CC(C)(C)[C@H](NC(=O)[C@H](CCONC(=N)N)NC(=O)Cc1ccc(CNC(=N)N)cc1)C(=O)N[C@@H](CCONC(=N)N)C(=O)NCc1ccc(C(=N)N)cc1 CHEMBL4790628 IC50 0.0 nM
C[C@@H](CC1CCCCC1)OC(=O)NN(C)C#N CHEMBL190121 Ki 0.025 nM
CC[C@@H](Cc1ccccc1)OC(=O)NN(C)C#N CHEMBL191558 Ki 0.036 nM
CC(C)C[C@H](NC(=O)c1cc2ccccc2o1)C(=O)N[C@@H]1C(=O)CN(S(=O)(=O)c2ccccn2)CC[C@@H]1C CHEMBL202668 Ki app 0.04 nM
CC(C)C[C@H](NC(=O)Nc1ccccc1)C(=O)N(C)N(C)C#N CHEMBL1651355 Ki 0.045 nM
CC(C)C[C@H](NC(=O)c1cc2ccccc2o1)C(=O)N[C@H]1CC[C@@H](C)N(S(=O)(=O)c2ccccn2)CC1=O CHEMBL203665 Ki app 0.068 nM
CC[C@H](C)[C@@H](C(=O)O[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](/C=C/C(=O)N1C(=O)C=C(OC)[C@@H]1CC(C)C)Cc1ccccc1)N(C)C CHEMBL4441303 IC50 0.094 nM
O=C(N[C@@H](Cc1ccccc1)C(=O)N[C@@H]1C(=O)N[C@H]1Sc1ccccc1)OCc1ccccc1 CHEMBL31788 IC50 0.1 nM
O=C(N[C@@H](Cc1ccccc1)C(=O)N[C@@H]1C(=O)N[C@H]1S(=O)(=O)c1ccccc1)OCc1ccccc1 CHEMBL287630 IC50 0.1 nM
CN(C#N)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)c1cc(C(C)(C)C)nn1C CHEMBL4212454 pKi 0.1259 nM
CC(C)C[C@@H](C=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1 CHEMBL64925 IC50 0.15 nM
CN(C#N)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 CHEMBL604281 Ki 0.16 nM
COc1ccc(CCNC(=O)c2cnc(C#N)nc2NC2CCCCC2)cc1 CHEMBL218024 IC50 0.17 nM
CN1CCN(C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](/C=C/S(=O)(=O)c2ccccc2)CCc2ccccc2)CC1 CHEMBL91704 IC50 0.2 nM
CC(C)C[C@H](NC(=O)c1ccc(-c2noc(-c3cccs3)n2)cc1)C(=O)N(C)N(C)C#N CHEMBL1651361 Ki 0.22 nM
CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](C[C@@H]1CCNC1=O)C(O)S(=O)(=O)[O-] CHEMBL3427166 IC50 0.25 nM
C[C@@H](OCc1ccccc1)[C@@H](C#N)NC(=O)[C@H](Cc1cccc(Cl)c1)NS(=O)(=O)c1cccc(Br)c1 CHEMBL4755248 pKi 0.2512 nM
COc1cccc(CCNC(=O)c2cnc(C#N)nc2NC2CCCCC2)c1 CHEMBL385632 IC50 0.31 nM
CN1CCN(Cc2ccc(CCNC(=O)c3cnc(C#N)nc3NCC(C)(C)C)cc2)CC1 CHEMBL374890 IC50 0.33 nM
COc1ccc(CCNC(=O)c2cnc(C#N)nc2NCC(C)(C)C)cc1 CHEMBL220496 IC50 0.34 nM
CN(C#N)N(C)C(=O)[C@H](Cc1ccc(O)cc1)NC(=O)OCc1ccccc1 CHEMBL1651353 Ki 0.36 nM
CC(C)C[C@H](NC(=O)NCc1ccccc1)C(=O)N(C)N(C)C#N CHEMBL1651354 Ki 0.39 nM
CN(C#N)N(C)C(=O)[C@H](CC1CCCCC1)NC(=O)OCc1ccccc1 CHEMBL1651352 Ki 0.4 nM
CC(=O)/C=C/[C@H](CCc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 CHEMBL4078345 Ki 0.4 nM
O=C(N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@H]1CCCN(S(=O)(=O)c2ccccn2)CC1=O)c1cccc2ccccc12 CHEMBL194643 Ki app 0.43 nM
CC(=O)c1c(Nc2ccc(Cl)cc2)[nH]c2c(Cl)cc([N+](=O)[O-])cc2c1=O CHEMBL492175 IC50 0.437 nM
CN1CCN(c2ccc(CCNC(=O)c3cnc(C#N)nc3NC3CCCCC3)cc2)CC1 CHEMBL219536 IC50 0.45 nM
O=C[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 CHEMBL177914 Ki app 0.47 nM
CC(C)C[C@H](NC(=O)c1cc2cc(OCCN3CCOCC3)ccc2o1)C(=O)N[C@H]1CCCN(C(=O)Cc2cccc(-c3ccccn3)c2)CC1=O CHEMBL284939 Ki 0.49 nM
C[C@@H](OCc1ccccc1)[C@@H](C#N)NC(=O)[C@H](Cc1cccc(Br)c1)NC(=O)c1cc(C(C)(C)C)nn1C CHEMBL4746022 pKi 0.5012 nM
CC(C)C[C@H](NC(=O)c1cc(C(C)(C)C)nn1C)C(=O)N(C)N(C)C#N CHEMBL4217414 pKi 0.5012 nM
CC(C)(C)CNc1nc(C#N)ncc1C(=O)NCCc1ccc(OCCn2ccnc2)cc1 CHEMBL218007 IC50 0.52 nM
CC(C)C[C@H](NC(=O)c1ccco1)C(=O)N[C@H]1CC[C@@H](C)N(S(=O)(=O)c2ccccn2)CC1=O CHEMBL1807649 IC50 0.53 nM
O=C(N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@H]1CCCN(S(=O)(=O)c2ccccn2)CC1=O)c1cc2ccccc2o1 CHEMBL194861 Ki app 0.57 nM
COc1ccc(CCNC(=O)c2cnc(C#N)nc2NCC(C)(C)C)cc1OCCn1ccnc1 CHEMBL436303 IC50 0.58 nM
CCCCOc1ccc(C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)C(=O)C=O)cc1 CHEMBL48837 Ki 0.6 nM
CC(=O)/C=C/[C@H](CCc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc(Cl)cc1 CHEMBL4584291 Ki 0.6 nM
CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](/C=C/S(=O)(=O)c1ccccc1)CCc1ccccc1 CHEMBL4083754 Ki 0.61 nM
CC(C)C[C@H](NC(=O)c1cc2ccccc2o1)C(=O)N[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccccn2)CC1=O CHEMBL205172 Ki app 0.63 nM
C[C@@H](OCc1ccccc1)[C@@H](C#N)NC(=O)[C@H](Cc1cccc(Cl)c1)NC(=O)c1cccc(Br)c1 CHEMBL4744431 pKi 0.631 nM
COC1=CC(=O)N(C(=O)/C=C/[C@H](Cc2ccccc2)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)OC(=O)[C@H](C(C)C)N(C)C)[C@H]1CC(C)C CHEMBL4447348 IC50 0.632 nM
CC(C)(C)CNc1nc(C#N)ncc1C(=O)NCCc1cccc(OCCn2ccnc2)c1 CHEMBL384685 IC50 0.68 nM
CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](CC1CCNC1=O)C(O)S(=O)(=O)O CHEMBL2365410 pIC50 0.6918 nM
CC(C)CN(NC(=O)c1ccc(CN2CCN(C)CC2)cc1)c1nc(C#N)ncc1Br CHEMBL1215628 IC50 0.7 nM
C[C@@H](CC1CCCCC1)OC(=O)C1CCN1C#N CHEMBL183812 IC50 0.71 nM
CCC(C)[C@H](NS(=O)(=O)c1cccc2ccccc12)C(=O)N[C@H](C=O)C(C)C CHEMBL341197 IC50 0.74 nM
O=CC(Cc1ccccc1)NC(=O)C(Cc1ccccc1)NC(=O)OCc1ccccc1 CHEMBL115394 IC50 0.74 nM
CC(C)N(C#N)NC(=O)O[C@@H](C)CC1CCCCC1 CHEMBL371420 Ki 0.79 nM
C#CCCCCOC1=CC(=O)N(C(=O)/C=C/[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)OC(=O)[C@H]([C@@H](C)CC)N(C)C)[C@@H]1C CHEMBL4527930 IC50 0.79 nM
CN1CCN(c2cccc(CCNC(=O)c3cnc(C#N)nc3NCC(C)(C)C)c2)CC1 CHEMBL414530 IC50 0.82 nM
CCC(C)[C@H](NS(=O)(=O)c1cccc2ccccc12)C(=O)N[C@H](C=O)Cc1cc2ccccc2[nH]1 CHEMBL197958 Ki app 0.87 nM
CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)N(C)C#N CHEMBL608115 Ki 0.9 nM
CC(C)[C@H](NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2Cl)CN1C(=O)C1(c2ncc(Cl)cc2F)CC1)C(=O)C(=O)NC1CC1 CHEMBL3649418 IC50 0.9 nM
CCC(C)[C@H](NS(=O)(=O)c1cccc2ccccc12)C(=O)N[C@H](C=O)CC(C)C CHEMBL134494 IC50 0.95 nM
CCC(C)[C@H](NS(=O)(=O)c1cccc2ccccc12)C(=O)N[C@H](C=O)Cc1ccccc1 CHEMBL336591 IC50 0.95 nM
CC(C)[C@H](NS(=O)(=O)c1cccc2ccccc12)C(=O)N[C@@H](C=O)Cc1c[nH]c2ccccc12 CHEMBL136252 IC50 0.97 nM
O=C(N[C@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCc1ccccc1)CNc1ccc(N2CCCCC2)cc1)OCc1ccccc1 CHEMBL169560 Ki 1.0 nM
O=C(N[C@H](CC1C=Nc2ccccc21)C(=O)N[C@@H](CCc1ccccc1)CNc1ccc(N2CCCCC2)cc1)OCc1ccccc1 CHEMBL354132 Ki 1.0 nM
O=C(N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCc1ccccc1)CNc1ccc(N2CCCCC2)cc1)OCc1ccccc1 CHEMBL169448 Ki 1.0 nM
CC(C)[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](CCc1ccccc1)CNc1ccc(N2CCCCC2)cc1 CHEMBL171403 Ki 1.0 nM
CCC[C@H](NC(=O)[C@H](CC(C)C)C(=O)OCc1ccccc1)C(=O)c1nnc(-c2ccco2)o1 CHEMBL207347 Ki app 1.0 nM
CCCC[C@H](NC(=O)C(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1)C(=O)c1nnc(-c2ccco2)o1 CHEMBL271004 Ki 1.0 nM
CC1CCC(C[C@H](NC(=O)c2ccco2)C(=O)N[C@H]2CC[C@@H](C)N(S(=O)(=O)c3ccccn3)CC2=O)CC1 CHEMBL1807698 IC50 1.0 nM
COC1=CC(=O)N(C(=O)/C=C/[C@H](Cc2ccccc2)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)OC(=O)[C@H](Cc2ccccc2)N(C)C)[C@@H]1Cc1ccccc1 CHEMBL4582558 IC50 1.0 nM
C[C@@H](OCc1ccccc1)[C@@H](C#N)NC(=O)[C@H](Cc1cccc(Cl)c1)NC(=O)c1cccc(-c2cccnc2)c1 CHEMBL4746374 pKi 1.0 nM
COc1ccc(NCCNC(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)c2cccc(C)c2)cc1 CHEMBL198299 Ki 1.1 nM
N#Cc1ncc(C(=O)NCCc2ccccc2)c(NC2CCCCC2)n1 CHEMBL386506 IC50 1.1 nM
CC(C)C[C@H](NC(=O)NCc1ccc(-c2noc(-c3cccs3)n2)cc1)C(=O)N(C)N(C)C#N CHEMBL1651357 Ki 1.1 nM
COc1ccc(NCCNC(=O)[C@H](Cc2ccc(-c3ccccc3)cc2)NC(=O)c2cccc(C)c2)cc1 CHEMBL198318 Ki 1.2 nM
COc1cccc(CCNC(=O)c2cnc(C#N)nc2NCC(C)(C)C)c1 CHEMBL221707 IC50 1.2 nM
C[C@@H]1CC[C@H](NC(=O)[C@H](CC2CCCCC2)NC(=O)c2ccco2)C(=O)CN1S(=O)(=O)c1ccccn1 CHEMBL1807647 IC50 1.2 nM
N#CC1(NC(=O)[C@@H]2Cc3ccc(c(Cl)c3)OCC#CCOc3c(F)cc(F)cc3C(=O)N2)CC1 CHEMBL4080708 Ki 1.2 nM
N#CC1(NC(=O)[C@@H]2Cc3ccc(c(Cl)c3)OC/C=C/COc3cc4ccccc4cc3C(=O)N2)CC1 CHEMBL4066422 Ki 1.2 nM
CC(C)C[C@H](NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)OC(C)(C)C)C(=O)N[C@H](C=O)C[C@@H]1CCNC1=O CHEMBL5275051 IC50 1.2 nM
Cn1nc(C(C)(C)C)cc1C(=O)N[C@@H](Cc1cccc(-c2nnc(CCN)o2)c1)C(=O)NCC#N CHEMBL555122 pIC50 1.259 nM
Cn1nc(C(C)(C)C)cc1C(=O)N[C@@H](Cc1cccc(Cl)c1)C(=O)NCC#N CHEMBL564131 pKi 1.259 nM
N#C[C@H](COCc1cn(CCC(=O)O)nn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 CHEMBL3804928 Ki 1.27 nM
CSCC[C@@H](C=O)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1 CHEMBL99195 Ki 1.3 nM
COC1=CC(=O)N(C(=O)/C=C/[C@H](Cc2ccccc2)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)OC(=O)[C@H](Cc2ccccc2)N(C)C)[C@H]1Cc1ccccc1 CHEMBL4471760 IC50 1.31 nM
COC1=CC(=O)N(C(=O)/C=C/[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)OC(=O)[C@H](Cc2ccccc2)N(C)C)[C@H]1Cc1ccccc1 CHEMBL4445744 IC50 1.35 nM
CCC(C)[C@H](NS(=O)(=O)c1cccc2ccccc12)C(=O)N[C@H](C=O)Cc1ccc(O)cc1 CHEMBL336415 IC50 1.4 nM
CC(C)C[C@H](NC(=O)c1cccc2ccccc12)C(=O)N[C@H]1CCCN(S(=O)(=O)c2ccccn2)CC1=O CHEMBL382286 Ki app 1.4 nM
COc1ccc(NCCNC(=O)[C@H](Cc2ccc(Cl)cc2)NC(=O)c2cccc(C)c2)cc1 CHEMBL198016 Ki 1.4 nM
Cc1nc(-c2ccc(CNC(=O)N[C@@H](CC(C)C)C(=O)N(C)N(C)C#N)cc2)no1 CHEMBL1651356 Ki 1.4 nM
CCOC(=O)CCSCC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 CHEMBL161817 Ki 1.5 nM
COc1ccc(NCCNC(=O)[C@H](Cc2cccc(Cl)c2)NC(=O)c2cccc(C)c2)cc1 CHEMBL199070 Ki 1.5 nM
CC(C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)N(C)C#N CHEMBL1651242 Ki 1.5 nM
CC(=O)/C=C/[C@H](CCc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc(F)cc1 CHEMBL4475066 Ki 1.5 nM
COc1ccc(NC[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)c2cccc(C)c2)cc1 CHEMBL203328 Ki 1.6 nM
CSc1ccc2c(c1)C(=O)N[C@H](C(=O)NC1(C#N)CC1)Cc1ccc(c(Cl)c1)OC/C=C/CO2 CHEMBL4093018 IC50 1.6 nM
CSc1ccc2c(c1)C(=O)N[C@H](C(=O)NC1(C#N)CC1)Cc1ccc(c(Cl)c1)OCCCCO2 CHEMBL3891991 IC50 1.6 nM
CC(=O)c1c(Nc2ccc(C)cc2Cl)[nH]c2c([N+](=O)[O-])cc(Cl)cc2c1=O CHEMBL521771 IC50 1.66 nM
CC[C@H](C)[C@@H](C(=O)O[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](/C=C/C(=O)N1C(=O)C=C(OC)[C@H]1Cc1ccccc1)Cc1ccccc1)N(C)C CHEMBL4474668 IC50 1.68 nM
CC(C)(C)SCC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 CHEMBL161651 Ki 1.7 nM
O=C(N[C@@H](Cc1ccccc1)C(=O)N[C@H]1CCCN(S(=O)(=O)c2ccccn2)CC1=O)c1cc2ccccc2o1 CHEMBL407633 Ki app 1.7 nM
CN1CCC(Oc2ccc(CCNC(=O)c3cnc(C#N)nc3NCC(C)(C)C)cc2)CC1 CHEMBL449096 IC50 1.7 nM
CC[C@H](NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2Cl)CN1C(=O)C1(c2ccc(Cl)cc2)CC1)C(=O)C(=O)NC1CCOCC1 CHEMBL3649413 IC50 1.7 nM
CC[C@H](C)[C@@H](C(=O)O[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)/C=C/C(=O)N1C(=O)C=C(OC)[C@@H]1CC(C)C)N(C)C CHEMBL4482954 IC50 1.73 nM
CC[C@@H](C)[C@H](NS(=O)(=O)c1cccc2ccccc12)C(=O)N[C@@H](C=O)Cc1c[nH]c2ccccc12 CHEMBL1790993 IC50 1.9 nM
CCC(C)[C@H](NS(=O)(=O)c1cccc2ccccc12)C(=O)N[C@H](C=O)Cc1c[nH]c2ccccc12 CHEMBL115676 IC50 1.9 nM
Cn1nc(C(C)(C)C)cc1C(=O)N[C@@H](Cc1cccc(-c2nnc(CN)o2)c1)C(=O)NCC#N CHEMBL557455 pIC50 1.995 nM
CC(C)C[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](CCc1ccccc1)CNc1ccc(N2CCCCC2)cc1 CHEMBL354439 Ki 2.0 nM
CC[C@@H](C)[C@H](NC(=O)Nc1ccccc1C(F)(F)F)C(=O)N[C@@H](C=O)Cc1c[nH]c2ccccc12 CHEMBL1790991 IC50 2.0 nM
CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](CNc1ccc(N2CCCCC2)cc1)Cc1ccccc1 CHEMBL353725 Ki 2.0 nM
CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](CNc1ccc(N2CCOCC2)cc1)Cc1ccccc1 CHEMBL170242 Ki 2.0 nM
CC[C@@H](C)[C@H](NC(=O)Nc1cccc2ccccc12)C(=O)N[C@@H](C=O)Cc1c[nH]c2ccccc12 CHEMBL1790989 IC50 2.0 nM
COc1cccc(C(=O)N[C@@H](CCC2CCCCC2)C(=O)N[C@H](CN2CCc3cc(F)ccc32)[C@@H](C)OCc2ccccc2)c1 CHEMBL206057 Ki 2.0 nM
Cc1nc(-c2ccc(NC(=O)N[C@@H](CC(C)C)C(=O)N(C)N(C)C#N)cc2)no1 CHEMBL1651349 Ki 2.0 nM
CC[C@H](NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2Cl)CN1C(=O)C1(c2ccc(Cl)cc2)CC1)C(=O)C(=O)NCCc1ccccc1 CHEMBL3649410 IC50 2.0 nM
CC[C@@H](C)[C@H](NC(=O)c1ccccc1)C(=O)N[C@@H](C=O)Cc1c[nH]c2ccccc12 CHEMBL1790996 IC50 2.1 nM
CC[C@@H](C)[C@H](/N=C(\S)NCc1ccccc1)C(=O)N[C@@H](C=O)Cc1c[nH]c2ccccc12 CHEMBL1790995 IC50 2.2 nM
CC[C@@H](C)[C@H](/N=C(\S)Nc1ccccc1)C(=O)N[C@@H](C=O)Cc1c[nH]c2ccccc12 CHEMBL1791000 IC50 2.2 nM
CC[C@@H](C)[C@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)N[C@@H](C=O)Cc1c[nH]c2ccccc12 CHEMBL1790999 IC50 2.2 nM
CC(C)C[C@H](NS(=O)(=O)c1cccc2ccccc12)C(=O)N[C@@H](C=O)Cc1c[nH]c2ccccc12 CHEMBL341577 IC50 2.2 nM
CC(C)C[C@H](NC(=O)c1cc2ccccc2o1)C(=O)N[C@H]1CCCN(S(=O)(=O)c2ccccn2)CC1=O CHEMBL286364 Ki 2.2 nM
CC(=O)/C=C/[C@H](CCc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccc([N+](=O)[O-])cc1 CHEMBL4062015 Ki 2.2 nM
CC(C)(C)c1cc2nn1CC/C=C/COc1ccc(cc1Cl)C[C@@H](C(=O)NC1(C#N)CC1)NC2=O CHEMBL4099651 Ki 2.3 nM
CC(C)C[C@H](NC(=O)[C@H]1O[C@@H]1C(=O)O)C(=O)NCCCCN=C(N)N CHEMBL374508 IC50 2.3 nM
N#CC1(NC(=O)[C@@H]2Cc3ccc(c(Cl)c3)OC/C=C/COc3cc(C(F)(F)F)ccc3C(=O)N2)CC1 CHEMBL4071237 Ki 2.4 nM
CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C=O)CCCNC(=N)N CHEMBL191881 IC50 2.5 nM
N#CC1(NC(=O)[C@@H]2Cc3ccc(c(Cl)c3)OC/C=C/CCn3nc(cc3C3CC3)C(=O)N2)CC1 CHEMBL4064172 Ki 2.5 nM
CC(C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC(C=O)Cc1ccccc1 CHEMBL423112 IC50 2.5 nM
CC(C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](C=O)Cc1ccccc1 CHEMBL286722 IC50 2.5 nM
O=C(N[C@@H](Cc1ccccc1)C(=O)N[C@@H]1C(=O)N[C@@H]1Oc1ccccc1)OCc1ccccc1 CHEMBL30401 IC50 2.6 nM
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)N(C)C#N CHEMBL1651351 Ki 2.6 nM
CC[C@H](NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2Cl)CN1C(=O)C1(c2ccc(Cl)cc2)CC1)C(=O)C(=O)NCCOC CHEMBL3649414 IC50 2.6 nM
CC[C@H](NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2Cl)CN1C(=O)C1(c2ccc(Cl)cc2)CC1)C(=O)C(=O)NCC(C)C CHEMBL3649415 IC50 2.6 nM
O=C(N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)CSCCCc1ccccc1)OCc1ccccc1 CHEMBL103238 Ki 2.8 nM
COc1ccc(NCCNC(=O)[C@H](Cc2ccc(C(F)(F)F)cc2)NC(=O)c2cccc(C)c2)cc1 CHEMBL195999 Ki 2.8 nM
COC1=CC(=O)N(C(=O)/C=C/[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)C2CCN(C)CC2)[C@H]1Cc1c[nH]c2ccccc12 CHEMBL4594757 Ki(app) 2.88 nM
C[C@@H](C=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 CHEMBL122591 IC50 3.0 nM
N#CC1(NC(=O)[C@@H]2C[C@@H](S(=O)(=O)c3ccccc3F)CN2C(=O)C2(c3ncc(I)cc3F)CC2)CC1 CHEMBL4112088 IC50 3.0 nM
N#CC1(NC(=O)[C@@H]2Cc3ccc(c(Cl)c3)OCCCCOc3cc4c(cc3C(=O)N2)CCCC4)CC1 CHEMBL3987059 Ki 3.0 nM
CC(C)C[C@@H](NC(=O)N1CCOCC1)C(=O)N[C@@H](/C=C/S(=O)(=O)c1ccccc1)CCc1ccccc1 CHEMBL222649 IC50 3.0 nM
CCC(C)[C@H](NS(=O)(=O)c1cccc2ccccc12)C(=O)N[C@@H](C)C=O CHEMBL334443 IC50 3.1 nM
N#CC1(NC(=O)[C@@H]2Cc3ccc(c(Cl)c3)OCCCCOc3ccc(C4CNC4)cc3C(=O)N2)CC1 CHEMBL3927619 IC50 3.1 nM
COC1=CC(=O)N(C(=O)/C=C/[C@H](C)NC(=O)[C@H](CCc2ccccc2)NC(=O)[C@H](CC2CCCCC2)NC(=O)[C@H](C(C)C)N(C)C)[C@H]1Cc1c[nH]c2ccccc12 CHEMBL4598338 Ki(app) 3.1 nM
CC[C@H](C)[C@@H](C(=O)O[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](/C=C/C(=O)N1C(=O)C=C(OC)[C@@H]1Cc1ccccc1)Cc1ccccc1)N(C)C CHEMBL4527867 IC50 3.13 nM
Cn1cc(-c2ccc(S(=O)(=O)[C@@H]3C[C@@H](C(=O)NC4(C#N)CC4)N(C(=O)C4(c5ncc(I)cc5F)CC4)C3)c(Cl)c2)cn1 CHEMBL4106618 IC50 3.2 nM
CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](C=O)Cc1c[nH]c2ccccc12 CHEMBL1791001 IC50 3.3 nM
CC[C@@H](C)[C@H](NC(=O)Nc1cccc(C)c1)C(=O)N[C@@H](C=O)Cc1c[nH]c2ccccc12 CHEMBL1790997 IC50 3.3 nM
COc1ccc(NCCNC(=O)[C@H](Cc2ccc(C)cc2)NC(=O)c2cccc(C)c2)cc1 CHEMBL436756 Ki 3.4 nM
CC(=O)/C=C/[C@H](CCc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccc([N+](=O)[O-])cc1 CHEMBL4096388 Ki 3.5 nM
CC[C@H](C)[C@@H](C(=O)O[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](/C=C/C(=O)N1C(=O)C=C(OC)[C@@H]1C)Cc1ccccc1)N(C)C CHEMBL4527329 IC50 3.53 nM
COC1=CC(=O)N(C(=O)/C=C/[C@H](Cc2ccccc2)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)OC(=O)[C@H](Cc2ccccc2)N(C)C)[C@H]1C CHEMBL4475810 IC50 3.54 nM
NC(=S)N/N=C(/c1cc(Cl)cc(Cl)c1)c1cccs1 CHEMBL259379 IC50 3.6 nM
COc1ccc(NCCNC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccc(C)c2)cc1 CHEMBL380989 Ki 3.7 nM
NC(=S)N/N=C(\c1cccc(O)c1)c1cccc(Br)c1 CHEMBL1269632 Ki(app) 3.7 nM
CS(=O)(=O)c1ccc2c(c1)C(=O)N[C@H](C(=O)NC1(C#N)CC1)Cc1ccc(c(Cl)c1)OC/C=C/CO2 CHEMBL4087751 Ki 3.7 nM
C[C@@H]1CC[C@H](NC(=O)[C@H](CC2=CCCC2)NC(=O)c2ccco2)C(=O)CN1S(=O)(=O)c1ccccn1 CHEMBL1807645 IC50 3.8 nM
CC[C@@H](C)[C@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)N[C@@H](C=O)Cc1c[nH]c2ccccc12 CHEMBL1791004 IC50 3.9 nM
CC(C)C[C@H](NC(=O)c1cc2ccccc2o1)C(=O)N[C@@H]1CC[C@H](C)N(S(=O)(=O)c2ccccn2)CC1=O CHEMBL202991 Ki app 3.9 nM
CN1CCN(c2ccc(CCNC(=O)c3cnc(C#N)nc3NCC(C)(C)C)cc2)CC1 CHEMBL220760 IC50 3.9 nM
COCc1nnc(-c2cccc(C[C@H](NC(=O)c3cc(C(C)(C)C)nn3C)C(=O)NCC#N)c2)o1 CHEMBL554065 pIC50 3.981 nM
Cn1nc(C(C)(C)C)cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC#N CHEMBL4752430 pKi 3.981 nM
CS(=O)(=O)CC[C@@H](CNc1ccc(OC(F)(F)F)cc1)NC(=O)[C@H](CC1CCCCC1)NC(=O)N1CCOCC1 CHEMBL379079 Ki 4.0 nM
CC(C)n1ncc(C(=O)N[C@@H](Cc2ccc(OC(F)(F)F)c(Cl)c2)C(=O)NC2(C#N)CC2)n1 CHEMBL4065829 Ki 4.0 nM
CC(C)C[C@H](NC(=O)c1ccc(CN2CCN(C)CC2)cc1)C(=O)NC1(C#N)CCS(=O)(=O)CC1 CHEMBL4228143 IC50 4.0 nM
CC(=O)/C=C/[C@H](CCc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc(C(F)(F)F)cc1 CHEMBL4587965 Ki 4.1 nM
CC[C@H](C)[C@@H](C(=O)O[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)/C=C/C(=O)N1C(=O)C=C(OC)[C@@H]1Cc1ccccc1)N(C)C CHEMBL4564747 IC50 4.15 nM
CC(C)C[C@H](NC(=O)c1cc2ccccc2o1)C(=O)N[C@@H]1C(=O)CN(S(=O)(=O)c2ccccn2)CC[C@H]1C CHEMBL203845 Ki app 4.2 nM
COC(=O)C[C@H](NS(=O)(=O)c1cccc2ccccc12)C(=O)N[C@@H](C=O)Cc1c[nH]c2ccccc12 CHEMBL132595 IC50 4.3 nM
N#CC1(NC(=O)[C@@H]2C[C@@H](S(=O)(=O)c3ccccc3Cl)CN2C(=O)C2(c3ccc(I)cc3F)CC2)CC1 CHEMBL2335184 IC50 4.3 nM
CC[C@H](NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2Cl)CN1C(=O)C1(c2ccc(Cl)cc2)CC1)C(=O)C(=O)NC1CC1 CHEMBL3649369 IC50 4.3 nM
N#CC1(NC(=O)[C@@H]2Cc3ccc(c(Cl)c3)OC/C=C/COc3ccc(F)c(F)c3C(=O)N2)CC1 CHEMBL4112101 IC50 4.3 nM
CC(C)C[C@H](NC(=O)Nc1ccc(-c2noc(-c3cccs3)n2)cc1)C(=O)N(C)N(C)C#N CHEMBL1651350 Ki 4.4 nM
O=C[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)c1cccc2ccccc12 CHEMBL334405 IC50 4.5 nM
CC[C@@H](C)[C@H](/N=C(\S)Nc1cccc2ccccc12)C(=O)N[C@@H](C=O)Cc1c[nH]c2ccccc12 CHEMBL1790994 IC50 4.5 nM
CC(C)C[C@H](NC(=O)c1cc2ccccc2o1)C(=O)N[C@@H]1CC[C@@H](C)N(S(=O)(=O)c2ccccn2)CC1=O CHEMBL203224 Ki app 4.5 nM
COc1ccc(NCCNC(=O)[C@H](CC2CCCCC2)NC(=O)c2cccc(C)c2)cc1 CHEMBL199242 Ki 4.6 nM
N#CC1(NC(=O)[C@@H]2C[C@@H](S(=O)(=O)c3ccccc3Cl)CN2C(=O)C2(c3ncc(Br)cc3F)CNC2)CC1 CHEMBL3671334 IC50 4.6 nM
CS(=O)(=O)c1ccc2c(c1)C(=O)N[C@H](C(=O)NC1(C#N)CC1)Cc1ccc(c(Cl)c1)OC[C@H]1O[C@@H]1CO2 CHEMBL4065847 Ki 4.6 nM
CC[C@H](C)[C@@H](C(=O)O[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)/C=C/C(=O)N1C(=O)C=C(OC)[C@@H]1C)N(C)C CHEMBL541700 IC50 4.67 nM
CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)CSCCCc1ccccc1 CHEMBL162474 Ki 4.7 nM
CCC[C@H](NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2Cl)CN1C(=O)C1(c2ccc(Cl)cc2)CC1)C(=O)C(=O)NC1CC1 CHEMBL3649370 IC50 4.7 nM
C[C@@H]1CC[C@H](NC(=O)[C@H](CC2CCCC2)NC(=O)c2ccco2)C(=O)CN1S(=O)(=O)c1ccccn1 CHEMBL1807646 IC50 4.8 nM
CC(C)C[C@H](NC(=O)c1ccc2ccccc2n1)C(=O)N[C@H]1CCCN(S(=O)(=O)c2ccccn2)CC1=O CHEMBL433985 Ki app 5.0 nM
COc1ccc(NCCNC(=O)[C@H](Cc2ccccc2Cl)NC(=O)c2cccc(C)c2)cc1 CHEMBL370764 Ki 5.0 nM
COc1cccc(C(=O)N[C@@H](CCC2CCCCC2)C(=O)N[C@@H](CCN2CCOCC2)CN2CCc3cc(F)ccc32)c1 CHEMBL203052 Ki 5.0 nM
C[C@H](Oc1ccc(S(=O)(=O)[C@@H]2C[C@@H](C(=O)NC3(C#N)CC3)N(C(=O)C3(c4ncc(Br)cc4F)CN(CC(F)F)C3)C2)c(Cl)c1)C(F)(F)F CHEMBL3671358 IC50 5.0 nM
C[C@H](Oc1ccc(S(=O)(=O)[C@@H]2C[C@@H](C(=O)NC3(C#N)CC3)N(C(=O)C3(c4ncc(Br)cc4F)CN(C=O)C3)C2)c(Cl)c1)C(F)(F)F CHEMBL3671359 IC50 5.0 nM
CSCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)CNC(C)=O)C(=O)NNC(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C)C(=O)N[C@H](CCCNC(=N)N)C(N)=O CHEMBL4238973 Ki 5.0 nM
CSCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(C)=O)C(=O)NNC(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C)C(=O)N[C@H](CCCNC(=N)N)C(N)=O CHEMBL4292287 Ki 5.0 nM
Cn1nc(C(C)(C)C)cc1C(=O)N[C@@H](Cc1cccc(-c2nncs2)c1)C(=O)NCC#N CHEMBL549378 pIC50 5.012 nM
Cc1nnc(-c2cccc(C[C@H](NC(=O)c3cc(C(C)(C)C)nn3C)C(=O)NCC#N)c2)o1 CHEMBL550872 pIC50 5.012 nM
CC(C)C[C@H](N[C@@H](c1ccccc1)C(F)(F)F)C(=O)N[C@H](C#N)Cc1ccccc1 CHEMBL4451757 pKi 5.012 nM
Cn1nc(C(C)(C)C)cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)NC1(C#N)CC1 CHEMBL4776795 pKi 5.012 nM
CC(C)C[C@H](NC(=O)C1(c2ccccc2)CCC1)C(=O)NC1(C#N)CC1 CHEMBL4760625 pKi 5.012 nM
CC(C)C[C@H](NC(=O)C1(c2ccccc2)CC1)C(=O)NC1(C#N)CC1 CHEMBL4792408 pKi 5.012 nM
N#Cc1ncc(C(=O)NCCc2ccc(N3CCCC3)cc2)c(NC2CCCCC2)n1 CHEMBL217930 IC50 5.1 nM
CC(C)[C@H](NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2Cl)CN1C(=O)C1(c2ccc(Cl)cc2)CC1)C(=O)C(=O)NC1CC1 CHEMBL3649389 IC50 5.2 nM
N#CC1(NC(=O)[C@@H]2Cc3ccc(c(Cl)c3)OC/C=C/COc3ccc(C4CNC4)cc3C(=O)N2)CC1 CHEMBL4107237 IC50 5.2 nM
C[C@H](NS(=O)(=O)c1cccc2ccccc12)C(=O)N[C@@H](C=O)Cc1c[nH]c2ccccc12 CHEMBL342189 IC50 5.3 nM
CC(=O)/C=C/[C@H](CCc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1F CHEMBL4515298 Ki 5.3 nM
N#CC1(NC(=O)[C@@H]2Cc3ccc(c(I)c3)OC/C=C/COc3cc(C(F)(F)F)ccc3C(=O)N2)CC1 CHEMBL4098931 Ki 5.6 nM
N#CC1(NC(=O)[C@@H]2Cc3ccc(c(I)c3)OCCCCOc3cc(C(F)(F)F)ccc3C(=O)N2)CC1 CHEMBL4091192 Ki 5.8 nM
CCC[C@H](NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2Cl)CN1C(=O)C1(c2ccc(Br)cc2)CC1)C(=O)C(=O)NC1CC1 CHEMBL3649377 IC50 5.9 nM
N#CN1CC(CNC(=O)C2CCCCC2)C1 CHEMBL8796 IC50 6.0 nM
Cc1cccc(C[C@H](NC(=O)C(c2ccccc2)c2ccccc2)C(=O)NCC#N)c1 CHEMBL140756 IC50 6.0 nM
CC[C@@H](CNc1ccc(OC(F)(F)F)cc1)NC(=O)[C@H](CC1CCCCC1)NC(=O)N1CCOCC1 CHEMBL212703 Ki 6.0 nM
CCC[C@H](NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2Cl)CN1C(=O)C1(c2ncc(Cl)cc2F)CC1)C(=O)C(=O)NCc1ccccc1 CHEMBL3649422 IC50 6.0 nM
C[C@H](Oc1ccc(S(=O)(=O)[C@@H]2C[C@@H](C(=O)NC3(C#N)CC3)N(C(=O)C3(c4ncc(Br)cc4F)CN(CC(F)(F)F)C3)C2)c(Cl)c1)C(F)(F)F CHEMBL3671361 IC50 6.0 nM
CC[C@@H](C)[C@H](NC(=O)NCc1ccccc1)C(=O)N[C@@H](C=O)Cc1c[nH]c2ccccc12 CHEMBL1790990 IC50 6.1 nM
CCCCNC(=O)C(=O)[C@H](CC)NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2Cl)CN1C(=O)C1(c2ncc(Cl)cc2F)CC1 CHEMBL3649420 IC50 6.1 nM
CCCCNC(=O)C(=O)[C@H](CCC)NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2Cl)CN1C(=O)C1(c2ncc(Cl)cc2F)CC1 CHEMBL3649421 IC50 6.2 nM
Cn1nc(C(C)(C)C)cc1C(=O)N[C@@H](Cc1cccc(-c2nnc(CO)o2)c1)C(=O)NCC#N CHEMBL549791 pIC50 6.31 nM
CC(C)C[C@H](NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2Cl)CN1C(=O)C1(c2ncc(Cl)cc2F)CC1)C(=O)C(=O)NC1CC1 CHEMBL3649419 IC50 6.4 nM
N#CC1(NC(=O)[C@@H]2C[C@@H](S(=O)(=O)c3ccccc3Cl)CN2C(=O)C2(c3ccc(Br)cc3F)CC2)CC1 CHEMBL2335183 IC50 6.5 nM
N#CC1(NC(=O)[C@@H]2C[C@@H](S(=O)(=O)c3ccccc3Cl)CN2C(=O)C2(c3ccc(I)cc3)CC2)CC1 CHEMBL2335181 IC50 6.5 nM
COC1=CC(=O)N(C(=O)/C=C/[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)OC(=O)[C@H](C(C)C)N(C)C)[C@H]1C CHEMBL4457500 IC50 6.64 nM
N#Cc1ccc2c(c1)C(=O)N[C@H](C(=O)NC1(C#N)CC1)Cc1ccc(c(Cl)c1)OC/C=C/CO2 CHEMBL4108364 IC50 6.9 nM
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)OCC(=O)N1CCCc2ccccc21 CHEMBL263634 IC50 6.9 nM
CC(C)C[C@H](CC(=O)NO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C=O)CC(C)C CHEMBL124623 IC50 7.0 nM
COc1ccc(NCCNC(=O)[C@H](CC(C)C)NC(=O)c2cccc(C)c2)cc1 CHEMBL64765 Ki 7.0 nM
COC(=O)N1CC(C(=O)N2C[C@H](S(=O)(=O)c3ccc(O[C@@H](C)C(F)(F)F)cc3Cl)C[C@H]2C(=O)NC2(C#N)CC2)(c2ncc(Br)cc2F)C1 CHEMBL3671360 IC50 7.0 nM
N#CC1(NC(=O)[C@H](Cc2ccc(Cl)c(Cl)c2)NC(=O)c2cnn(C3CCC3)n2)CC1 CHEMBL4101430 Ki 7.0 nM
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](C=O)Cc1c[nH]c2ccccc12 CHEMBL1790998 IC50 7.1 nM
COc1ccc(NCCNC(=O)[C@H](Cc2cc3ccccc3[nH]2)NC(=O)c2cccc(C)c2)cc1 CHEMBL435116 Ki 7.2 nM
N#CC1(NC(=O)[C@@H]2Cc3ccc(c(Cl)c3)OC/C=C/COc3cc(-c4ccc(Cl)nc4)ccc3C(=O)N2)CC1 CHEMBL4062591 Ki 7.3 nM
Cc1ccc(/C(=N\NC(N)=S)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1 CHEMBL261657 IC50 7.4 nM
N#CC1(NC(=O)[C@@H]2Cc3ccc(c(Cl)c3)OC/C=C/COc3cc(-c4cnn(C(F)F)c4)ccc3C(=O)N2)CC1 CHEMBL4084294 Ki 7.4 nM
CCCCNC(=O)C(=O)[C@H](CCC)NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2Cl)CN1C(=O)C1(c2ccc(Cl)cc2)CC1 CHEMBL3649393 IC50 7.7 nM
CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)CSC(C)(C)C CHEMBL160000 Ki 7.9 nM
CC(C)C[C@H](NC(=O)c1cc2ccccc2o1)C(=O)N[C@H]1CC[C@H](C)N(S(=O)(=O)c2ccccn2)CC1=O CHEMBL377713 Ki app 7.9 nM
C[C@@H](OCc1ccccc1)[C@@H](C#N)NC(=O)[C@H](Cc1cccc(Cl)c1)NC(=O)c1cc(C(C)(C)C)nn1C CHEMBL4751229 pKi 7.943 nM
C[C@@H](OCc1ccccc1)[C@@H](C#N)NC(=O)[C@H](Cc1cccc(Cl)c1)NC(=O)c1ccc(Br)cc1 CHEMBL4757831 pKi 7.943 nM
CC(C)(C)n1ncc(C(=O)N[C@@H](Cc2ccc(OC(F)(F)F)c(Cl)c2)C(=O)NC2(C#N)CC2)n1 CHEMBL4065483 Ki 8.0 nM
NC(=S)N/N=C(\c1cc(Br)cc(C(=O)c2ccccc2F)c1)c1ccccc1F CHEMBL3629203 IC50 8.12 nM
NC(=S)N/N=C(/c1cc(Br)cc(C(=O)c2ccccc2F)c1)c1ccccc1F CHEMBL3699008 IC50 8.12 nM
CC(C)C[C@H](NC(=O)c1cccc2cccnc12)C(=O)N[C@H]1CCCN(S(=O)(=O)c2ccccn2)CC1=O CHEMBL196023 Ki app 8.2 nM
CC[C@H](NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2Cl)CN1C(=O)C1(c2ccc(Br)cc2)CC1)C(=O)C(=O)NC1CC1 CHEMBL3649376 IC50 8.2 nM
CCC[C@H](NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2Cl)CN1C(=O)C1(c2ccc(I)cc2)CC1)C(=O)C(=O)NC1CC1 CHEMBL3649379 IC50 8.4 nM
NC(=S)N/N=C(\c1cccc(O)c1)c1cc(Br)cc(Br)c1 CHEMBL4087627 Ki(app) 8.4 nM
CC[C@H](NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2Cl)CN1C(=O)C1(c2ccc(Cl)cc2)CC1)C(=O)C(=O)NCCc1cccc2ccccc12 CHEMBL3649411 IC50 8.6 nM
O=C(N[C@H](CCc1ccccc1)C(=O)N[C@@H](CCc1ccccc1)CNc1ccc(N2CCCCC2)cc1)OCc1ccccc1 CHEMBL169708 Ki 9.0 nM
N#CC1(NC(=O)[C@@H]2Cc3ccc(c(Cl)c3)OC/C=C/COc3ccc(C(F)(F)F)cc3C(=O)N2)CC1 CHEMBL4109426 IC50 9.0 nM
N#CC1(NC(=O)[C@@H]2Cc3ccc(c(Cl)c3)OCCCCOc3ccc(C(F)(F)F)cc3C(=O)N2)CC1 CHEMBL3927728 IC50 9.0 nM
N#CC1(NC(=O)[C@@H]2Cc3ccc(c(Cl)c3)OC/C=C/COc3c(F)cc(F)cc3C(=O)N2)CC1 CHEMBL4086987 IC50 9.2 nM
COc1ccc(C[C@H](NC(=O)c2cccc(C)c2)C(=O)NCCNc2ccc(OC)cc2)cc1 CHEMBL425379 Ki 9.3 nM
Cc1ccc(/C(=N/NC(N)=S)c2cccc(C(F)(F)F)c2)cc1 CHEMBL407264 IC50 9.4 nM
CCC[C@H](NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccc(F)cc2Cl)CN1C(=O)C1(c2ccc(Cl)cc2)CC1)C(=O)C(=O)NC1CC1 CHEMBL3649409 IC50 9.4 nM
CC[C@H](NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2Cl)CN1C(=O)C1(c2ccc(Cl)cc2)CC1)C(=O)C(=O)NCc1cccc2ccccc12 CHEMBL3649412 IC50 9.4 nM
CC(C)(C)SCC(=O)[C@H](CCc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1cccnc1 CHEMBL161038 Ki 9.6 nM
N#CC1(NC(=O)[C@@H]2Cc3ccc(c(Cl)c3)OC/C=C/CCc3ccccc3C(=O)N2)CC1 CHEMBL4114537 IC50 9.6 nM
CCC[C@H](NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2Cl)CN1C(=O)C1(c2ccc(Cl)cc2)CC1)C(=O)C(=O)NCc1ccccc1 CHEMBL3649396 IC50 9.8 nM
CC[C@H](NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2Cl)CN1C(=O)C1(c2ncc(Cl)cc2F)CC1)C(=O)C(=O)NC1CC1 CHEMBL3649386 IC50 9.8 nM
Cc1ncccc1-c1ccc(S(=O)(=O)[C@@H]2C[C@@H](C(=O)NC3(C#N)CC3)N(C(=O)C3(c4ncc(I)cc4F)CC3)C2)c(Cl)c1 CHEMBL4113661 IC50 9.8 nM
NC(=S)N/N=C(\c1ccccc1)c1cccc(C(=O)c2ccccc2)c1 CHEMBL3629191 IC50 9.85 nM
CC(C)C[C@H](NC(=O)c1cc2ccccc2o1)C(=O)N[C@@H]1C[C@H](C)CN(S(=O)(=O)c2ccccn2)CC1=O CHEMBL440574 Ki app 10.0 nM
CCC[C@H](NC(=O)C(CC(C)C)NC(=O)c1ccc(-c2ccc(I)cc2)cc1)C(=O)C=[N+]=[N-] CHEMBL518284 IC50 10.0 nM
CN1CCC(CCOc2nc(C#N)nc(NCC3CCC4(CC3)CC4)c2C(=O)NCCc2ccccc2)CC1 CHEMBL526384 IC50 10.0 nM
CC(C)C[C@H](NC(=O)c1ccco1)C(=O)N[C@H]1CC[C@@H](C)N(C(=O)c2ccccn2)CC1=O CHEMBL1807704 IC50 10.0 nM
N#CC1(NC(=O)[C@@H]2Cc3ccc(c(Cl)c3)OCCCCOc3ccc(Br)cc3C(=O)N2)CC1 CHEMBL3914960 IC50 10.0 nM
N#CC1(NC(=O)[C@@H]2Cc3ccc(c(Cl)c3)OC/C=C/CNc3ccc(Br)cc3C(=O)N2)CC1 CHEMBL4110269 IC50 10.0 nM
N#CC1(NC(=O)[C@@H]2Cc3ccc(c(Cl)c3)OCCCCOc3cc(C(F)(F)F)ccc3C(=O)N2)CC1 CHEMBL3917415 Ki 10.0 nM
CCOC(=O)/C=C/C(=O)[C@@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 CHEMBL4238441 IC50 10.0 nM
CCOC(=O)/C=C/C(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 CHEMBL4244656 IC50 10.0 nM
N#CCNC(=O)[C@H](Cc1ccccc1)NC(=O)c1cncc(Br)c1 CHEMBL4792949 pKi 10.0 nM
NC(=S)N/N=C(/c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cccs1 CHEMBL260921 IC50 10.1 nM
CC[C@H](NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2Cl)CN1C(=O)C1(c2ccc(I)cc2)CC1)C(=O)C(=O)NC1CC1 CHEMBL3649378 IC50 10.1 nM
CC(=O)/C=C/[C@H](CCc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc2c(c1)OCO2 CHEMBL4437914 Ki 10.2 nM
N#CC1(NC(=O)[C@@H]2Cc3ccc(c(Cl)c3)OC/C=C/COc3ccc(Cl)cc3C(=O)N2)CC1 CHEMBL4108512 IC50 10.3 nM
CC[C@H](NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2Cl)CN1C(=O)C1(c2ccc(Br)cc2F)CC1)C(=O)C(=O)NC1CC1 CHEMBL3649375 IC50 10.4 nM
COc1ccc2c(c1)C(=O)N[C@H](C(=O)NC1(C#N)CC1)Cc1ccc(c(Cl)c1)OCCCCO2 CHEMBL3898304 IC50 10.4 nM
CN(/N=C(/c1ccccc1)c1cccc(C(=O)c2ccccc2)c1)C(N)=S CHEMBL3699007 IC50 10.5 nM
CC[C@H](NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccc(Cl)cc2Cl)CN1C(=O)C1(c2ccc(Cl)cc2)CC1)C(=O)C(=O)NC1CC1 CHEMBL3649399 IC50 10.6 nM
C[C@@H]1CC[C@H](NC(=O)[C@H](CCC2CCCC2)NC(=O)c2ccco2)C(=O)CN1S(=O)(=O)c1ccccn1 CHEMBL1807697 IC50 10.7 nM
C[C@@H]1CC[C@H](NC(=O)[C@H](CCC2CCCC2)NC(=O)N2CCOCC2)C(=O)CN1S(=O)(=O)c1ccccn1 CHEMBL1807700 IC50 10.8 nM
CCC[C@H](NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2Cl)CN1C(=O)C1(c2ncc(Cl)cc2F)CC1)C(=O)C(=O)NC1CC1 CHEMBL3649385 IC50 10.8 nM
Cc1cccc(C(=O)N[C@@H](CC(C)C)C(=O)NCCN2CCc3cc(F)ccc32)c1 CHEMBL203480 Ki 11.0 nM
Cc1ccc(/C(=N\NC(N)=S)c2cc(Cl)cc(Cl)c2)cc1 CHEMBL261438 IC50 11.0 nM
C[C@@H](/C=C/[N+](=O)[O-])NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 CHEMBL3907022 Ki 11.0 nM
N#CC1(NC(=O)[C@@H]2Cc3ccc(c(I)c3)OC/C=C/COc3ccc(Cl)cc3C(=O)N2)CC1 CHEMBL4110586 IC50 11.0 nM
N#CC1(NC(=O)[C@H](Cc2ccc(OC(F)(F)F)c(Cl)c2)NC(=O)c2cnn(C3CCC3)n2)CC1 CHEMBL4093144 Ki 11.0 nM
CCCCNC(=O)C(=O)[C@H](CC)NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2Cl)CN1C(=O)C1(c2ccc(Cl)cc2)CC1 CHEMBL3649392 IC50 11.2 nM
CC[C@H](NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2Cl)CN1C(=O)C1(c2ccc(Cl)cc2F)CC1)C(=O)C(=O)NC1CC1 CHEMBL3649374 IC50 11.3 nM
CC[C@H](NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccc(F)cc2Cl)CN1C(=O)C1(c2ccc(Cl)cc2)CC1)C(=O)C(=O)NC1CC1 CHEMBL3649400 IC50 11.4 nM
COc1ccc2c(c1)C(=O)N[C@H](C(=O)NC1(C#N)CC1)Cc1ccc(c(Cl)c1)OC/C=C/CO2 CHEMBL4109365 IC50 11.4 nM
C[C@@H]1CC[C@H](NC(=O)[C@H](CC(C)(C)C)NC(=O)c2ccco2)C(=O)CN1S(=O)(=O)c1ccccn1 CHEMBL1807650 IC50 11.5 nM
N#CC1(NC(=O)[C@@H]2Cc3ccc(c(Cl)c3)OCCCCOc3ccc(Cl)cc3C(=O)N2)CC1 CHEMBL3903780 IC50 11.6 nM
CCC[C@H](NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccc(Cl)cc2Cl)CN1C(=O)C1(c2ccc(Cl)cc2)CC1)C(=O)C(=O)NC1CC1 CHEMBL3649403 IC50 11.7 nM
CCC[C@H](NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2Cl)CN1C(=O)C1(c2ccc(Cl)cc2)CC1)C(=O)C(=O)NC(C)C CHEMBL3649402 IC50 11.7 nM
COC1=CC(=O)N(C(=O)/C=C/[C@H](CCc2ccccc2)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C(C)C)N(C)C)[C@H]1Cc1c[nH]c2ccccc12 CHEMBL4596647 Ki(app) 11.8 nM
COc1ccc(S(=O)(=O)[C@@H]2C[C@@H](C(=O)NC3(C#N)CC3)N(C(=O)C3(c4ncc(Cl)cc4F)CC3)C2)c(Cl)c1 CHEMBL4114586 IC50 11.9 nM
CCCC(NC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)c1cnccn1)C(C)C)C(C)C)C(=O)C(=O)NC1CC1 CHEMBL264623 Ki 12.0 nM
CCCC[C@@H](/C=N/NC(=O)N1CCOCC1)NC(=O)O[C@H](Cc1ccccc1)C(C)C CHEMBL203663 IC50 12.0 nM
CCCC[C@@H](C=O)NC(=O)O[C@H](Cc1ccccc1)C(C)C CHEMBL113948 IC50 12.0 nM
N#CC1(NC(=O)[C@@H]2C[C@@H](S(=O)(=O)c3ccccc3Cl)CN2C(=O)C2(c3ccc(Br)cc3)CC2)CC1 CHEMBL2335180 IC50 12.0 nM
N#CC1(NC(=O)[C@@H]2Cc3ccc(c(I)c3)OCCCCOc3ccc(Cl)cc3C(=O)N2)CC1 CHEMBL3932399 IC50 12.0 nM
N#Cc1ncc(F)c(N(Cc2ccc3c(c2)OCO3)CC2CCCC2)n1 CHEMBL4061626 Ki 12.0 nM
CN1CC(C(=O)N2C[C@H](S(=O)(=O)c3ccccc3Cl)C[C@H]2C(=O)NC2(C#N)CC2)(c2ncc(Br)cc2F)C1 CHEMBL3671335 IC50 12.5 nM
Cc1cccc(C[C@H](NC(=O)c2cc(C(C)(C)C)nn2C)C(=O)NCC#N)c1 CHEMBL565079 pIC50 12.59 nM
CC(C)C[C@H](NC(=O)c1cc(C(C)(C)C)nn1C)C(=O)NC1(C#N)CC1 CHEMBL4761511 pKi 12.59 nM
N#CC1(NC(=O)[C@@H]2C[C@@H](S(=O)(=O)c3ccccc3Cl)CN2C(=O)C2(c3ncc(Cl)cc3F)CC2)CC1 CHEMBL4109015 IC50 12.9 nM
COc1ccc(NCCNC(=O)[C@H](CC2CCCCC2)NC(=O)c2ccc3ccccc3c2)cc1 CHEMBL264519 Ki 13.0 nM
CC(C)C[C@H](N[C@@H](c1ccc(Br)cc1)C(F)(F)F)C(=O)NCC#N CHEMBL204277 IC50 13.0 nM
CC[C@H](NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2Cl)CN1C(=O)C1(c2ccc(Cl)cc2)CC1)C(=O)C(=O)NCCc1ccc2ccccc2c1 CHEMBL3639482 IC50 13.0 nM
N#Cc1nc(N2CCOCC2)nc(N(Cc2ccc(Cl)cc2)C2CCCCC2)n1 CHEMBL4099881 Ki 13.0 nM
CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@H]1C(=O)N1[C@H](C(=O)OCc2ccccc2)[C@@H]1C(=O)OCc1ccccc1 CHEMBL5283523 Ki 13.0 nM
N#CC1(NC(=O)[C@@H]2Cc3ccc(c(Cl)c3)OCCCCOc3ccc(F)c(F)c3C(=O)N2)CC1 CHEMBL3960987 IC50 13.5 nM
CC[C@H](NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2Cl)CN1C(=O)C1(c2ccc(Cl)cc2)CC1)C(=O)C(=O)NCc1ccccc1 CHEMBL3649394 IC50 13.6 nM
CCC[C@H](NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2Cl)CN1C(=O)C1(c2ccc(Cl)cc2)CC1)C(=O)C(=O)NCC CHEMBL3649405 IC50 13.6 nM
CCNC(=O)C(=O)[C@H](CC)NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2Cl)CN1C(=O)C1(c2ccc(Cl)cc2)CC1 CHEMBL3649404 IC50 13.6 nM
N#CC1(NC(=O)[C@@H]2Cc3ccc(c(Cl)c3)OC/C=C/COc3ccccc3C(=O)N2)CC1 CHEMBL4110750 IC50 13.8 nM
COc1ccc(NCCNC(=O)[C@H](CC2CCCCC2)NC(=O)c2cccc(-c3ccccc3)c2)cc1 CHEMBL198611 Ki 14.0 nM
COc1cc(C)c(NCCNC(=O)[C@H](CC(C)C)NC(=O)c2cccc(C)c2)c(C)c1 CHEMBL202958 Ki 14.0 nM
N#CC1(NC(=O)[C@H](Cc2ccc(OC(F)(F)F)c(Cl)c2)NC(=O)c2cnn(C3CCNC3)n2)CC1 CHEMBL4085387 Ki 14.0 nM
C[C@H](Oc1ccc(S(=O)(=O)[C@@H]2C[C@@H](C(=O)NC3(C#N)CC3)N(C(=O)C3(c4ncc(Br)cc4F)CNC3)C2)c(Cl)c1)C(F)(F)F CHEMBL3671346 IC50 14.2 nM
NC(=S)N/N=C(\c1ccc(F)cc1)c1cccc(C(=O)c2ccc(F)cc2)c1 CHEMBL3629194 IC50 14.4 nM
CC(=O)/C=C/[C@H](CCc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cc(F)cc(F)c1 CHEMBL4436812 Ki 14.8 nM
O=C(N[C@@H](Cc1ccccc1)C(=O)N[C@@H]1C(=O)N[C@@H]1Sc1ccccc1)OCc1ccccc1 CHEMBL31272 IC50 15.0 nM
CC(C)C[C@H](CC(=O)NO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C=O CHEMBL126122 IC50 15.0 nM
CCCC[C@@H](C=O)NC(=O)O[C@@H](CC)Cc1ccccc1 CHEMBL114462 IC50 15.0 nM
N#CC1(NC(=O)[C@H](CS(=O)(=O)c2ccc(Br)cc2)N[C@@H](c2ccccc2)C(F)(F)F)CC1 CHEMBL250720 IC50 15.0 nM
CC(C)CS(=O)(=O)C[C@H](NC(=O)c1ccccc1)C(=O)N(C)N(C)C#N CHEMBL2153161 Ki 15.0 nM
Cn1ncc(C(=O)N[C@@H](Cc2ccc(OC(F)(F)F)c(Cl)c2)C(=O)NC2(C#N)CC2)n1 CHEMBL4093444 Ki 15.0 nM
Cc1cccc(C(=O)N[C@@H](CC(C)C)C(=O)NCC#N)c1 CHEMBL4129611 IC50 15.0 nM
CCCC(C)NC(=O)C(=O)[C@H](CCC)NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2Cl)CN1C(=O)C1(c2ccc(Cl)cc2)CC1 CHEMBL3649398 IC50 15.1 nM
N#CC1(NC(=O)[C@@H]2Cc3ccc(c(Cl)c3)OC/C=C/COc3ccc(-c4ccc(F)cc4)cc3C(=O)N2)CC1 CHEMBL4092050 Ki 15.5 nM
Cn1cc(-c2cccc(C[C@H](NC(=O)c3cc(C(C)(C)C)nn3C)C(=O)NCC#N)c2)cn1 CHEMBL563471 pIC50 15.85 nM
Cn1nc(C(C)(C)C)cc1C(=O)N[C@@H](Cc1cccc(-c2nnco2)c1)C(=O)NCC#N CHEMBL562915 pIC50 15.85 nM
C[C@@H](OCc1ccccc1)[C@@H](C#N)NC(=O)[C@H](Cc1cccc(Cl)c1)NC(=O)c1ccc(-c2cncnc2)cc1 CHEMBL4760236 pKi 15.85 nM
CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)NC1CCN(C(=O)[C@H](CC(C)C)NC(=O)OCc2ccccc2)CC1=O CHEMBL118449 Ki app 16.0 nM
N=C(N)NCCC[C@H](NC(=O)[C@H](CS)NC(=O)Cc1ccc(-c2ccccc2)cc1)C(=O)N[C@@H](CC1CCCCC1)C(=O)NCCc1ccccc1 CHEMBL3143404 Ki 16.0 nM
CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC(NC(=O)[C@@H](CC(C)C)NC(=O)OCc2ccccc2)C(=O)C1 CHEMBL281086 Ki 16.0 nM
CC(C)C[C@H](N[C@@H](c1ccc(-c2ccc(N3CCNCC3)cc2)cc1)C(F)(F)F)C(=O)NCC#N CHEMBL195454 IC50 16.0 nM
N#CC1(NC(=O)[C@@H]2Cc3ccc(c(Cl)c3)OC/C=C/COc3cc4c(cc3C(=O)N2)CCCC4)CC1 CHEMBL4115352 IC50 16.0 nM
N#CC1(NC(=O)[C@@H]2Cc3ccc(c(Cl)c3)OC/C=C/COc3ccc(F)cc3C(=O)N2)CC1 CHEMBL4115171 IC50 16.0 nM
CCCC(C)NC(=O)C(=O)[C@H](CC)NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2Cl)CN1C(=O)C1(c2ccc(Cl)cc2)CC1 CHEMBL3649397 IC50 16.5 nM
C[C@H](Oc1ccc(S(=O)(=O)[C@@H]2C[C@@H](C(=O)NC3(C#N)CC3)N(C(=O)C3(c4ncc(Br)cc4F)CN(C)C3)C2)c(Cl)c1)C(F)(F)F CHEMBL3671349 IC50 16.6 nM
O=C(N[C@@H](Cc1ccccc1)C(=O)N[C@@H]1C(=O)N[C@H]1Oc1ccccc1)OCc1ccccc1 CHEMBL282602 IC50 17.0 nM
CC(C)C[C@H](NC(=O)c1ccc(CN)cc1)C(=O)N[C@@H](CCc1ccccc1)C(=O)CO CHEMBL100482 Ki 17.0 nM
Cc1cccc(C(=O)N[C@@H](CC(C)C)C(=O)NCCN2CCc3cc(Cl)ccc32)c1 CHEMBL379230 Ki 17.0 nM
NC(=S)N/N=C(\CCc1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 CHEMBL410086 IC50 17.0 nM
O=C(N[C@@H](Cc1ccccc1)C(=O)N[C@H]1C(=O)N[C@@H]1Oc1ccccc1)OCc1ccccc1 CHEMBL469177 Activity 17.0 nM
N#Cc1nc(Nc2ccc([N+](=O)[O-])cc2)nc(N2CCNCC2)n1 CHEMBL3962225 IC50 17.0 nM
N#Cc1nc(Nc2cccc([N+](=O)[O-])c2)nc(N2CCNCC2)n1 CHEMBL3893204 IC50 17.0 nM
COc1ccc(Nc2nc(C#N)nc(N3CCNCC3)n2)cc1 CHEMBL3930949 IC50 17.0 nM
O=C(NC(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@H](CCc1ccccc1)N/C=C/S(=O)(=O)c1ccc2ccccc2c1)NN1CCOCC1 CHEMBL3142836 Ki 18.0 nM
CC(C)(C)CCn1c(Cc2ccc(Cl)cc2)cc2cnc(C#N)nc21 CHEMBL523336 IC50 18.0 nM
COC1=CC(=O)N(C(=O)/C=C/[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC2CCCCC2)NC(=O)C2CCN(C)CC2)[C@H]1Cc1c[nH]c2ccccc12 CHEMBL4594870 Ki(app) 18.0 nM
N#Cc1ccc2c(c1)C(=O)N[C@H](C(=O)NC1(C#N)CC1)Cc1ccc(c(Cl)c1)OCCCCO2 CHEMBL3919549 IC50 18.3 nM
CC(C)C[C@H](NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2Cl)CN1C(=O)C1(c2ccc(Cl)cc2)CC1)C(=O)C(=O)NC1CC1 CHEMBL3649390 IC50 18.4 nM
CCC[C@H](NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2C(F)(F)F)CN1C(=O)C1(c2ncc(Cl)cc2F)CC1)C(=O)C(=O)NC1CC1 CHEMBL3649381 IC50 18.5 nM
O=C(N[C@@H](Cc1ccccc1)C(=O)NC1CC(=O)N(CCCc2ccccc2)CC1=O)OCc1ccccc1 CHEMBL316864 Ki 19.0 nM
CSC[C@@H](NC(=O)Cc1ccc(-c2ccccc2)cc1)C(=O)N[C@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCCc1ccccc1 CHEMBL3143406 Ki 19.0 nM
COc1cccc(C(=O)N[C@@H](CC(C)(C)C)C(=O)N[C@@H](CCS(C)(=O)=O)CN2CCc3cc(F)ccc32)c1 CHEMBL202747 Ki 19.0 nM
CSCC(NC(=O)Cc1ccc(-c2ccccc2)cc1)C(=O)N[C@H](CCCNC(=N)N)C(=O)NC(Cc1ccc(O)cc1)C(=O)NCCc1ccccc1 CHEMBL407017 Ki 19.0 nM
N#CC1(NC(=O)[C@@H]2C[C@@H](S(=O)(=O)c3ccccc3Cl)CN2C(=O)C2(c3ncc(Br)cc3F)CC2)CC1 CHEMBL4110952 IC50 19.2 nM
O=C(N[C@@H](Cc1ccccc1)C(=O)N[C@H](/C=C/[N+](=O)[O-])CCc1ccccc1)OCc1ccccc1 CHEMBL3974129 Ki 19.6 nM
Cc1cc(C(=O)N[C@@H](Cc2cccc(Cl)c2)C(=O)NCC#N)c2cc(C)ccc2c1 CHEMBL549365 pIC50 19.95 nM
CC(C)C[C@H](NC(=O)c1ccccc1)C(=O)NC1(C#N)CC1 CHEMBL4442543 pKi 19.95 nM
C[C@@H](OCc1ccccc1)[C@@H](C#N)NC(=O)[C@H](Cc1cccc(Br)c1)NC(=O)c1cccc(-c2cccnc2)c1 CHEMBL4741290 pKi 19.95 nM
C[C@@H](OCc1ccccc1)[C@@H](C#N)NC(=O)[C@H](Cc1cccc(Br)c1)NC(=O)c1ccc(-c2cccnc2)cc1 CHEMBL4749112 pKi 19.95 nM
C[C@@H](OCc1ccccc1)[C@@H](C#N)NC(=O)[C@H](Cc1cccc(Br)c1)NC(=O)c1ccc(-c2cncnc2)cc1 CHEMBL4784909 pKi 19.95 nM
C[C@@H](OCc1ccccc1)[C@@H](C#N)NC(=O)[C@H](Cc1cccc(Cl)c1)NC(=O)c1cccc(-c2cncnc2)c1 CHEMBL4758783 pKi 19.95 nM
N#CCNC(=O)[C@H](Cc1cccc(Cl)c1)NC(=O)c1ccccc1 CHEMBL550246 pKi 19.95 nM
CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](C=O)Cc1ccccc1 CHEMBL341014 Ki 20.0 nM
Cc1cccc(C[C@H](NC(=O)C(c2ccccc2)c2ccccc2)C(=O)N[C@H](C#N)COCc2cccc(C(=O)O)c2)c1 CHEMBL336228 IC50 20.0 nM
COc1cccc(C(=O)N[C@@H](CCC2CCCCC2)C(=O)N[C@H](CN2CCc3cc(F)ccc32)[C@@H](C)O)c1 CHEMBL205566 Ki 20.0 nM
COc1c(C)cc(NCCNC(=O)[C@H](CC(C)C)NC(=O)c2cccc(C)c2)cc1C CHEMBL379253 Ki 20.0 nM
CCC[C@H](N)C(=O)N[C@H](/C=C/S(=O)(=O)c1ccccc1)CCc1ccccc1 CHEMBL514348 INH 20.0 nM
CC(C)C[C@H](NC(=O)OCC(C)(C)Oc1cccc(Cl)c1)C(=O)N[C@H](C=O)C[C@@H]1CCNC1=O CHEMBL5414071 IC50 20.0 nM
CCN1CC(C(=O)N2C[C@H](S(=O)(=O)c3ccccc3Cl)C[C@H]2C(=O)NC2(C#N)CC2)(c2ncc(Br)cc2F)C1 CHEMBL3671336 IC50 20.1 nM
CC[C@H](NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccc(N3CCOCC3)cc2Cl)CN1C(=O)C1(c2ccc(Cl)cc2)CC1)C(=O)C(=O)NC1CC1 CHEMBL3649416 IC50 20.6 nM
N=C(N)NCCC[C@@H](NC(=O)[C@H](CS)NC(=O)Cc1ccc(-c2ccccc2)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCCc1ccccc1 CHEMBL3143390 Ki 21.0 nM
N=C(N)NCCC[C@@H](NC(=O)C(CS)NC(=O)Cc1ccc(-c2ccccc2)cc1)C(=O)NC(Cc1ccccc1)C(=O)NCCc1ccccc1 CHEMBL272370 Ki 21.0 nM
NC(=S)N/N=C(/CCc1ccccc1)c1cccc(Cl)c1 CHEMBL258588 IC50 21.0 nM
CC[C@H](NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2Cl)CN1C(=O)C1(c2ccc(Cl)cc2)CC1)C(=O)c1nc2ccccc2o1 CHEMBL3649373 IC50 21.2 nM
COc1ccc(NCCNC(=O)[C@@H](NC(=O)c2cccc(C)c2)C2CCCCC2)cc1 CHEMBL370198 Ki 22.0 nM
Cc1cccc(O[C@H]2CCN3C[C@H]2OC3=O)c1C CHEMBL390474 IC50 22.0 nM
N#CC1(NC(=O)[C@H](CS(=O)(=O)c2ccc(F)cc2)N[C@@H](c2ccc(F)cc2)C(F)(F)F)CC1 CHEMBL251114 IC50 22.0 nM
N#CC1(NC(=O)[C@@H]2C[C@@H](S(=O)(=O)c3ccccc3Cl)CN2C(=O)C2(c3ccc(Cl)cc3)CC2)CC1 CHEMBL2335179 IC50 22.0 nM
C[C@@H]1CC[C@H](NC(=O)[C@H](CC2(C)CCCC2)NC(=O)c2ccco2)C(=O)CN1S(=O)(=O)c1ccccn1 CHEMBL1807651 IC50 22.4 nM
CC(C)C[C@H](CC(=O)NO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C=O CHEMBL125553 IC50 23.0 nM
COc1ccc(NCCNC(=O)[C@H](Cc2ccc(NC(C)=O)cc2)NC(=O)c2cccc(C)c2)cc1 CHEMBL199239 Ki 23.0 nM
N#CC1(NC(=O)[C@H](CS(=O)(=O)c2cccc(Br)c2)N[C@@H](c2ccccc2)C(F)(F)F)CC1 CHEMBL251719 IC50 23.0 nM
N=C(N)NCCC[C@@H](NC(=O)C(CCCCNC(=O)Cc1ccc(-c2ccccc2)cc1)NC(=O)Cc1ccc(-c2ccccc2)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCCc1ccccc1 CHEMBL270269 Ki 23.0 nM
N#Cc1ncc2cc(Cc3ccc(Cl)cc3)n(CCc3ccccc3)c2n1 CHEMBL495098 IC50 23.0 nM
N#Cc1nc(Nc2cccc([N+](=O)[O-])c2)nc(NC2CCCCC2)n1 CHEMBL3954506 IC50 23.0 nM
N#CC1(NC(=O)[C@@H]2Cc3ccc(c(Cl)c3)OCCCCOc3ccc(F)cc3C(=O)N2)CC1 CHEMBL3904797 IC50 23.0 nM
CC(C)CCN(c1nc(C#N)nc(N2CCOCC2)n1)C(C)c1ccc(F)cc1 CHEMBL5269075 IC50 23.0 nM
O=C(NC1CC1)C(=O)[C@H](CC1CCCCC1)NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2Cl)CN1C(=O)C1(c2ccc(Cl)cc2)CC1 CHEMBL3649391 IC50 23.4 nM
N#CC1(NC(=O)[C@@H]2C[C@@H](S(=O)(=O)c3ccccc3Cl)CN2C(=O)C2(c3ncc(Cl)cc3F)CNC2)CC1 CHEMBL3671333 IC50 23.6 nM
NC(=S)N/N=C(\c1ccccc1)c1cccc(C(O)c2ccccc2)c1 CHEMBL3629193 IC50 23.8 nM
NC(=S)N/N=C(/c1ccccc1)c1cccc(C(O)c2ccccc2)c1 CHEMBL4114758 IC50 23.8 nM
COc1ccc(NC[C@H](C)NC(=O)[C@H](CC2CCCCC2)Nc2nc3cccc(Cl)c3o2)cc1 CHEMBL381355 Ki 24.0 nM
N#CC1(NC(=O)[C@H](CS(=O)(=O)c2ccc(Cl)c(Cl)c2)N[C@@H](c2ccccc2)C(F)(F)F)CC1 CHEMBL443319 IC50 24.0 nM
N=C(N)NCCC[C@@H](NC(=O)C(CSCc1ccccc1)NC(=O)Cc1ccc(-c2ccccc2)cc1)C(=O)NC(Cc1ccccc1)C(=O)NCCc1ccccc1 CHEMBL270285 Ki 24.0 nM
NC(=S)N/N=C(/c1ccc(F)cc1)c1cccc(C(=O)c2ccc(F)cc2)c1 CHEMBL3699009 IC50 24.3 nM
N#CC1(NC(=O)[C@@H]2Cc3ccc(c(Cl)c3)OC/C=C/COc3ccc(Br)cc3C(=O)N2)CC1 CHEMBL4109425 IC50 24.8 nM
CCC[C@H](NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccc(N3CCOCC3)cc2Cl)CN1C(=O)C1(c2ccc(Cl)cc2)CC1)C(=O)C(=O)NC1CC1 CHEMBL3649417 IC50 24.9 nM
COc1ccc(NCCNC(=O)[C@H](Cc2c(F)c(F)c(F)c(F)c2F)NC(=O)c2cccc(C)c2)cc1 CHEMBL372081 Ki 25.0 nM
NC(=S)N/N=C(/c1ccccc1)c1cc(C(=O)c2ccccc2)cc(C(=O)c2ccccc2)c1 CHEMBL3938699 IC50 25.0 nM
N#Cc1ncc(F)c(N(CCC(F)(F)F)Cc2ccc3c(c2)OCO3)n1 CHEMBL4103288 Ki 25.0 nM
COC(=O)/C=C/[C@H](CCc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccc([N+](=O)[O-])cc1 CHEMBL4093034 Ki 25.0 nM
N#CC1(NC(=O)[C@H](Cc2ccc(OC(F)(F)F)c(Cl)c2)NC(=O)c2cnn(C3COC3)n2)CC1 CHEMBL4074099 Ki 25.0 nM
N#CN1CC[C@@H](NS(=O)(=O)c2cc(Br)ccc2Br)C1 CHEMBL1672427 pIC50 25.12 nM
CC(C)C[C@H](N[C@@H](c1ccc(-c2cncnc2)cc1)C(F)(F)F)C(=O)N[C@H](C#N)Cc1ccccc1 CHEMBL4473385 pKi 25.12 nM
Cn1nc(C(F)(F)F)cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC#N CHEMBL4741237 pKi 25.12 nM
CC(C)C[C@H](NC(=O)c1cc(C(C)(C)C)nn1C)C(=O)NCC#N CHEMBL4784502 pKi 25.12 nM
CC(C)(C)OC(=O)N1CC(c2ccc3c(c2)C(=O)N[C@H](C(=O)NC2(C#N)CC2)Cc2ccc(c(Cl)c2)OCCCCO3)C1 CHEMBL3966056 IC50 25.5 nM
COc1ccc(S(=O)(=O)[C@@H]2C[C@@H](C(=O)NC3(C#N)CC3)N(C(=O)C3(c4ncc(Br)cc4F)CC3)C2)c(Cl)c1 CHEMBL4112501 IC50 25.5 nM
O=C1O[C@@H]2CN1CC[C@@H]2Oc1ccccc1 CHEMBL230474 IC50 26.0 nM
Cc1ccc2c(n1)SC/C=C/COc1ccc(cc1Cl)C[C@@H](C(=O)NC1(C#N)CC1)NC2=O CHEMBL4109672 IC50 26.0 nM
CC(C)(C)OC(=O)N1CC(c2ccc3c(c2)C(=O)N[C@H](C(=O)NC2(C#N)CC2)Cc2ccc(c(Cl)c2)OC/C=C/CO3)C1 CHEMBL4108574 IC50 26.2 nM
CCC[C@H](NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2C(F)(F)F)CN1C(=O)C1(c2ccc(Cl)cc2)CC1)C(=O)C(=O)NC1CC1 CHEMBL3649383 IC50 26.6 nM
C[C@H](Oc1ccc(S(=O)(=O)[C@@H]2C[C@@H](C(=O)NC3(C#N)CC3)N(C(=O)C3(c4ncc(Br)cc4F)CCN3)C2)c(Cl)c1)C(F)(F)F CHEMBL3671348 IC50 26.9 nM
CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](/C=C/[N+](=O)[O-])CCc1ccccc1 CHEMBL3930083 Ki 27.0 nM
N#Cc1ncc(F)c(N(CCCc2ccc(Cl)cc2)Cc2ccc3c(c2)OCO3)n1 CHEMBL4099341 Ki 27.0 nM
COC(=O)/C=C/[C@H](CCc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 CHEMBL4082758 Ki 27.0 nM
C[C@H](NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2Cl)CN1C(=O)C1(c2ccc(Cl)cc2)CC1)C(=O)C(=O)NC1CC1 CHEMBL3649395 IC50 28.0 nM
CC[C@H](NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2C(F)(F)F)CN1C(=O)C1(c2ccc(Cl)cc2)CC1)C(=O)C(=O)NC1CC1 CHEMBL3649382 IC50 28.7 nM
Cn1cc(-c2ccc(S(=O)(=O)[C@@H]3C[C@@H](C(=O)NC4(C#N)CC4)N(C(=O)C4(c5ncc(Cl)cc5F)CC4)C3)c(Cl)c2)cn1 CHEMBL4111007 IC50 28.7 nM
CC(C)C[C@H](NC(=O)OCc1ccncc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)CSC(C)(C)C CHEMBL436227 Ki 28.8 nM
O=C(N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCc1ccccc1)C(=O)CSCCCc1ccccc1)OCc1cccnc1 CHEMBL347459 Ki 28.8 nM
CCC[C@H](NC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)c1cnccn1)C(C)C)C(C)(C)C)C(=O)C(=O)N[C@@H](C)c1ccccc1 CHEMBL87150 Ki 29.0 nM
CCC[C@H](NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2Cl)CN1C(=O)C1(c2ccc(Cl)cc2)CC1)C(=O)C(=O)NCC(F)(F)F CHEMBL3649401 IC50 29.9 nM
CC(C)[C@H](NC(=O)c1cnccn1)C(=O)N[C@H](C(=O)N1C[C@@H]2CCC[C@@H]2[C@H]1C(=O)N[C@@H](CC(F)F)C(=O)C(=O)NC1CC1)C(C)(C)C CHEMBL313182 Ki 30.0 nM
CC[C@@H](C)[C@H](NC(=O)NC(C)C)C(=O)N[C@@H](C=O)Cc1c[nH]c2ccccc12 CHEMBL1790992 IC50 30.0 nM
CCc1ccc(C(=O)N[C@@H](CC(C)C)C(=O)NCCNc2ccc(OC)cc2)cc1 CHEMBL64604 IC50 30.0 nM
CC(C)C[C@H](NC(=O)C1CCNCC1)C(=O)N[C@@H](CCc1ccccc1)C(=O)c1nc2ccccc2o1 CHEMBL270792 Ki 30.0 nM
N#CC1(NC(=O)[C@@H]2C[C@@H](S(=O)(=O)c3ccccc3Cl)CN2C(=O)C2(c3ccc(Cl)cc3F)CC2)CC1 CHEMBL2335182 IC50 30.0 nM
CC(C)C[C@@H](/C=C/[N+](=O)[O-])NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 CHEMBL3934979 Ki 30.0 nM
COc1cccc(CCCN(Cc2ccc3c(c2)OCO3)c2nc(C#N)ncc2F)c1 CHEMBL4061015 Ki 30.0 nM
N#Cc1nc(Nc2cccc([N+](=O)[O-])c2)nc(NC2CCNCC2)n1 CHEMBL4237391 IC50 30.0 nM
Cc1cccc(C[C@H](NC(=O)c2ccncc2)C(=O)N[C@H](/C=C(\F)S(=O)(=O)Oc2ccccc2)CCc2ccccc2)c1 CHEMBL4864383 Ki 30.0 nM
CC(C)C[C@H](NC(=O)OCC(C)(C)Sc1ccccc1)C(=O)N[C@H](C=O)C[C@@H]1CCNC1=O CHEMBL5426970 IC50 30.0 nM
CC(C)C[C@H](NC(=O)OCC(C)(C)Sc1ccccc1)C(=O)N[C@H](C#N)C[C@@H]1CCNC1=O CHEMBL5405589 IC50 30.0 nM
[2H]C([2H])(OC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C=O)C[C@@H]1CCNC1=O)C(C)(C)Sc1ccccc1 CHEMBL5433349 IC50 30.0 nM
CC(C)C[C@H](NC(=O)OCC(C)(C)Sc1cccc(Cl)c1)C(=O)N[C@H](C=O)C[C@@H]1CCNC1=O CHEMBL5405557 IC50 30.0 nM
CC(C)C[C@H](NC(=O)OCC(C)(C)Oc1ccc(F)cc1)C(=O)N[C@H](C=O)C[C@@H]1CCNC1=O CHEMBL5396481 IC50 30.0 nM
NC(=S)N/N=C(/c1cccc(Br)c1)c1ccccc1F CHEMBL589280 IC50 30.5 nM
N#CCNC(=O)[C@H](Cc1ccccc1)NC(=O)C(c1ccccc1)c1ccccc1 CHEMBL342145 IC50 31.0 nM
N#CC1(NC(=O)[C@@H]2C[C@@H](S(=O)(=O)c3ccccc3F)CN2C(=O)C2(c3ncc(Cl)cc3F)CC2)CC1 CHEMBL4111154 IC50 31.0 nM
CC(C)C[C@H](NC(=O)C(F)(F)c1ccccc1)C(=O)NC1(C#N)CC1 CHEMBL4750552 pKi 31.62 nM
C[C@@H]1CC[C@H](NC(=O)[C@H](CC2(C)CCCCC2)NC(=O)c2ccco2)C(=O)CN1S(=O)(=O)c1ccccn1 CHEMBL1807652 IC50 31.9 nM
CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](CNc1ccc(-c2ccccc2)cc1)Cc1ccccc1 CHEMBL171998 Ki 32.0 nM
O=C[C@H](Cc1c[nH]c2ccccc12)NC(=O)C(Cc1ccccc1)Cc1ccccc1 CHEMBL132652 IC50 32.0 nM
N#CC1(NC(=O)[C@@H]2Cc3ccc(c(Cl)c3)OC/C=C/COc3cccc(c3)C(=O)N2)CC1 CHEMBL4111726 IC50 32.0 nM
CC[C@H](NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2C(F)(F)F)CN1C(=O)C1(c2ncc(Cl)cc2F)CC1)C(=O)C(=O)NC1CC1 CHEMBL3649380 IC50 32.4 nM
N#Cc1nc(N2CCOCC2)nc(N(Cc2ccc3c(c2)OCO3)C2CCCCC2)n1 CHEMBL2402091 Ki 33.0 nM
N#CC1(NC(=O)[C@@H]2C[C@@H](S(=O)(=O)c3ccc(OCC(F)(F)F)cc3Cl)CN2C(=O)C2(c3ncc(Br)cc3F)CNC2)CC1 CHEMBL3671337 IC50 33.8 nM
CC(C)C[C@H](NC(c1ccc(Br)cc1)C(F)(F)F)C(=O)NCC#N CHEMBL372979 IC50 34.0 nM
CC(C)C[C@H](N[C@@H](c1ccccc1)C(F)(F)F)C(=O)NCC#N CHEMBL204276 IC50 34.0 nM
CC(=O)/C=C/[C@H](CCc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc(F)cc1F CHEMBL4566436 Ki 35.0 nM
CSCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](CCc1ccccc1)CNc1ccc(N2CCCCC2)cc1 CHEMBL172456 Ki 36.0 nM
COc1ccc(S(=O)(=O)[C@@H]2C[C@@H](C(=O)NC3(C#N)CC3)N(C(=O)C3(c4ccc(Cl)cn4)CNC3)C2)c(Cl)c1 CHEMBL3671323 IC50 36.0 nM
CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)NC1CN(C(=O)[C@H](CC(C)C)NC(=O)OCc2ccccc2)CC1=O CHEMBL100563 Ki 39.0 nM
CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(=O)C(NC(=O)[C@@H](CC(C)C)NC(=O)OCc2ccccc2)C1 CHEMBL29483 Ki 39.0 nM
NC(=S)N/N=C(\CCc1ccccc1)c1cc(Cl)cc(Cl)c1 CHEMBL406601 IC50 39.0 nM
Cc1ccc(C[C@H](NC(=O)c2ccc3c(c2)OCCO3)C(=O)N[C@H](/C=C(\F)S(=O)(=O)Oc2ccccc2)CCc2ccccc2)cc1 CHEMBL4860770 Ki 39.0 nM
N#CN1CC[C@@H](NS(=O)(=O)c2cccc(Br)c2)C1 CHEMBL1672425 pIC50 39.81 nM
N#CC1(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)CC1 CHEMBL4463665 pKi 39.81 nM
CC(C)C[C@H](NC(=O)C(C)(C)c1ccccc1)C(=O)NC1(C#N)CC1 CHEMBL4763131 pKi 39.81 nM
N#Cc1ncc2cc(Cc3ccc(Cl)cc3)n(CCc3cccc(Cl)c3)c2n1 CHEMBL493472 IC50 40.0 nM
COC(=O)/C=C/[C@H](CCc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1 CHEMBL4101714 Ki 40.0 nM
CC(C)C[C@H](NC(=O)OCC(C)(C)Sc1ccccc1)C(=O)N[C@@H](C[C@@H]1CCNC1=O)C(=O)C(=O)NC1CC1 CHEMBL5433524 IC50 40.0 nM
[2H]C([2H])(OC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C=O)C[C@@H]1CCNC1=O)C(C)(C)Oc1ccc(Cl)cc1 CHEMBL5402510 IC50 40.0 nM
Cc1cc2nn1CC/C=C/COc1ccc(cc1Cl)C[C@@H](C(=O)NC1(C#N)CC1)NC2=O CHEMBL4091918 Ki 40.3 nM
N#CC1(NC(=O)[C@H](CS(=O)(=O)c2ccc(Cl)c(Cl)c2)N[C@@H](c2ccc(F)cc2)C(F)(F)F)CC1 CHEMBL251117 IC50 41.0 nM
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)SCC(=O)N1CCCc2ccccc21 CHEMBL258492 IC50 41.0 nM
COC(=O)/C=C/[C@H](CCc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccc([N+](=O)[O-])cc1 CHEMBL4100751 Ki 41.0 nM
CC(=O)O[C@@H]1NC(=O)[C@H]1NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 CHEMBL417303 IC50 42.0 nM
CC(C)CC(NC(=O)c1ccccc1)C(=O)NCC#N CHEMBL122513 IC50 42.0 nM
COc1cccc(C(=O)N[C@@H](CCC2CCCCC2)C(=O)N[C@@H](CCCN)CN2CCc3cc(F)ccc32)c1 CHEMBL383549 Ki 42.0 nM
CS(=O)(=O)c1ccc(-c2ccc([C@H](N[C@@H](CC(Cl)Cl)C(=O)N[C@H](C#N)Cc3ccccc3)C(F)(F)F)cc2)cc1 CHEMBL1290084 IC50 42.0 nM
N#CCNC(=O)[C@H](Cc1cccc(O)c1)NC(=O)c1cccc(C(F)(F)F)c1 CHEMBL4126611 IC50 42.0 nM
CC[C@H](NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2Cl)CN1C(=O)C1(c2ncc(Br)cc2F)CC1)C(=O)C(=O)NC1CC1 CHEMBL3649384 IC50 42.1 nM
Cn1cc(-c2ccc(S(=O)(=O)[C@@H]3C[C@@H](C(=O)NC4(C#N)CC4)N(C(=O)C4(c5ncc(C(F)(F)F)cc5F)CC4)C3)c(Cl)c2)cn1 CHEMBL4112897 IC50 43.6 nM
CC(C)C[C@H](NC(=O)OCc1cccnc1)C(=O)N[C@@H](CCc1ccccc1)C(=O)CSC(C)(C)C CHEMBL352168 Ki 44.0 nM
N#Cc1nc(Nc2ccccc2OCCCn2ccnc2)c2ncn(C3CCCC3)c2n1 CHEMBL188865 IC50 44.0 nM
Cc1ccc(/C(=N/NC(N)=S)c2cccc(F)c2)cc1 CHEMBL261307 IC50 44.0 nM
N#CC1(NC(=O)[C@@H]2C[C@@H](S(=O)(=O)c3ccc(OCC(F)(F)F)cc3Cl)CN2C(=O)C2(c3ncc(Cl)cc3F)CC2)CC1 CHEMBL4112900 IC50 44.5 nM
N=C(N)NCCC[C@H](NC(=O)[C@H](CS)NC(=O)Cc1ccc(-c2ccccc2)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCCc1ccccc1 CHEMBL3143399 Ki 45.0 nM
CC(C)C[C@H](NC(=O)c1cc2ccccc2o1)C(=O)N[C@H]1C(=O)CN(S(=O)(=O)c2ccccn2)CC[C@H]1C CHEMBL203556 Ki app 45.0 nM
O=C(N[C@@H](CC1CCCCC1)C(=O)NCCNc1ccc(OC(F)(F)F)cc1)c1cc2ccccc2o1 CHEMBL386383 Ki 45.0 nM
N=C(N)NCCC[C@@H](NC(=O)C(CS)NC(=O)Cc1ccc(-c2ccccc2)cc1)C(=O)NC(Cc1ccc(O)cc1)C(=O)NCCc1ccccc1 CHEMBL437233 Ki 45.0 nM
N#Cc1nc(NC[C@H](O)c2ccccc2)nc(N2CCNCC2)n1 CHEMBL3899928 IC50 45.0 nM
O=C(N[C@@H](Cc1ccccc1)C(=O)N[C@H](/C=C/S(=O)(=O)c1ccccc1)CCc1ccccc1)OCc1ccc([N+](=O)[O-])cc1 CHEMBL4081250 Ki 45.0 nM
NC(=S)N/N=C1\CCSc2cc(F)c(F)cc21 CHEMBL2062897 IC50 46.0 nM
CC(C)C[C@@H](/C=C/[N+](=O)[O-])NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1 CHEMBL3921142 Ki 46.0 nM
NC(=S)N/N=C(/c1cccc(Br)c1)c1cccc(C(F)(F)F)c1 CHEMBL601890 IC50 46.5 nM
O=C(CCc1ccccc1)O[C@@H]1NC(=O)[C@H]1NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 CHEMBL30356 IC50 47.0 nM
CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)NC1CCCN(C(=O)[C@H](CC(C)C)NC(=O)OCc2ccccc2)CC1=O CHEMBL31947 Ki 47.0 nM
CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(N3CCNCC3)cc2)cc1)C(F)(F)F)C(=O)NCC#N CHEMBL4557939 IC50 47.0 nM
CC(=O)/C=C/[C@H](CCc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccc(F)c1 CHEMBL4453415 Ki 47.0 nM
CC(C)C[C@H](NC(=O)C1OC1C(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCCN=[N+]=[N-] CHEMBL4443064 Ki 47.0 nM
CCCN1CCN(c2ccc(C(=O)NC3(C(=O)NCC#N)CCCCC3)cc2)CC1 CHEMBL371064 IC50 48.0 nM
CC(C)C(Nc1cccc(C(F)(F)F)c1)C(=O)N1CCCCN1C#N CHEMBL521987 IC50 48.0 nM
CC(C)C[C@H](NC(=O)c1cccc(F)c1)C(=O)NCC#N CHEMBL4128244 IC50 48.0 nM
N#CC1(NC(=O)[C@@H]2C[C@@H](S(=O)(=O)c3ccc(F)cc3Cl)CN2C(=O)C2(c3ncc(Br)cc3F)CCN2)CC1 CHEMBL3671344 IC50 48.5 nM
C[C@@H]1CC[C@H](NC(=O)[C@H](CC2(C)CCCCC2)NC(=O)N2CCOCC2)C(=O)CN1S(=O)(=O)c1ccccn1 CHEMBL1807701 IC50 48.7 nM
CC(C)C[C@@H](C(=O)NC1CN(C(=O)[C@H](CC(C)C)N(C)C(=O)OCc2ccccc2)CC1=O)N(C)C(=O)OCc1ccccc1 CHEMBL423995 Ki app 49.0 nM
CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)N[C@H](C#N)Cc1ccc(C#N)cc1F CHEMBL1288523 IC50 49.0 nM
CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](/C=C/[N+](=O)[O-])Cc1ccccc1 CHEMBL3893138 Ki 49.0 nM
Cc1cccc(C[C@H](NC(=O)c2ccncc2)C(=O)N[C@H](/C=C(\F)S(=O)(=O)c2ccccc2)CCc2ccccc2)c1 CHEMBL4851440 Ki 49.0 nM
Cc1cccc(C[C@H](NC(=O)c2ccc(F)cc2)C(=O)NCC#N)c1 CHEMBL5405909 Ki 49.0 nM
COC(=O)Cn1cc(COC[C@@H](C#N)NC(=O)[C@H](Cc2cccc(C)c2)NC(=O)c2ccc(F)cc2)nn1 CHEMBL5395533 Ki 49.0 nM
COc1ccc(NCCNC(=O)[C@H](CC(C)C)NC(=O)c2ccc(C(C)C)cc2)cc1 CHEMBL306503 IC50 50.0 nM
N#CN1CC(CNS(=O)(=O)c2ccccc2)C1 CHEMBL276169 IC50 50.0 nM
[N-]=[N+]=CC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 CHEMBL426774 IC50 50.0 nM
C[C@H](C#N)n1cc([C@@H](NC(=O)c2ccsc2)C2CCCCC2)nn1 CHEMBL2207571 IC50 50.0 nM
N#CC1(NC(=O)[C@@H]2Cc3ccc(c(Cl)c3)OCCCCOc3cc(Cl)ccc3C(=O)N2)CC1 CHEMBL3967123 IC50 50.0 nM
CCOC(=O)/C=C/C(=O)[C@H](CCc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 CHEMBL4251480 IC50 50.0 nM
Cc1cc(C)cc(C(=O)N[C@@H](Cc2cccc(Cl)c2)C(=O)NCC#N)c1 CHEMBL559238 pIC50 50.12 nM
C[C@@H](OCc1ccccc1)[C@@H](C#N)NC(=O)[C@H](Cc1cccc(Cl)c1)NC(=O)c1cccc(-c2ccccc2)c1 CHEMBL4778004 pKi 50.12 nM
N#CCNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccccc1 CHEMBL4764822 pKi 50.12 nM
CCC[C@H](NC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)c1cnccn1)C(C)C)C(C)(C)C)C(=O)C(=O)NC(C)CC CHEMBL314777 Ki 52.0 nM
CC(C)C[C@H](NC(=O)c1cc2ccccc2o1)C(=O)N[C@H]1C(=O)CN(S(=O)(=O)c2ccccn2)CC[C@@H]1C CHEMBL204169 Ki app 52.0 nM
N#CC1(NC(=O)[C@@H]2C[C@@H](Sc3cc(C(F)(F)F)ccc3Cl)CN2C(=O)C2(c3ncc(Cl)cc3F)CC2)CC1 CHEMBL4109836 IC50 52.4 nM
CC(C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@H](C=O)Cc1ccc[nH]c1=O CHEMBL5079773 Ki 53.0 nM
N#CN1CCC(NC(=O)OCc2ccccc2)C1 CHEMBL273229 IC50 54.0 nM
N#CCNC(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)OCc1ccccc1 CHEMBL200954 Ki app 54.0 nM
N#CC1(NC(=O)[C@@H]2Cc3ccc(c(Cl)c3)OC/C=C/CNc3ccccc3C(=O)N2)CC1 CHEMBL4114847 IC50 54.0 nM
N#CC1(NC(=O)[C@@H]2Cc3ccc(c(Cl)c3)OC/C=C\COc3ccc(F)c(F)c3C(=O)N2)CC1 CHEMBL3910337 IC50 54.0 nM
COc1ccc2c(c1)CC/C=C/COc1ccc(cc1Cl)C[C@@H](C(=O)NC1(C#N)CC1)NC2=O CHEMBL4107132 IC50 54.7 nM
CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)NC1CN(C(=O)c2ccc(Oc3ccccc3)cc2)CC1=O CHEMBL119219 Ki 55.0 nM
N#CCNC(=O)[C@H](CC1CCCCC1)NC(=O)c1ccccc1 CHEMBL200884 IC50 55.0 nM
CC[C@H](NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccc(OCC(F)(F)F)cc2Cl)CN1C(=O)C1(c2ncc(Cl)cc2F)CC1)C(=O)C(=O)NC1CC1 CHEMBL3649371 IC50 55.4 nM
N#CC1(NC(=O)[C@@H]2Cc3ccc(c(Cl)c3)OC/C=C/CCn3nc(cc3-c3ccccc3)C(=O)N2)CC1 CHEMBL4072767 Ki 55.7 nM
CCc1ccccc1NC(=O)CSC(=O)NNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C CHEMBL259450 IC50 56.0 nM
NC(=S)N/N=C(\c1ccccc1)c1cc(C(=O)c2ccccc2)cc(C(=O)c2ccccc2)c1 CHEMBL3629192 IC50 56.0 nM
N#CC1(NC(=O)[C@@H]2C[C@@H](S(=O)(=O)c3cc(C(F)(F)F)ccc3Cl)CN2C(=O)C2(c3ncc(Cl)cc3F)CC2)CC1 CHEMBL4114176 IC50 56.8 nM
C[C@@H]1CC[C@H](NC(=O)[C@H](CC2CCC(C)(C)CC2)NC(=O)c2ccco2)C(=O)CN1S(=O)(=O)c1ccccn1 CHEMBL1807699 IC50 58.5 nM
C[C@H](Oc1ccc(S(=O)(=O)[C@@H]2C[C@@H](C(=O)NC3(C#N)CC3)N(C(=O)C3(c4ncc(Cl)cc4F)CCN3)C2)c(Cl)c1)C(F)(F)F CHEMBL3671347 IC50 58.5 nM
Cc1ncccc1-c1ccc(S(=O)(=O)[C@@H]2C[C@@H](C(=O)NC3(C#N)CC3)N(C(=O)C3(c4ncc(C(F)(F)F)cc4F)CC3)C2)c(Cl)c1 CHEMBL4108889 IC50 58.9 nM
NC(=S)N/N=C(\c1cc(F)cc(F)c1)c1cccc(Br)c1 CHEMBL600860 IC50 59.4 nM
O=C(N[C@@H](Cc1ccccc1)C(=O)N[C@H](/C=C(\F)S(=O)(=O)Oc1ccccc1)CCc1ccccc1)c1ccncc1 CHEMBL4857486 Ki 60.0 nM
Cc1cc(-c2ccc(S(=O)(=O)[C@@H]3C[C@@H](C(=O)NC4(C#N)CC4)N(C(=O)C4(c5ncc(Cl)cc5F)CC4)C3)c(Cl)c2)ccn1 CHEMBL4111584 IC50 61.6 nM
Cc1cccc(C(=O)N[C@@H](CC(C)C)C(=O)NCCNc2ccc(F)cc2)c1 CHEMBL205196 Ki 62.0 nM
N#CC1(NC(=O)[C@H](CS(=O)(=O)CC2CC2)N[C@@H](c2ccc(F)cc2)C(F)(F)F)CC1 CHEMBL251327 IC50 62.0 nM
CCc1cc(C(=O)N[C@@H](Cc2cccc(Cl)c2)C(=O)NCC#N)n(C)n1 CHEMBL563886 pIC50 63.1 nM
CC(C)C[C@H](NC(=O)c1ccccc1)C(=O)N[C@H](C#N)Cc1ccccc1 CHEMBL4578891 pKi 63.1 nM
CC(C)C[C@H](NC(=O)Cc1ccccc1)C(=O)NC1(C#N)CC1 CHEMBL4792937 pKi 63.1 nM
NC(=S)N/N=C(/c1cccc(Br)c1)c1cc(F)c(F)c(F)c1F CHEMBL602934 IC50 63.2 nM
CC[C@H](NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccc(OCC(F)(F)F)cc2C(F)(F)F)CN1C(=O)C1(c2ccc(Cl)cc2)CC1)C(=O)C(=O)NC1CC1 CHEMBL3649372 IC50 63.2 nM
CN1CCC(COc2nc(C#N)nc(NCC3CCC4(CC3)CC4)c2C(=O)NCc2ccccc2)CC1 CHEMBL498508 IC50 64.0 nM
N#CC1(NC(=O)[C@H](Cc2ccc(Cl)c(Cl)c2)NC(=O)c2cnn(C3CC(F)(F)C3)n2)CC1 CHEMBL4078079 Ki 64.0 nM
Cc1ncccc1-c1ccc(S(=O)(=O)[C@@H]2C[C@@H](C(=O)NC3(C#N)CC3)N(C(=O)C3(c4ncc(Cl)cc4F)CC3)C2)c(Cl)c1 CHEMBL4111061 IC50 64.2 nM
N=C(N)NCCC[C@H](NC(=O)[C@H](CS)NC(=O)Cc1ccc(-c2ccccc2)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCCc1ccccc1 CHEMBL3143405 Ki 67.0 nM
CC(C)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)N[C@H](C#N)Cc1ccccc1 CHEMBL399361 IC50 67.0 nM
CCC[C@H](NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccc(O[C@@H](C)C(F)(F)F)cc2Cl)CN1C(=O)C1(c2ccc(Cl)cc2)CC1)C(=O)C(=O)NC1CC1 CHEMBL3649407 IC50 67.1 nM
CC(C)CC(NC(c1ccc(-c2ccc(N3CCNCC3)cc2)cc1)C(F)(F)F)C(=O)NCC#N CHEMBL195505 IC50 68.0 nM
COc1ccc(NCCNC(=O)[C@H](CC2CCCCC2)NC(=O)c2cc3cc(Cl)ccc3o2)cc1 CHEMBL198420 Ki 68.0 nM
N#CC1(NC(=O)[C@H](CS(=O)(=O)CC2CC2)N[C@@H](c2ccccc2)C(F)(F)F)CC1 CHEMBL249712 IC50 68.0 nM
NC(=S)N/N=C1\CCSc2ccc([N+](=O)[O-])cc21 CHEMBL2062909 IC50 68.0 nM
N=C(N)NCCC[C@@H](NC(=O)[C@H](CS)NC(=O)Cc1ccc(-c2ccccc2)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O CHEMBL3143391 Ki 70.0 nM
CC(C)C[C@H](NC(=O)C1CCNCC1)C(=O)N[C@@H](CCc1ccccc1)C(=O)c1nc2cc(C(C)(C)C)ccc2o1 CHEMBL257692 Ki 70.0 nM
CC(C)(C)OC(=O)N1CC(C(=O)N2C[C@H](S(=O)(=O)c3ccccc3Cl)C[C@H]2C(=O)NC2(C#N)CC2)(c2ncc(Br)cc2F)C1 CHEMBL3671332 IC50 70.5 nM
Cc1cc(-c2ccc(S(=O)(=O)[C@@H]3C[C@@H](C(=O)NC4(C#N)CC4)N(C(=O)C4(c5ncc(Br)cc5F)CCN4)C3)c(Cl)c2)ccn1 CHEMBL3671353 IC50 70.6 nM
NC(=S)N/N=C(\c1cccc(O)c1)c1cc(Br)cc(C(=O)c2cccc(O)c2)c1 CHEMBL3629202 IC50 71.6 nM
CCCC[C@@H](C=O)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1 CHEMBL92708 IC50 72.0 nM
Cc1ncccc1-c1ccc(S(=O)(=O)[C@@H]2C[C@@H](C(=O)NC3(C#N)CC3)N(C(=O)C3(c4ncc(Cl)cc4Cl)CC3)C2)c(Cl)c1 CHEMBL4115527 IC50 72.2 nM
N#CC1(NC(=O)[C@@H]2C[C@@H](S(=O)(=O)c3ccc(Br)cc3Cl)CN2C(=O)C2(c3ncc(Cl)cc3F)CC2)CC1 CHEMBL4114015 IC50 72.6 nM
N#CC1(NC(=O)[C@@H]2Cc3ccc(c(Cl)c3)OC/C=C/COc3cc(Cl)ccc3C(=O)N2)CC1 CHEMBL4112499 IC50 73.0 nM
N#CC1(NC(=O)[C@@H]2C[C@@H](S(=O)(=O)c3ccc(OCC(F)(F)F)cc3Cl)CN2C(=O)C2(c3ccc(Br)cn3)CNC2)CC1 CHEMBL3671328 IC50 73.5 nM
CC[C@H](NC(=O)[C@@H]1C[C@@H](S(=O)(=O)c2ccc(O[C@@H](C)C(F)(F)F)cc2Cl)CN1C(=O)C1(c2ccc(Cl)cc2)CC1)C(=O)C(=O)NC1CC1 CHEMBL3649406 IC50 74.9 nM
COc1ccc(NC[C@@H](C)NC(=O)[C@H](CC(C)C)NC(=O)c2cccc(C)c2)cc1 CHEMBL203325 Ki 75.0 nM
C[C@@H](CNc1ccc(OC(F)(F)F)cc1)NC(=O)[C@H](CC1CCCCC1)NC(=O)OC1CCOCC1 CHEMBL212176 Ki 75.0 nM
COCCN(C)CCn1cnc2c(NC3CCCCC3)nc(C#N)nc21 CHEMBL186062 IC50 76.0 nM
N#CC1(NC(=O)[C@H](Cc2ccc(OC(F)(F)F)c(Cl)c2)NC(=O)c2cnn(C3CC(F)(F)C3)n2)CC1 CHEMBL4100863 Ki 76.0 nM
Cc1cc(O)cc(C)c1C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)N(C)C(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H](CO)NC(=O)[C@@H](CO)NC(=O)[C@@H](CO)NC(=O)[C@H](Cc1cn(CCNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)C2OC2C(=O)O)nn1)NC(=O)CN1CCN(CC(=O)O)CCN(CC(=O)O)CCN(CC(=O)O)CC1)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)(C)C CHEMBL4588311 Ki 76.0 nM
Cc1ccc(C[C@H](NC(=O)c2ccc3c(c2)OCCO3)C(=O)N[C@H](/C=C(\F)S(=O)(=O)Cc2ccccc2)CCc2ccccc2)cc1 CHEMBL4878537 Ki 76.0 nM
N#CC1(NC(=O)[C@@H]2Cc3ccc(cc3)OC/C=C/CCc3ccccc3C(=O)N2)CC1 CHEMBL4107440 IC50 77.0 nM
N#Cc1ncc(F)c(N(CCOc2ccccc2)Cc2ccc3c(c2)OCO3)n1 CHEMBL4094982 Ki 77.0 nM
N#Cc1ncc(F)c(N(Cc2ccc3c(c2)OCO3)CC2CC2)n1 CHEMBL4069851 Ki 77.0 nM
CC(C)C[C@H](NC(=O)c1cccc(C(C)(C)C)c1)C(=O)NCC#N CHEMBL4125776 IC50 77.0 nM
CC[C@H](C)[C@@H](C(=O)O[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](/C=C/C(=O)N1C(=O)C=C(OC)[C@H]1Cc1ccccc1)Cc1ccccc1)N(C)C CHEMBL4514842 IC50 77.0 nM
N#CC1(NC(=O)[C@H](Cc2ccc(Cl)c(Cl)c2)NC(=O)c2cnn(C3COC3)n2)CC1 CHEMBL4102351 Ki 78.0 nM
Cc1ccc(C[C@H](NC(=O)c2ccncc2)C(=O)N[C@H](/C=C(\F)S(=O)(=O)Oc2ccccc2)CCc2ccccc2)cc1 CHEMBL4861941 Ki 78.0 nM
N#CC1(NC(=O)[C@@H]2C[C@@H](S(=O)(=O)c3ccc(OCC(F)(F)F)cc3Cl)CN2C(=O)C2(c3ncc(Cl)cc3F)CNC2)CC1 CHEMBL3671338 IC50 78.2 nM
CC(=O)/C=C/[C@H](CCc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc2c(c1)OCCO2 CHEMBL4456010 Ki 78.2 nM
N#CCNC(=O)[C@H](Cc1cccc(Cl)c1)NC(=O)c1cccc(Cl)c1 CHEMBL551805 pIC50 79.43 nM
Cc1ccc(C)c(C(=O)N[C@@H](Cc2cccc(Cl)c2)C(=O)NCC#N)c1 CHEMBL560786 pIC50 79.43 nM
Cc1cc(C(=O)N[C@@H](Cc2cccc(Cl)c2)C(=O)NCC#N)c(C)s1 CHEMBL561586 pIC50 79.43 nM
CC(C)c1cc(C(=O)N[C@@H](Cc2cccc(Cl)c2)C(=O)NCC#N)n(C)n1 CHEMBL562462 pIC50 79.43 nM
N#CCNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)c1ccccc1 CHEMBL4799785 pKi 79.43 nM
NC(=S)N/N=C(\c1ccc(F)cc1)c1cccc(Br)c1 CHEMBL602093 IC50 79.6 nM
N#CN1CCC(NS(=O)(=O)c2ccccc2)C1 CHEMBL275080 IC50 80.0 nM
CC(C)C[C@H](N[C@@H](c1ccc(-c2ccncc2)cc1)C(F)(F)F)C(=O)NCC#N CHEMBL206024 IC50 80.0 nM
CCOC(=O)/C=C/C(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 CHEMBL4240920 IC50 80.0 nM
CCC(C)[C@H](NC(=O)c1cccc(CN)c1)C(=O)N[C@@H](CCc1ccccc1)C(=O)CO CHEMBL98540 Ki 81.0 nM
C[C@@H](CC1CCCCC1)OC(=O)N[C@H]1CCN(C#N)C1 CHEMBL183660 IC50 81.0 nM
NC(=S)N/N=C(/C=C/c1ccccc1)c1cccc(C(F)(F)F)c1 CHEMBL404938 IC50 81.0 nM
N#CC1(NC(=O)[C@@H]2C[C@@H](S(=O)(=O)c3ccc(F)cc3Cl)CN2C(=O)C2(c3ncc(Cl)cc3F)CCN2)CC1 CHEMBL3671343 IC50 81.6 nM
N#CC1(NC(=O)[C@H](Cc2ccc(OC(F)(F)F)c(Cl)c2)NC(=O)c2cnn(-c3ccccc3)n2)CC1 CHEMBL4080286 Ki 81.7 nM
CN1CCN(CCCOc2ccccc2Nc2nc(C#N)nc3c2ncn3C2CCCC2)CC1 CHEMBL188139 IC50 82.0 nM
N#CC1(NC(=O)[C@H](Cc2ccc(OC(F)(F)F)c(Cl)c2)NC(=O)c2cnn(C3CCCCC3)n2)CC1 CHEMBL4095566 Ki 82.0 nM
N#CC1(NC(=O)[C@H](Cc2ccc(OC(F)(F)F)c(Cl)c2)NC(=O)c2cnn(-c3ccncc3)n2)CC1 CHEMBL4099235 Ki 82.0 nM
Cn1cc(-c2ccc(S(=O)(=O)[C@@H]3C[C@@H](C(=O)NC4(C#N)CC4)N(C(=O)C4(c5ncc(Cl)cc5F)CCN4)C3)c(Cl)c2)cn1 CHEMBL3671356 IC50 82.1 nM
CC(C)C[C@H](NC(=O)c1cc2ccccc2n1C)C(=O)N[C@H](C#N)COCc1ccccc1 CHEMBL208284 IC50 83.0 nM
O=C(N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)CF)OCc1ccccc1 CHEMBL2368566 IC50 83.7 nM
NC(=S)N/N=C(/c1cccc(Br)c1)c1cccc(F)c1F CHEMBL601644 IC50 83.8 nM
CC(C)C[C@H](N[C@@H](c1ccc(F)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1 CHEMBL4128887 IC50 84.0 nM
N#CC1(NC(=O)[C@H](CS(=O)(=O)Cc2ccc(F)cc2)N[C@@H](c2ccccc2)C(F)(F)F)CC1 CHEMBL400728 IC50 86.0 nM
N#Cc1ncc2cc(Cc3ccc(Cl)cc3)n(CCc3ccc(Cl)cc3)c2n1 CHEMBL521700 IC50 86.0 nM
COc1cccc(C[C@H](NC(=O)c2cccc(C(F)(F)F)c2)C(=O)NCC#N)c1 CHEMBL4127007 IC50 86.0 nM
Cc1cc(-c2ccc(S(=O)(=O)[C@@H]3C[C@@H](C(=O)NC4(C#N)CC4)N(C(=O)C4(c5ncc(Cl)cc5F)CCN4)C3)c(Cl)c2)ccn1 CHEMBL3671352 IC50 86.6 nM
CC(=O)O[C@@H]1NC(=O)[C@H]1NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1 CHEMBL292513 Ki 88.0 nM
Cc1cccc(C(=O)N[C@@H](CC(C)C)C(=O)NCCN2CCc3ccccc32)c1 CHEMBL205835 Ki 88.0 nM
N#CC1(NC(=O)[C@@H]2Cc3ccc(cc3)OC/C=C/COc3ccccc3C(=O)N2)CC1 CHEMBL4109839 IC50 88.5 nM
CN1CCN(CCn2cnc3c(NC4CCCCC4)nc(C#N)nc32)CC1 CHEMBL363847 IC50 89.0 nM
C[C@H](Oc1ccc(S(=O)(=O)[C@@H]2C[C@@H](C(=O)NC3(C#N)CC3)N(C(=O)C3(c4ncc(Br)cc4F)CN(C(=O)OC(C)(C)C)C3)C2)c(Cl)c1)C(F)(F)F CHEMBL3671345 IC50 89.5 nM
N#CC1(NC(=O)[C@@H]2C[C@@H](S(=O)(=O)c3ccc(OCC(F)(F)F)cc3Cl)CN2C(=O)C2(c3ccc(Cl)cn3)CNC2)CC1 CHEMBL3671327 IC50 89.8 nM
N#CC1(NC(=O)[C@@H]2C[C@@H](S(=O)(=O)c3ccc(F)cc3Cl)CN2C(=O)C2(c3ccc(Cl)cc3F)CC2)CC1 CHEMBL4107778 IC50 89.8 nM
N=C(N)NCCC[C@H](NC(=O)[C@H](Cc1ccccc1)C(=O)OCc1ccccc1)C(=O)C=O CHEMBL51128 Ki 90.0 nM
COc1ccc(NCCNC(=O)[C@H](CC(C)C)NC(=O)c2cc3ccccc3[nH]2)cc1 CHEMBL304918 IC50 90.0 nM
Cc1cc(C)cc(CC(NC(=O)C(c2ccccc2)c2ccccc2)C(=O)NCC#N)c1 CHEMBL477531 IC50 90.0 nM
C[C@H](Oc1ccc(S(=O)(=O)[C@@H]2CC(C(=O)NC3(C#N)CC3)N(C(=O)C3(c4ncc(Cl)cc4F)CC3)C2)c(Cl)c1)C(F)(F)F CHEMBL3927257 IC50 90.0 nM
CCOC(=O)/C=C/C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)N1CCOCC1 CHEMBL4237990 IC50 90.0 nM
CC(=O)/C=C/[C@H](CCc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)Cc1ccc2c(c1)OCO2 CHEMBL4454883 Ki 90.3 nM
N#CC1(NC(=O)[C@@H]2C[C@@H](S(=O)(=O)c3ccccc3-n3cccn3)CN2C(=O)C2(c3ncc(I)cc3F)CC2)CC1 CHEMBL4108321 IC50 90.6 nM
CC(C)CO[C@@H]1NC(=O)[C@H]1NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 CHEMBL31363 IC50 91.0 nM
N#Cc1ncc(F)c(N(CCCc2noc(-c3ccccc3)n2)Cc2ccc3c(c2)OCO3)n1 CHEMBL4082899 Ki 91.0 nM
N#CC1(NC(=O)[C@@H]2C[C@@H](S(=O)(=O)c3ccc(OCC(F)(F)F)cc3Cl)CN2C(=O)C2(c3ccc(Br)cn3)CN(CC(F)F)C2)CC1 CHEMBL3671330 IC50 91.7 nM
Cc1cccc(C(=O)N[C@@H](CC(C)C)C(=O)NCCNc2ccc(Cl)cc2)c1 CHEMBL379901 Ki 92.0 nM
CC(C)(C)c1cccc(C(=O)N[C@@H](Cc2cccc(O)c2)C(=O)NCC#N)c1 CHEMBL4126455 IC50 92.0 nM
O=C(N[C@@H](Cc1ccccc1)C(=O)NC1CC(=O)N(CCc2ccccc2)CC1=O)OCc1ccccc1 CHEMBL100702 Ki 93.0 nM
N#CC1(NC(=O)[C@H](Cc2ccc(Cl)c(Cl)c2)NC(=O)c2cnn(C3CCOCC3)n2)CC1 CHEMBL4064430 Ki 93.0 nM
CC(C)C[C@H](N[C@@H](c1ccc(F)cc1)C(F)(F)F)C(=O)NCC#N CHEMBL4126546 IC50 93.0 nM
CCC(C)[C@H](NS(=O)(=O)c1cccc2ccccc12)C(=O)NCC=O CHEMBL135471 IC50 95.0 nM
CC(C)(C)Cn1c(Cc2ccc(Cl)cc2)cc2cnc(C#N)nc21 CHEMBL250589 IC50 96.0 nM
NC(=S)N/N=C(/c1cccc(Br)c1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 CHEMBL603084 IC50 96.0 nM
N#CC1(NC(=O)[C@@H]2Cc3ccc(c(Cl)c3)OCCCCOc3ccccc3C(=O)N2)CC1 CHEMBL3939597 IC50 96.2 nM
N#CC1(NC(=O)[C@H](Cc2ccccc2)NS(=O)(=O)c2cccc(-c3ccccc3)c2)CC1 CHEMBL4743577 Ki 96.3 nM
CS(=O)(=O)CC[C@@H](CNc1ccc(OC(F)(F)F)cc1)NC(=O)[C@@H](CC(=O)N1CCOCC1)CC1CCCCC1 CHEMBL241467 Ki 98.0 nM
CS(=O)(=O)CCC(CNc1ccc(OC(F)(F)F)cc1)NC(=O)C(CC(=O)N1CCOCC1)CC1CCCCC1 CHEMBL493231 Activity 98.0 nM
CC(C)[C@H](N[C@@H](c1ccc(-c2ccc(C3(C(N)=O)CC3)cc2)cc1)C(F)(F)F)C(=O)N[C@H](C#N)Cc1ccc(C#N)cc1F CHEMBL1288531 IC50 98.0 nM
Cn1cc(-c2ccc(S(=O)(=O)[C@@H]3C[C@@H](C(=O)NC4(C#N)CC4)N(C(=O)C4(c5ncc(Br)cc5F)CCN4)C3)c(Cl)c2)cn1 CHEMBL3671357 IC50 98.9 nM
CC(C)C[C@H](NC(=O)c1ccc(-c2ccccc2)cc1)C(=O)NC1(C#N)CCS(=O)(=O)CC1 CHEMBL4228926 IC50 99.0 nM