c(=O)c3c(O)cc4c(c3[nH]c12)C=CC(C)(C)O4 CHEMBL3297832 IC50 170.0 nM
CC1C/C(=C\c2ccc3ncsc3c2)C(=O)O1 CHEMBL3775538 IC50 170.0 nM
N#Cc1cc2ccncc2c2[nH]c3ccccc3c12 CHEMBL3883820 IC50 170.0 nM
COC[C@@H](CC(C)C)NC1=N/C(=C\c2ccc3nc(C)sc3c2)C(=O)N1 CHEMBL5435195 IC50 171.1 nM
CC(C)(C)CNc1ncnc2ccc(-c3ccc4c(c3)OCO4)cc12 CHEMBL1551169 IC50 173.0 nM
Cc1ccc([C@H](C)n2nnc3cnc4ccc(-c5ccnc(C)c5)cc4c32)cc1 CHEMBL4086890 IC50 173.0 nM
c1csc(CNc2ncnc3ccc(-c4ccc5c(c4)OCO5)cc23)n1 CHEMBL1705549 IC50 176.0 nM
COC[C@@H](CC(C)C)NC1=N/C(=C\c2ccc3c(c2)CCO3)C(=O)N1C CHEMBL5415238 IC50 177.8 nM
Nc1ncc(I)c(-c2c[nH]c3ccc(Br)cc23)n1 CHEMBL1802965 IC50 180.0 nM
c1cc(-c2ccc3c(c2)OCO3)nc(Nc2ccc3c(c2)OCO3)n1 CHEMBL1885536 IC50 180.0 nM
Nc1ncnc2c1sc1ncc(-c3cccs3)cc12 CHEMBL3408808 IC50 180.0 nM
Clc1ccc(CNc2nccc(-c3ccc4cn[nH]c4c3)n2)cc1Cl CHEMBL2392367 IC50 183.0 nM
CN(C)CC(NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1)c1ccccc1 CHEMBL5438852 IC50 185.0 nM
C[C@@H](c1ccc(F)cc1)n1nnc2cnc3ccc(-c4ccc(C(N)=O)cc4)cc3c21 CHEMBL4100703 IC50 186.0 nM
Cn1ncc2cccc(NC3=N/C(=C\c4ccc5ncsc5c4)C(=O)N3)c21 CHEMBL5394513 IC50 188.0 nM
C[C@@H](c1ccc(F)cc1)n1nnc2cnc3ccc(-c4ccncc4)cc3c21 CHEMBL4081470 IC50 189.0 nM
CC1Cc2ccccc2N1c1[nH]cnc2ncnc1-2 CHEMBL1444643 AC50 190.0 nM
Nc1ncnc2c1sc1ncc(-c3ccc(F)cc3Cl)cc12 CHEMBL3408803 IC50 190.0 nM
Nc1ncnc2c1sc1ncc(-c3ccccc3)cc12 CHEMBL507635 IC50 190.0 nM
Nc1ncc2cc3cnccc3cc2n1 CHEMBL3823505 IC50 190.0 nM
COC[C@@H](CC(C)C)NC1=N/C(=C\c2ccc3nn(C)cc3c2)C(=O)N1 CHEMBL5422963 IC50 190.8 nM
c1c[nH]c(CNc2ncnc3ccc(-c4ccc5c(c4)OCO5)cc23)n1 CHEMBL1407164 IC50 191.0 nM
c1coc(CNc2ncnc3ccc(-c4ccc5c(c4)OCO5)cc23)c1 CHEMBL1725513 IC50 192.0 nM
O=C1NC(Nc2cccc(C(F)(F)F)c2)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5437446 IC50 193.0 nM
O=C(c1ccccc1)c1cc2cc(O)ccc2s1 CHEMBL3335361 IC50 200.0 nM
O=C1NC(=S)S/C1=C\c1ccc2ncccc2c1 CHEMBL3774448 IC50 200.0 nM
CCN1C(=O)/C(=C/c2ccc3ncsc3c2)N=C1N[C@@H](COC)CC(C)C CHEMBL5433334 IC50 200.4 nM
O=C1NC(N[C@H]2CCCC[C@@H]2O)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5398602 IC50 205.0 nM
CCOC(=O)C1=C(NN2CCN(CC(F)(F)F)CC2)O/C(=C\c2c[nH]c3ncccc23)C1=O CHEMBL4868568 IC50 206.0 nM
CO[C@H]1Cc2ccccc2[C@H]1NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1 CHEMBL5399810 IC50 207.0 nM
Cc1cc(-c2cc(-c3ccccc3)[nH]c(=O)n2)ccc1O CHEMBL501724 IC50 210.0 nM
Nc1nccc(-c2c[nH]c3ccc(Br)cc23)n1 CHEMBL44541 IC50 220.0 nM
CC(C)C[C@H](COCc1ccccc1)NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1 CHEMBL5428588 IC50 220.0 nM
CCOC(=O)c1ccc2ncc(C(=O)OCC)c(Nc3ccc(N4CCOCC4)cc3)c2c1 CHEMBL1300063 AC50 227.0 nM
COc1ccc2c(/C(C#N)=C/c3cccnc3)c[nH]c2n1 CHEMBL3884570 IC50 230.0 nM
N#Cc1cc2cnccc2c2[nH]c3ccc(F)cc3c12 CHEMBL3883414 IC50 230.0 nM
COc1ccc(-c2ccc3ncc4c(c3c2)n(-c2ccc(N3CCNCC3)c(C(F)(F)F)c2)c(=O)n4C)cn1 CHEMBL3218578 Kd apparent 246.0 nM
CN1CCCC(NC2=N/C(=C\c3ccc4ncsc4c3)C(=O)N2)C1 CHEMBL5420670 IC50 247.0 nM
COC[C@@H](CC(C)C)NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1C1CC1 CHEMBL5406672 IC50 249.8 nM
CNC(=O)c1ccc(Nc2ncc(C(F)(F)F)c(NCc3nccnc3N(C)S(C)(=O)=O)n2)cc1 CHEMBL3137331 IC50 250.0 nM
Fc1cc(F)cc(CNc2cnc3[nH]cc(-c4cc5ccccc5s4)c3c2)c1 CHEMBL5440916 IC50 252.0 nM
COC[C@@H](CC(C)C)NC1=N/C(=C\c2ccc3nn(C)cc3c2)C(=O)N1C CHEMBL5422667 IC50 258.5 nM
N#CCn1c2ccc(O)cc2c2c3c(n4cccc4c21)C(=O)NC3=O CHEMBL5280284 IC50 260.0 nM
CN(C)c1ccc(-c2nccc(NCc3cccs3)n2)cc1 CHEMBL1356135 AC50 265.0 nM
O=C(Nc1cncc(-c2cc(-c3cccnc3)cs2)c1)C1CC1 CHEMBL4283503 IC50 270.0 nM
O=C1NC(NC2CCCCCC2)=N/C1=C\c1ccc2nnsc2c1 CHEMBL5401764 IC50 270.0 nM
CC(C)n1cnc2c(Nc3cc(N)cc(Cl)c3)nc(N[C@@H]3CCCC[C@H]3N)nc21 CHEMBL4100324 IC50 274.0 nM
COC[C@@H](CC(C)C)NC1=N/C(=C\c2ccc3[nH]ncc3c2)C(=O)N1C CHEMBL5415554 IC50 275.4 nM
CC(=O)c1c(C)c2cnc(Nc3ccc(N4CCNCC4)cn3)nc2n(C2CCCC2)c1=O CHEMBL189963 Kd apparent 276.0 nM
COc1ccc(-c2ccnc(NCc3ccc(Cl)cc3)n2)cc1 CHEMBL2392359 IC50 277.0 nM
COc1ccc(-c2cnc3sc4c(N)ncnc4c3c2)cc1 CHEMBL3408795 IC50 280.0 nM
C[C@@H](c1ccc(F)cc1)n1nnc2cnc3ccc(-c4cnn(C)c4)cc3c21 CHEMBL4063617 IC50 280.0 nM
C[C@H](NC(=O)c1cnc2ccc(-c3cnn(C)c3)cn12)c1ccccc1 CHEMBL4850068 IC50 296.0 nM
O=C(c1ccc(O)cc1)c1cc2cc(O)ccc2s1 CHEMBL3335354 IC50 300.0 nM
O=C(c1ccc(F)c(O)c1)c1cc2cc(O)ccc2s1 CHEMBL3335359 IC50 300.0 nM
CNC(=O)c1ccc(Nc2nc(OC3CCCC3)c3c(-c4ccc5nc(C)oc5c4)c[nH]c3n2)c(OC)c1 CHEMBL4062218 IC50 300.0 nM
CC1(c2ccc(-c3coc4ccc(-c5cn[nH]c5)nc34)cc2)CC1 CHEMBL4740998 IC50 308.0 nM
Cc1n[nH]cc1-c1cc2nc([C@@H]3CCCCN3)[nH]c(=O)c2s1 CHEMBL4439133 IC50 310.0 nM
NC(=O)c1ccc2nc(-c3ccc(C4(N)CCC4)cc3)c(-c3ccccc3)n2n1 CHEMBL4751394 Kd 310.0 nM
COC[C@@H](CC(C)C)NC1=N/C(=C\c2ccc3[nH]ncc3c2)C(=O)N1 CHEMBL5432194 IC50 310.4 nM
Nc1ncnc2c1oc1cc(-c3ccc4c(c3)OCO4)cnc12 CHEMBL3091798 IC50 320.0 nM
Fc1cc(F)cc(CNc2cnc3[nH]cc(C4=CCCCC4)c3c2)c1 CHEMBL5426304 IC50 324.0 nM
CC(C)C[C@H](COCc1ccc(F)cc1)NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1 CHEMBL5416161 IC50 325.0 nM
Cc1ccc(NC2=N/C(=C\c3ccc4ncsc4c3)C(=O)N2)cc1F CHEMBL5434778 IC50 329.0 nM
CCN(CC)c1nc2cc(OC)ccc2cc1C#N CHEMBL1440473 AC50 343.0 nM
COC(=O)C1(NC2=N/C(=C\c3ccc4ncsc4c3)C(=O)N2)C2CC3CC(C2)CC1C3 CHEMBL5417890 IC50 348.0 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 350.0 nM
CC(C)[C@@H]1CC[C@@H](C)C[C@H]1NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1 CHEMBL5406527 IC50 355.0 nM
Cc1[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c(C)c1C(=O)NC[C@H](O)CN1CCOCC1 CHEMBL1721885 Kd 360.0 nM
CN(c1ncccc1CNc1nc(Nc2ccc3c(c2)CC(=O)N3)ncc1C(F)(F)F)S(C)(=O)=O CHEMBL1084546 Kd apparent 363.0 nM
CCn1cnc2c(Nc3cccc(Cl)c3)nc(N[C@H]3CCCC[C@@H]3N)nc21 CHEMBL4080283 IC50 371.0 nM
CN1CCN(c2cnc(NC3=N/C(=C\c4ccc5ncsc5c4)C(=O)N3)nc2)CC1 CHEMBL5398195 IC50 372.0 nM
COc1ccc2cc(C#N)c(NC(C)C)nc2c1 CHEMBL1450635 AC50 374.0 nM
O=C1NC(N[C@@H]2CN3CCC2CC3)=N/C1=C\c1ccc2ncsc2c1 CHEMBL5434213 IC50 379.0 nM
Nc1nccc(-c2c[nH]c3cc([N+](=O)[O-])ccc23)n1 CHEMBL1802400 IC50 380.0 nM
CC(=O)c1ccc(-c2cnc(N)nc2-c2c[nH]c3c(Br)cccc23)cc1 CHEMBL1802971 IC50 380.0 nM
O=C1NCc2c(Cl)cc3c(-c4ccccc4)c[nH]c3c21 CHEMBL5290575 IC50 380.0 nM
COc1ccc2sc(-c3cncc(NC(C)=O)c3)nc2c1 CHEMBL5288595 IC50 384.7 nM
c1cncc(CNc2ccnc(-c3ccc4[nH]ncc4c3)n2)c1 CHEMBL1884711 AC50 385.0 nM
O=C(Nc1cnc2[nH]cc(-c3cncc(F)c3)c2c1)c1ccco1 CHEMBL5411512 IC50 389.0 nM
CC(NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1)C12CC3CC(CC(C3)C1)C2 CHEMBL5409178 IC50 391.0 nM
C[C@H](NC(=O)c1cnc2ccc(-c3cnn(C)c3)cn12)c1ccc(Cl)cc1 CHEMBL4860037 IC50 399.0 nM
O=C(O)COc1ccc(/C=C/c2nc3ccc([N+](=O)[O-])cc3s2)cc1 CHEMBL1579512 AC50 400.0 nM
N#Cc1cccc(C(=O)c2cc3cc(O)ccc3s2)c1 CHEMBL3335360 IC50 400.0 nM
CC(C)n1cnc2c(Nc3cccc(Cl)c3)nc(N[C@@H]3CCCC[C@H]3N)nc21 CHEMBL4104505 IC50 400.0 nM
COC[C@@H](CC(C)C)NC1=N/C(=C\c2ccc3c(cnn3C)c2)C(=O)N1C CHEMBL5414086 IC50 407.9 nM
CC(C)(C)c1cnc(CSc2cnc(NC(=O)C3CCNCC3)s2)o1 CHEMBL296468 Kd 410.0 nM
COc1cccc(-c2ccc3ncnc(N(C)Cc4ccco4)c3c2)c1 CHEMBL1399528 AC50 410.0 nM
COc1ccc2c(c1)oc1c(N)ncnc12 CHEMBL2314163 IC50 410.0 nM
CN(C)CC#Cc1ccc2[nH]c3c(c2c1)-c1nc(N)ncc1CCC3 CHEMBL5174830 IC50 420.0 nM
CCc1cc2c(cc1-c1cccc(S(=O)(=O)F)c1)C(C)(C)c1[nH]c3cc(C#N)ccc3c1C2=O CHEMBL4468747 IC50 422.0 nM
CC(=O)Nc1ccc(SCc2ncc(-c3ccccc3)o2)cc1 CHEMBL1383996 AC50 429.0 nM
COc1ccc2c(-c3ccncc3)c[nH]c2n1 CHEMBL3883448 IC50 430.0 nM
COc1cc(-c2ccc3ncc4nnn([C@@H](C)c5ccc(F)cc5)c4c3c2)ccn1 CHEMBL4092984 IC50 430.0 nM
COc1ccc(-c2ccc3ncc4nnn([C@@H](C)c5ccc(F)cc5)c4c3c2)cc1 CHEMBL4072220 IC50 439.0 nM
c1ccc(Cc2ccc(-c3coc4ccc(-c5cn[nH]c5)nc34)cc2)cc1 CHEMBL4789373 IC50 450.0 nM
Fc1cccc(/C=N/c2cnc3[nH]cc(-c4cncc(F)c4)c3c2)c1 CHEMBL5416749 IC50 454.0 nM
Fc1cc(F)cc(CNc2cnc3[nH]cc(-c4ccc(C(F)(F)F)cc4)c3c2)c1 CHEMBL5397989 IC50 458.0 nM
CCOC(=O)c1cnc2ccc(OC)cc2c1Nc1ccc2c(c1)OCCO2 CHEMBL1508872 AC50 461.0 nM
COc1cc(/C=C2\N=C(N)NC2=O)ccc1O CHEMBL603189 IC50 470.0 nM
COc1ccc2cc(C#N)c(N3CCOCC3)nc2c1 CHEMBL1607471 AC50 471.0 nM
NC1(C(=O)N[C@@H](CCO)c2ccc(Cl)cc2)CCN(c2nc[nH]c3nccc2-3)CC1 CHEMBL2325741 Kd apparent 475.0 nM
Fc1cc(F)cc(CNc2cnc3[nH]cc(-c4ccc5ccccc5c4)c3c2)c1 CHEMBL5429415 IC50 476.0 nM
CN(Cc1ncc[nH]1)c1ncnc2ccc(-c3ccc4c(c3)OCO4)cc12 CHEMBL1397614 IC50 480.0 nM
CC(C)(C)C(=O)OC12CC3CC(CC(NC4=N/C(=C\c5ccc6ncsc6c5)C(=O)N4)(C3)C1)C2 CHEMBL5437649 IC50 481.0 nM
COC[C@@H](CC(C)C)NC1=N/C(=C\c2ccc3nc(C)sc3c2)C(=O)N1C CHEMBL5421052 IC50 496.0 nM
Nc1ncnc2c1sc1ncc(-c3ccc([N+](=O)[O-])cc3)cc12 CHEMBL3408806 IC50 500.0 nM
O=C1NC(=S)S/C1=C\c1ccc2c(c1)CCO2 CHEMBL3774830 IC50 500.0 nM
CC(=O)N1CCN([C@H]2CC[C@H](Nc3ncnn4ccc(C(C)C)c34)CC2)CC1 CHEMBL4278882 IC50 502.0 nM
Cn1cc(C2=C(c3cn(C4CCN(Cc5ccccn5)CC4)c4ccccc34)C(=O)NC2=O)c2ccccc21 CHEMBL300138 Kd 510.0 nM
Fc1ccc(/C=N/c2cnc3[nH]cc(-c4cncc(F)c4)c3c2)cc1 CHEMBL5425642 IC50 510.0 nM
C[C@@H]1CCNC(=O)c2cc3ccc(C(=O)Nc4nc5ccccc5n4CCCN(C)C)cc3n21 CHEMBL1933288 IC50 512.0 nM
Nc1ncnc2c1sc1ncc(-c3ccc4c(c3)OCO4)cc12 CHEMBL3408807 IC50 520.0 nM
C[C@@H](c1ccc(F)cc1)n1nnc2cnc3ccc(N4CCOCC4)cc3c21 CHEMBL4082710 IC50 529.0 nM
Nc1nccc(-c2c[nH]c3ccccc23)n1 CHEMBL48082 IC50 530.0 nM
CC(=O)Nc1ccc(-c2cnc(N)nc2-c2c[nH]c3cc(Br)ccc23)cc1 CHEMBL1802390 IC50 530.0 nM
O=C1NC(NC2CCCCC2)=N/C1=C\c1ccc2[nH]ncc2c1 CHEMBL5422413 IC50 541.0 nM
COc1cc2c(Oc3ccc(NC(=O)C4(C(=O)Nc5ccc(F)cc5)CC4)cc3F)ccnc2cc1OCCCN1CCOCC1 CHEMBL1230609 Kd 550.0 nM
COc1ccc(-c2cnc3ccc(NCc4cc(F)cc(F)c4)cn23)cc1 CHEMBL5423818 IC50 569.0 nM
COc1cccc2c1[nH]c1c3ccncc3cc(C(N)=O)c21 CHEMBL3884627 IC50 570.0 nM
Cc1nc(NC(=O)c2ccccc2)sc1-c1csc(NCc2ccco2)n1 CHEMBL1492194 AC50 579.0 nM
COC[C@@H](CC(C)C)NC1=N/C(=C\c2ccc3c(cnn3C)c2)C(=O)N1 CHEMBL5420112 IC50 583.4 nM
Cc1nc(N)sc1-c1ccnc(Nc2ccc(N3CCOCC3)cc2)n1 CHEMBL482967 Kd apparent 586.0 nM
COc1cc(Nc2c(C#N)cnc3cc(OCCCN4CCN(C)CC4)c(OC)cc23)c(Cl)cc1Cl CHEMBL288441 Kd apparent 598.0 nM
CCN(CC)Cc1ccc(OC)c(-c2cc3c(-c4ccc(C(=O)O)c(C(C)C)c4)ccnc3[nH]2)c1 CHEMBL4798421 IC50 607.2 nM
Nc1ccc2[nH]cc(-c3nc(N)ncc3I)c2c1 CHEMBL1802408 IC50 610.0 nM
Cc1ccc(-c2cnc3c(c2)oc2c(N)ncnc23)cc1 CHEMBL3091818 IC50 610.0 nM
COc1cccc2[nH]c3c4ccncc4cc(C#N)c3c12 CHEMBL3884250 IC50 620.0 nM
Cc1ccsc1CNc1ncnc2ccc(-c3c(C)noc3C)cc12 CHEMBL1574454 AC50 622.0 nM
Clc1ccc(CNc2ncncc2-c2ccc3c(c2)OCO3)cc1Cl CHEMBL2392228 IC50 626.0 nM
COc1cc2c(N3CCN(C(=O)Nc4ccc(OC(C)C)cc4)CC3)ncnc2cc1OCCCN1CCCCC1 CHEMBL124660 Kd 630.0 nM
COc1c(Cl)cc2c([nH]c3cnccc32)c1NC(=O)c1cccnc1C CHEMBL608154 Kd 640.0 nM
COC[C@@H](CC(C)C)NC1=N/C(=C\c2ccc3nnsc3c2)C(=O)N1 CHEMBL5406490 IC50 650.0 nM
C=CC(=O)Nc1cccc(Nc2nc(Nc3ccc(N4CCN(C(C)=O)CC4)cc3OC)ncc2C(F)(F)F)c1 CHEMBL3545308 Kd apparent 651.0 nM
Nc1nc(Nc2ccc(S(N)(=O)=O)cc2)nn1C(=O)c1c(F)cccc1F CHEMBL191003 Kd 660.0 nM
O=S(=O)(Nc1cnc2[nH]cc(-c3cncc(F)c3)c2c1)c1ccc(F)cc1 CHEMBL5416971 IC50 667.0 nM
CC(=O)Nc1nc2cc(N)ccc2s1 CHEMBL1440984 AC50 670.0 nM
CC(C)Cc1ccc(-c2coc3ccc(-c4cn[nH]c4)nc23)cc1 CHEMBL4794825 IC50 671.0 nM
COc1ccc2nc(NC(=O)c3cccc(S(=O)(=O)N4CCOCC4)c3)sc2c1 CHEMBL1545657 AC50 679.0 nM
Nc1ncnc2c1sc1ncccc12 CHEMBL457313 IC50 680.0 nM
COc1ccc2c(c1)sc1c(Nc3ccc4c(c3)OCCO4)ncnc12 CHEMBL2313912 IC50 680.0 nM
Nc1ncnc2c1oc1cc(-c3ccccc3)cnc12 CHEMBL3091817 IC50 690.0 nM
Nc1ncnc2c1sc1ncc(-c3cccc(Cl)c3)cc12 CHEMBL3408797 IC50 690.0 nM
Cc1ccc(CNc2ncnc3ccc(-c4ccoc4C)cc23)o1 CHEMBL1611201 AC50 695.0 nM
NC(=O)c1cc(-c2cn3cc(Br)ccc3n2)ccc1O CHEMBL3908596 IC50 700.0 nM
CCc1cnn2c(NCc3ccc[n+]([O-])c3)cc(N3CCCC[C@H]3CCO)nc12 CHEMBL2103840 Kd apparent 714.0 nM
Cc1[nH]c(/C=C2\C(=O)Nc3ccc(S(=O)(=O)Cc4c(Cl)cccc4Cl)cc32)c(C)c1C(=O)N1CCC[C@@H]1CN1CCCC1 CHEMBL450786 Kd 730.0 nM
CN1CCN(C(=O)c2ccc(NC(=O)Nc3nc4ccc(O)cc4s3)cc2)CC1 CHEMBL4287375 IC50 730.0 nM
COC[C@@H](CC(C)C)NC1=N/C(=C\c2ccc3nnsc3c2)C(=O)N1C CHEMBL5426876 IC50 733.8 nM
CC(=O)Nc1ccc(-c2cnc(N)nc2-c2c[nH]c3ccc(Br)cc23)cc1 CHEMBL1802389 IC50 750.0 nM
NC(=O)c1cccc(-c2c[nH]c3ncc(NCc4cc(F)cc(F)c4)cc23)c1 CHEMBL5438084 IC50 762.0 nM
CCS(=O)(=O)N1CC(CC#N)(n2cc(-c3ncnc4[nH]ccc34)cn2)C1 CHEMBL2105759 Kd apparent 778.0 nM
CC(=O)N1CCN([C@H]2CC[C@H](Nc3ncnn4ccc(C5CCOCC5)c34)CC2)CC1 CHEMBL4290222 IC50 786.0 nM
COc1ccc2c(c1)sc1c(Nc3ccc(N(C)C)cc3)ncnc12 CHEMBL2313884 IC50 790.0 nM
CCOC(=O)c1ccc(-c2ccc3ncnc(NCc4cccs4)c3c2)o1 CHEMBL1535925 IC50 798.0 nM
CNC(=O)O[C@@H](C)/C=C\C(=O)N[C@H]1CC[C@@H](C/C=C(C)/C=C/[C@@H]2C[C@]3(CO3)CC(C)(C)O2)CC1 CHEMBL3108948 EC50 800.0 nM
COc1ccc([C@H](C)NC(=O)c2cnc3ccc(-c4cnn(C)c4)cn23)cc1 CHEMBL4875425 IC50 809.0 nM
COc1ccc2c(c1)[nH]c1c3ccncc3cc(CN)c21 CHEMBL3885328 IC50 830.0 nM
O=C(Nc1cc(C(F)(F)F)ccc1N1CCN(Cc2ccccn2)CC1)c1ccc(-c2ccncc2)o1 CHEMBL5074274 IC50 839.0 nM
O=C1NC(NC2CCCCC2)=N/C1=C\c1ccc2nnsc2c1 CHEMBL5414361 IC50 852.0 nM
NC(=O)c1c(NC(=O)c2ccc(N3C(=O)CCC3=O)cc2)sc2c1CCCC2 CHEMBL1444580 AC50 853.0 nM
CCn1cnc2c(Nc3cccc(Cl)c3)nc(N[C@@H]3CCCC[C@H]3N)nc21 CHEMBL1532768 IC50 868.0 nM
COc1cccc(-c2cnc(N)nc2-c2c[nH]c3c(Br)cccc23)c1 CHEMBL1802399 IC50 870.0 nM
O=C1NC(NC2CCCCC2)=N/C1=C\c1ccc2[nH]cnc2c1 CHEMBL5437222 IC50 883.0 nM
Cc1ccc(CNc2ncnc3ccc(-c4ccc5c(c4)OCO5)cc23)s1 CHEMBL1599314 IC50 888.0 nM
NC(=O)c1cc(-c2cn3cc(O)ccc3n2)ccc1O CHEMBL3962894 IC50 890.0 nM
CN(C)CC(=O)N1CCC(c2ccc(NC(=O)c3nc(C#N)c[nH]3)c(C3=CCCCC3)c2)CC1 CHEMBL1908395 Kd 900.0 nM
CN(C)C[C@@H]1CCn2cc(c3ccccc32)C2=C(C(=O)NC2=O)c2cn(c3ccccc23)CCO1 CHEMBL91829 Kd 910.0 nM
CC(C)n1nc(-c2cc3cc(O)ccc3[nH]2)c2c(N)ncnc21 CHEMBL1241674 Kd 910.0 nM
Nc1ncnc2c1sc1ncc(-c3ccc(Br)cc3)cc12 CHEMBL3408805 IC50 910.0 nM
N#CCNC(=O)c1ccc(-c2ccnc(Nc3ccc(N4CCOCC4)cc3)n2)cc1 CHEMBL1078178 Kd apparent 918.0 nM
c1nc(NCCc2c[nH]cn2)c2cc(-c3ccc4c(c3)OCO4)ccc2n1 CHEMBL1515868 IC50 931.0 nM
CC[C@@H]1C(=O)N(C)c2cnc(Nc3ccc(C(=O)NC4CCN(C)CC4)cc3OC)nc2N1C1CCCC1 CHEMBL513909 Kd 940.0 nM
C[C@@H](NC(=O)c1ncnc(N)c1Cl)c1ncc(C(=O)Nc2cc(C(F)(F)F)c(Cl)cn2)s1 CHEMBL3348923 Kd apparent 942.0 nM
CC(C)(C)c1ccc(-c2coc3ccc(-c4cn[nH]c4)nc23)cc1 CHEMBL4777288 IC50 946.0 nM
Nc1ncnc2c1sc1ncc(-c3cncnc3)cc12 CHEMBL3408809 IC50 950.0 nM
Cn1cc2cc(/C=C3\N=C(NC4CCCCC4)NC3=O)ccc2n1 CHEMBL5396119 IC50 951.0 nM
O=C(NC1CCNCC1)c1n[nH]cc1NC(=O)c1c(Cl)cccc1Cl CHEMBL445813 Kd 990.0 nM
CC(=O)c1ccc(-c2ccc3ncc4nnn([C@@H](C)c5ccc(F)cc5)c4c3c2)s1 CHEMBL4104093 IC50 993.0 nM