c1cc(-c2cnc3c(c2)C[C@@]2(CN4CCC2CC4)O3)co1 CHEMBL2151438 Ki 0.03 nM
CN1C[C@H]2CN(c3ccc4c(c3)C(=O)c3cc(N5C[C@@H]6CN([11CH3])[C@@H]6C5)ccc3-4)C[C@H]21 CHEMBL3235498 Ki 0.092 nM
c1cc2cc(-c3ccc(O[C@H]4CN5CCC4CC5)nn3)ccc2[nH]1 CHEMBL2151570 Ki 0.2 nM
CN1CC2CN(c3ccc(-c4ccc5[nH]ccc5c4)nn3)CC2C1 CHEMBL2151569 Ki 0.24 nM
[11CH3]N1CC2CN(c3ccc(-c4ccc5[nH]ccc5c4)nn3)CC2C1 CHEMBL3235495 Ki 0.24 nM
C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)[C@H](CS)NC(=O)CNC(=O)CN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CS)C(N)=O CHEMBL412032 IC50 0.3 nM
O=C(N[C@@H]1C2CCN(CC2)[C@H]1Cc1cccnc1)c1ccc(I)s1 CHEMBL2179874 Ki 0.51 nM
C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)[C@H](CS)NC(=O)CN)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C=O)CS)[C@@H](C)O CHEMBL429557 IC50 0.75 nM
O=C(N[C@@H]1C2CCN(CC2)[C@H]1Cc1cccnc1)c1ccc(-c2ccccc2)s1 CHEMBL2179875 Ki 0.8 nM
O=C(N[C@@H]1C2CCN(CC2)[C@H]1Cc1cccnc1)c1ccc(-c2ccccn2)s1 CHEMBL2179877 Ki 0.9 nM
CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)C[C@H](C)C3=O)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14 CHEMBL510275 pKi 1.0 nM
O=C(N[C@@H]1C2CCN(CC2)[C@H]1Cc1cccnc1)c1cc2ccccc2o1 CHEMBL1258006 Ki 1.0 nM
Clc1cnc2nc(N3CCN4CCC3CC4)oc2c1 CHEMBL597241 Ki 1.0 nM
c1cncc(C[C@H]2[C@H](Oc3ccc(-c4ccc5[nH]ccc5c4)nn3)C3CCN2CC3)c1 CHEMBL5276123 Ki 1.0 nM
C[N+]1(C)CC[C@@H](Oc2ccc(-c3ccc4[nH]ccc4c3)cc2)C1 CHEMBL5393773 Ki 1.0 nM
CN1CCC[C@@H]1c1cccnc1 CHEMBL9732 Kd 1.06 nM
c1cncc([C@@H]2CCCN2)c1 CHEMBL6200 Kd 1.06 nM
Clc1ccc(C2CC3CCC2N3)cn1 CHEMBL6623 Kd 1.06 nM
c1cc2c(cn1)C1CCC(CC2)N1 CHEMBL149667 Kd 1.06 nM
Cc1cc2c(cn1)C1CCC(CC2)N1 CHEMBL366923 Kd 1.06 nM
CC(C)C[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]2CSSC[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](CSSC[C@@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc3cnc[nH]3)NC(=O)[C@@H]3CCCN3C(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC1=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N2 CHEMBL2151573 IC50 1.09 nM
CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)[C@H](CS)NC(=O)CN)C(=O)N[C@@H](CS)C(N)=O CHEMBL437423 IC50 1.1 nM
O=C(NC1CN2CCC1CC2)c1ccc(-c2cccs2)s1 CHEMBL195190 Ki 1.1 nM
O=C(N[C@@H]1C2CCN(CC2)[C@H]1Cc1cccnc1)c1ccc(Br)s1 CHEMBL2179873 Ki 1.1 nM
C1=C(c2cccnc2)C[C@H]2CNC[C@@H]1C2 CHEMBL2177538 Ki 1.2 nM
O=C(N[C@@H]1C2CCN(CC2)[C@H]1Cc1cccnc1)c1ccc(-c2cccs2)s1 CHEMBL2179878 Ki 1.2 nM
O=C(N[C@H]1CN2CCC1CC2)c1ccc(-c2ccccn2)s1 CHEMBL364069 Ki 1.3 nM
C1=C(c2cccnc2)C[C@@H]2CNC[C@H]1C2 CHEMBL2177537 Ki 1.3 nM
c1ccc2cc(NC3=NC[C@@]4(CN5CCC4CC5)O3)ncc2c1 CHEMBL3918431 Ki 1.3 nM
C[N+]1(C)CC[C@H](Oc2ccc(/C=C/c3ccccc3)cc2)C1 CHEMBL5201239 IC50 1.48 nM
C[N+]1(C)CC[C@@H](Oc2ccc(/C=C/c3ccccc3)cc2)C1 CHEMBL5178473 IC50 1.49 nM
CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)[C@H](CS)NC(=O)CN)[C@@H](C)O)C(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CS)C(=O)NCC(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@H](C=O)CCCN=C(N)N CHEMBL411146 IC50 1.5 nM
O=C(N[C@H]1CN2CCC1CC2)c1ccc2occc2c1 CHEMBL378471 Ki 1.6 nM
c1cncc(N2CC3CNCC(C3)C2)c1 CHEMBL2177512 Ki 1.6 nM
Fc1cncc(C2=C[C@@H]3CNC[C@H](C2)C3)c1 CHEMBL2177553 Ki 1.6 nM
O=C(N[C@H]1CN2CCC1CC2)c1ccc(-c2ccccc2)s1 CHEMBL370535 Ki 1.8 nM
O=C(N[C@@H]1C2CCN(CC2)[C@H]1Cc1cccnc1)c1cc2cc(O)ccc2o1 CHEMBL2180253 Ki 1.8 nM
CC[N+](CC)(CC)CCOc1ccc(/C=C/c2ccccc2)cc1 CHEMBL1257065 IC50 1.99 nM
O=C(Cn1nc(C2CCCCC2)cc(Cc2ccco2)c1=O)NCCc1cccc(F)c1 CHEMBL1210516 pEC50 1.995 nM
O=C(Cn1nc(C2CCCCC2)cc(Cc2ccco2)c1=O)NC1Cc2ccccc2C1 CHEMBL1210515 pEC50 1.995 nM
Nc1cccc2cc(C(=O)N[C@H]3CN4CCC3CC4)sc12 CHEMBL3699100 Ki 2.0 nM
c1ccc(-c2cnc3c(c2)C[C@@]2(CN4CCC2CC4)O3)cc1 CHEMBL195345 Ki 2.0 nM
C[N+]1(CCOc2ccc(/C=C/c3ccccc3)cc2)CCCC1 CHEMBL5190813 IC50 2.04 nM
O=C(N[C@H]1CN2CCC1CC2)c1ccc2ccsc2c1 CHEMBL378349 Ki 2.1 nM
COc1ccc2oc(C(=O)N[C@@H]3C4CCN(CC4)[C@H]3Cc3cccnc3)cc2c1 CHEMBL2179881 Ki 2.1 nM
Cc1c(C(=O)N[C@@H]2C3CCN(CC3)[C@H]2Cc2cccnc2)oc2ccccc12 CHEMBL2180250 Ki 2.2 nM
C[N+]1(CCOc2ccc(/C=C/c3ccccc3)cc2)CCCCC1 CHEMBL5176101 IC50 2.29 nM
C[N+]1(CCOc2ccc(/C=C/c3ccccc3)cc2)CCC1 CHEMBL5174508 IC50 2.45 nM
FCCn1ccc2ccc(-c3nnc(N4CCN5CCC4CC5)o3)cc21 CHEMBL2380928 Ki 2.5 nM
O=C(Nc1ccc(Br)cc1)O[C@@H]1C2CCN(CC2)[C@H]1Cc1cccnc1 CHEMBL1258240 pKi 2.692 nM
C(=C/c1ccc(OCC[N+]23CCC(CC2)CC3)cc1)\c1ccccc1 CHEMBL5177606 IC50 2.75 nM
O=C(N[C@@H]1C2CCN(CC2)[C@H]1Cc1cccnc1)c1cc2ccccc2cn1 CHEMBL2179862 Ki 2.8 nM
Nc1ccc2cc(C(=O)N[C@H]3CN4CCC3CC4)sc2c1 CHEMBL3699101 Ki 2.8 nM
c1cnc2c(c1)C[C@@]1(CN3CCC1CC3)O2 CHEMBL2151437 Ki 3.0 nM
Cc1ccc(C(=O)N[C@@H]2C3CCN(CC3)[C@H]2Cc2cccnc2)s1 CHEMBL2151441 Ki 3.0 nM
O=C(N[C@H]1CN2CCC1CC2)c1cc2cccc(F)c2s1 CHEMBL3699095 Ki 3.1 nM
O=C(Cn1nc(C2CCCCC2)cc(Cc2ccoc2)c1=O)NC1Cc2ccccc2C1 CHEMBL1210517 pEC50 3.162 nM
Cc1nc2nc(N3CCN4CCC3CC4)oc2cc1Cl CHEMBL603052 Ki 3.2 nM
Fc1cncc(C2=C[C@H]3CNC[C@@H](C2)C3)c1 CHEMBL2177552 Ki 3.3 nM
O=C(NC1CN2CCC1CC2)c1ccc(-c2ccccc2)s1 CHEMBL194100 Ki 3.4 nM
O=C(N[C@H]1CN2CCC1CC2)c1ccc(-c2ccccc2)s1 CHEMBL195329 Ki 3.4 nM
Fc1cncc(C2=CC3CNCC(C2)C3)c1 CHEMBL2177551 Ki 3.6 nM
Nc1ccc2cc(C(=O)N[C@H]3CN4CCC3CC4)oc2c1 CHEMBL3699088 Ki 3.7 nM
O=C(N[C@@H]1C2CCN(CC2)[C@H]1Cc1cccnc1)c1cc2cc(Cl)ccc2o1 CHEMBL2179879 Ki 3.8 nM
O=C(N[C@H]1CN2CCC1CC2)c1cc2ccccc2s1 CHEMBL3699094 Ki 3.9 nM
C1=C(c2cccnc2)CC2CNCC1C2 CHEMBL2177536 Ki 4.0 nM
O=C(NC1CN2CCC1CC2)c1cc(-c2ccccc2)sn1 CHEMBL372041 Ki 4.1 nM
O=C(N[C@H]1CN2CCC1CC2)c1cc2cccc(Cl)c2s1 CHEMBL2151572 Ki 4.3 nM
O=C(/C=C/c1ccccc1)N[C@@H]1C2CCN(CC2)[C@H]1Cc1cccnc1 CHEMBL2179871 Ki 4.3 nM
Clc1ccc2c(n1)O[C@]13CC[C@H]1NC[C@H]23 CHEMBL4290888 Ki 4.4 nM
Cc1ccsc1/C=C/C(=O)N[C@@H]1C2CCN(CC2)[C@H]1Cc1cccnc1 CHEMBL2179872 Ki 4.5 nM
COc1cncc(C2=CC3CNCC(C2)C3)c1 CHEMBL2177541 Ki 4.6 nM
O=C(N[C@@H]1C2CCN(CC2)[C@H]1Cc1cccnc1)c1cc2cc(F)ccc2o1 CHEMBL2180254 Ki 4.7 nM
O=C(N[C@@H]1C2CCN(CC2)[C@@H]1Cc1cccnc1)c1cc2ccccc2o1 CHEMBL194082 Ki 4.98 nM
CC[C@H](C)[C@H](N)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1C[C@H](O)C[C@H]1C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)N[C@@H](CS)C(N)=O)C(C)C)C(C)C CHEMBL2371820 IC50 5.0 nM
Cc1ccc2oc(C(=O)N[C@@H]3C4CCN(CC4)[C@H]3Cc3cccnc3)cc2c1 CHEMBL2180251 Ki 5.0 nM
C[C@@H]1C[C@@H]1C(=O)N1CC2CNCC(C2)C1 CHEMBL2409491 Ki 5.0 nM
O=C(Nc1ccc(Br)cc1)OC1C2CCN(CC2)C1Cc1cccnc1 CHEMBL2151571 Ki 5.0 nM
Clc1ccc2c(n1)OC13CCC1NCC23 CHEMBL4283703 Ki 5.4 nM
Cc1ccc2cc(C(=O)N[C@@H]3C4CCN(CC4)[C@H]3Cc3cccnc3)oc2c1 CHEMBL2180252 Ki 5.5 nM
COc1cccc2cc(C(=O)N[C@@H]3C4CCN(CC4)[C@H]3Cc3cccnc3)oc12 CHEMBL2179882 Ki 5.9 nM
O=C(N[C@@H]1C2CCN(CC2)[C@H]1Cc1cccnc1)c1ccc(-c2ccccc2)o1 CHEMBL2179868 Ki 5.9 nM
O=C(N[C@@H]1CN2CCC1CC2)c1n[nH]c2ccccc12 CHEMBL2151439 Ki 6.0 nM
O=C(N[C@@H]1C2CCN(CC2)[C@H]1Cc1cccnc1)c1ccc(Br)cc1 CHEMBL1258005 Ki 6.0 nM
c1cncc(OC[C@H]2CNCCN2c2nc3ncccc3o2)c1 CHEMBL3302240 IC50 6.0 nM
O=C(N[C@@H]1C2CCN(CC2)[C@H]1Cc1cccnc1)c1occc1Br CHEMBL2179865 Ki 6.2 nM
O=C(Cc1nc(C2CCCCC2)c2ccccc2n1)NC1Cc2ccccc2C1 CHEMBL1210576 pEC50 6.31 nM
COc1ccc(C(=O)N[C@@H]2C3CCN(CC3)[C@H]2Cc2cccnc2)cc1 CHEMBL2179844 Ki 6.4 nM
CC[N+](CC)(CC)CCCCOc1ccc(/C=C/c2ccccc2)cc1 CHEMBL4291079 IC50 6.5 nM
COc1cccc2cc(C(=O)N[C@H]3CN4CCC3CC4)sc12 CHEMBL3699103 Ki 6.7 nM
O=C(NC1CN2CCC1CC2)c1ccc(-c2ccccn2)s1 CHEMBL188469 Ki 6.9 nM
CN1[C@@H]2CC[C@H]1C[C@@H](OC(=O)c1c[nH]c3ccccc13)C2 CHEMBL56564 Ki 6.9 nM
O=C(N[C@H]1CN2CCC1CC2)c1cc2ccoc2cn1 CHEMBL214268 Ki 7.0 nM
O=C(Nc1ccccc1)OC1C2CCN(CC2)C1Cc1cccnc1 CHEMBL3640294 Ki 7.0 nM
Fc1ccc(Oc2cncc(C3=CC4CNCC(C3)C4)c2)cc1 CHEMBL2177514 Ki 7.2 nM
CN1C(=O)[C@@H](CN2CCCCC2)C[C@H]1C#Cc1ccc2c(ccn2C)c1 CHEMBL459689 pEC50 7.943 nM
CN1C(=O)[C@@H](CN2CCCCC2)C[C@H]1C#Cc1ccc2occc2c1 CHEMBL459900 pEC50 7.943 nM
CN1C(=O)[C@@H](CN2CCCCC2)C[C@H]1C#Cc1ccc2c(c1)CCO2 CHEMBL503427 pEC50 7.943 nM
O=C(Cn1nc(C2CCCCC2)c2ccccc2c1=O)NC1Cc2ccccc2C1 CHEMBL1210577 pEC50 7.943 nM
CC(C)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)[C@H](CS)NC(=O)CN)C(C)C)C(=O)N[C@@H](CS)C(N)=O CHEMBL265198 IC50 8.0 nM
c1cn(-c2cc(NC3=NC[C@@]4(CN5CCC4CC5)O3)ncn2)cn1 CHEMBL4084621 Ki 8.1 nM
c1cncc(CNc2cnc3c(c2)C[C@@]2(CN4CCC2CC4)O3)c1 CHEMBL193329 Ki 8.3 nM
c1ccc(-c2ccc(N3CC4CNCC4C3)cn2)cc1 CHEMBL2151444 Ki 8.4 nM
c1ccc(-c2ccc[n+](CCCCCc3cc(CCCCC[n+]4cccc(-c5ccccc5)c4)cc(CCCCC[n+]4cccc(-c5ccccc5)c4)c3)c2)cc1 CHEMBL267841 IC50 8.8 nM
O=C(N[C@@H]1C[C@H]2CCN(C2)C1)c1cc2ccoc2cn1 CHEMBL403858 Ki 9.0 nM
O=C1O[C@]2(CN3CCC2CC3)CN1c1ccc(Cl)s1 CHEMBL192704 Ki 9.0 nM
O=C(NC1C2CCN(CC2)C1Cc1cccnc1)c1ccc(Sc2ccccc2)cc1 CHEMBL3640295 Ki 9.0 nM
CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)[C@H](CS)NC(=O)CN)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CS)C(N)=O CHEMBL409988 IC50 9.6 nM
CN1CC2CN(c3ccc(-c4ccccc4)nc3)CC2C1 CHEMBL2151445 Ki 9.6 nM
Oc1ccc(-c2cn(C3CN4CCC3CC4)nn2)cc1 CHEMBL4472617 Ki 9.61 nM
[N-]=[N+]=Nc1cc(C2CC3CCC2N3)cnc1Cl CHEMBL55716 Ki 9.7 nM
CN1C(=O)[C@@H](CN2CCCCC2)C[C@H]1C#Cc1ccccc1 CHEMBL454407 pEC50 10.0 nM
O=C(Cn1nc(C2CCCCC2)c2ccccc2c1=O)NCCc1ccccc1 CHEMBL1210579 pEC50 10.0 nM
O=C(Cn1nc(C2CCC(F)(F)CC2)c2cnccc2c1=O)NC1Cc2ccccc2C1 CHEMBL1210578 pEC50 10.0 nM
COc1ccc(Cc2cc(C3CCCCC3)nn(CC(=O)NC3Cc4ccccc4C3)c2=O)cn1 CHEMBL1210518 pEC50 10.0 nM
O=C([C@@H]1C[C@H]1F)N1CC2CNCC(C2)C1 CHEMBL2409487 Ki 10.0 nM
Oc1ccc(-c2cn([C@H]3CN4CCC3CC4)nn2)cc1 CHEMBL4535466 Ki 10.9 nM
COc1ccc(NC(=O)N2CCNCC2COc2cccnc2)cc1 CHEMBL3302229 IC50 11.0 nM
c1cncc(C[C@@H]2[C@@H](Oc3nnc(-c4ccc5[nH]ccc5c4)s3)C3CCN2CC3)c1 CHEMBL5266111 Ki 11.1 nM
O=C(N[C@@H]1C2CCN(CC2)[C@H]1Cc1cccnc1)c1cc2cc(Br)ccc2o1 CHEMBL2179880 Ki 11.2 nM
Cc1c(C(=O)N[C@@H]2C3CCN(CC3)[C@H]2Cc2cccnc2)oc2ccc(Cl)cc12 CHEMBL2180258 Ki 11.5 nM
Fc1ccc(-c2nnc(N3CCN4CCC3CC4)o2)cc1 CHEMBL2380802 Ki 11.6 nM
[18F]c1ccc(-c2nnc(N3CCN4CCC3CC4)o2)cc1 CHEMBL2380803 Ki 11.6 nM
Clc1ccc(C2=CCCC3CCC2N3)cn1 CHEMBL63102 Ki 12.0 nM
Cc1c(C(=O)N[C@@H]2C3CCN(CC3)[C@H]2Cc2cccnc2)oc2ccc(F)cc12 CHEMBL2180255 Ki 12.3 nM
CC[N+](CC)(CC)CCCCCCOc1ccc(/C=C/c2ccccc2)cc1 CHEMBL4293646 IC50 12.3 nM
O=C(N[C@H]1CN2CCC1CC2)c1ccc2ccoc2c1 CHEMBL379302 Ki 12.5 nM
c1ccc2sc(CO[C@@H]3CN4CCC3CC4)cc2c1 CHEMBL125069 Ki 13.0 nM
Clc1cccc(Oc2cncc(C3=CC4CNCC(C3)C4)c2)c1 CHEMBL2178157 Ki 13.0 nM
COc1cccc(Oc2cncc(C3=CC4CNCC(C3)C4)c2)c1 CHEMBL2178160 Ki 13.0 nM
O=C(Oc1ccc(Br)cc1)N1CCN2CCC1CC2 CHEMBL559478 Ki 14.0 nM
[11CH3]c1ccc(OC(=O)N2CCN3CCC2CC3)cc1 CHEMBL3235496 Ki 14.0 nM
O=C(NC1CN2CCC1CC2)c1cc2ccccc2s1 CHEMBL365323 Ki 14.6 nM
O=C(N[C@H]1CN2CCC1CC2)c1cc2cccc(Br)n2c1 CHEMBL3786240 Ki 14.9 nM
Clc1cncc(C2=CC3CNCC(C2)C3)c1 CHEMBL2177555 Ki 15.0 nM
O=C(N[C@@H]1C2CCN(CC2)[C@H]1Cc1cccnc1)c1ccc(Cl)cc1 CHEMBL2179842 Ki 15.0 nM
Cc1cc2cc(CNC(=O)N3CC(COc4ccc(C(F)(F)F)cc4)C3)ccc2[nH]1 CHEMBL5418230 EC50 15.0 nM
Cc1ccc2oc(C(=O)N[C@@H]3C4CCN(CC4)[C@H]3Cc3cccnc3)c(C)c2c1 CHEMBL2180257 Ki 15.7 nM
Cc1ccccc1C#C[C@@H]1C[C@H](CN2CCCCC2)C(=O)N1C CHEMBL459904 pEC50 15.85 nM
O=C(Nc1ccc(-c2nnc(NCCCN3CCN4CCC3CC4)o2)cc1)c1ccccc1F CHEMBL2021936 pEC50 15.85 nM
O=C(Nc1ccc(-c2nnc(NCCCCN3CCCC3)o2)cc1)c1ccccc1F CHEMBL2022731 pEC50 15.85 nM
Cc1ccc2oc(N3CCN4CCC3CC4)nc2n1 CHEMBL604798 Ki 16.4 nM
O=C(NC1CN2CCC1CC2)c1csc(-c2ccccc2)c1 CHEMBL195800 Ki 16.7 nM
CN1CC2CN(c3ccc(-c4ccccc4)nn3)CC2C1 CHEMBL2151443 Ki 17.0 nM
CN1CC2C=C(c3cncc(Oc4ccccc4)c3)CC(C2)C1 CHEMBL2177546 Ki 17.0 nM
O=[N+]([O-])c1ccc(C[N+]23CC[C@@H]4[C@@H]5[C@@H]6[C@@H](OCC=C(C2)[C@@H]6C[C@@H]43)N2c3ccccc3[C@@]34CC[N+]6(Cc7ccc([N+](=O)[O-])cc7)CC7=CCO[C@H]([C@@H]([C@H]23)[C@H]7C[C@@H]46)N5c2ccccc2)cc1 CHEMBL229998 Ki 18.0 nM
c1cc2c(NC3=NC[C@@]4(CN5CCC4CC5)O3)nccn2c1 CHEMBL3963469 EC50 18.0 nM
O=C(Nc1ccccc1)O[C@@H]1C2CCN(CC2)[C@H]1Cc1cccnc1 CHEMBL1258126 pKi 18.62 nM
Nc1nc2ccc(-c3ccc(O[C@H]4C5CCN(CC5)[C@@H]4Cc4cccnc4)nn3)cc2s1 CHEMBL5281563 Ki 18.8 nM
C1=C(c2cncnc2)CC2CNCC1C2 CHEMBL2177518 Ki 19.0 nM
COc1ccc(NC(=O)N2CCNC[C@@H]2COc2cccnc2)cc1 CHEMBL3303977 IC50 19.0 nM
CC[N+](CC)(CC)CCOc1ccc(-c2ccc3[nH]ccc3c2)cc1 CHEMBL5417751 Ki 19.0 nM
COc1cc(NC(=O)c2ccccc2F)ccc1-c1nnc(NCCCCN2CCCCC2)o1 CHEMBL2022736 pEC50 19.95 nM
Fc1ccc(C2=CC3CNCC(C2)C3)cn1 CHEMBL2177522 Ki 20.0 nM
O=C(C1CC1)N1CC2CNCC(C2)C1 CHEMBL2179962 Ki 20.0 nM
O=C(N[C@@H]1C2CCN(CC2)[C@H]1Cc1cccnc1)c1ccc(Cl)c(Cl)c1 CHEMBL2179849 Ki 20.0 nM
O=C(N[C@@H]1CN2CCC1CC2)c1cc2cccc(F)c2s1 CHEMBL3699096 Ki 20.0 nM
O=C(N[C@H]1CN2CCC1CC2)c1cc2cccc(C(F)(F)F)c2s1 CHEMBL3699098 Ki 20.0 nM
COc1cccc2cc(C(=O)N[C@@H]3CN4CCC3CC4)sc12 CHEMBL3699104 Ki 20.0 nM
O=C(N[C@H]1CN2CCC1CC2)c1cc2ccc3ccccc3n2c1 CHEMBL4453847 IC50 21.25 nM
C1=C(c2cncc(Oc3ccccc3)c2)CC2CNCC1C2 CHEMBL2177545 Ki 22.0 nM
Clc1ccc([C@H]2C[C@@H]3CC[C@H]2N3)cn1 CHEMBL298826 Ki 22.0 nM
O=C(N[C@H]1CN2CCC1CC2)c1cc2cc(F)ccc2s1 CHEMBL3699102 Ki 22.0 nM
CCOc1cccc2cc(C(=O)N[C@@H]3C4CCN(CC4)[C@H]3Cc3cccnc3)oc12 CHEMBL2179883 Ki 22.1 nM
c1ccc2oc(N3CCN4CCC3CC4)nc2c1 CHEMBL611082 Ki 22.5 nM
c1ccc(COc2cccc(-c3cn([C@H]4CN5CCC4CC5)nn3)c2)cc1 CHEMBL4463888 Ki 22.5 nM
COc1cc(O)ccc1/C=C1\CCCN=C1c1cccnc1 CHEMBL1162395 Kd 23.0 nM
Clc1ccc(Oc2cncc(C3=CC4CNCC(C3)C4)c2)cc1 CHEMBL2177513 Ki 23.0 nM
COc1ccc(Oc2cncc(C3=CC4CNCC(C3)C4)c2)cc1 CHEMBL2178159 Ki 23.0 nM
CCCC[C@@H]1N[C@@H](CO)C(=O)NCC(=O)N[C@H]2CSSC[C@@H]3NC(=O)[C@H](C(C)C)NC(=O)[C@H](Cc4ccc(O)cc4)NC(=O)[C@H](Cc4cnc[nH]4)NC(=O)[C@H](Cc4c[nH]c5ccccc45)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](Cc4cnc[nH]4)NC(=O)CNC(=O)[C@@H]4CSSC[C@H](NC(=O)[C@@H]5CCCN5C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)[C@H](CSSC[C@H](NC(=O)[C@@H]5CCCN5C(=O)CN)C(=O)N[C@@H](CO)C(=O)N4)NC(=O)[C@H]([C@@H](C)O)NC3=O)C(=O)N[C@@H](CSSC[C@@H](C(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CCCNC(=N)N)N[C@@H](CCCC)C(=O)NC2=O)C(=O)NC1=O CHEMBL5176133 IC50 23.0 nM
N[C@@H]1[C@@H]2CC[C@@H](C2)[C@H]1c1ccc(Cl)nc1 CHEMBL4582201 EC50 24.0 nM
O=C(N[C@@H]1C2CCN(CC2)[C@H]1Cc1cccnc1)c1ccc2c(c1)OCCO2 CHEMBL2179851 Ki 24.1 nM
CC[N+](CC)(CC)CCCCOc1ccc(/C=C/c2cc(OC)cc(OC)c2)cc1 CHEMBL4280452 IC50 24.3 nM
O=C(N[C@H]1CN2CCC1CC2)c1ccc(Cl)cc1 CHEMBL177611 pKi 24.55 nM
CCCn1cnc2cc3c(cc21)C1CNCC3C1 CHEMBL199152 Ki 25.0 nM
Cn1ccc2cc(CNC(=O)N3CC(COc4ccc(OC(F)(F)F)cc4)C3)ccc21 CHEMBL4870678 EC50 25.0 nM
CN1C(=O)[C@@H](CN2CCCCC2)C[C@H]1c1cnc(-c2ccccc2Cl)s1 CHEMBL516818 pEC50 25.12 nM
CN1C(=O)[C@@H](CN2CCCCC2)C[C@H]1C#Cc1ccccc1Cl CHEMBL503573 pEC50 25.12 nM
O=C(Cc1nc(-c2ccc3c(c2)OCO3)c2ccccc2n1)NC1Cc2ccccc2C1 CHEMBL1210643 pEC50 25.12 nM
O=C(Cc1nc(C2CCCCC2)c2ccsc2n1)NC1Cc2ccccc2C1 CHEMBL1210642 pEC50 25.12 nM
O=C(Cn1nc(-c2ccc(Cl)cc2)c2cc(F)ccc2c1=O)NC1Cc2ccccc2C1 CHEMBL1210641 pEC50 25.12 nM
O=C(Nc1ccc(Br)cc1)N[C@@H]1C2CCN(CC2)[C@H]1Cc1cccnc1 CHEMBL1258241 pKi 25.7 nM
c1ccc2sc(NC3=NCC4(CN5CCC4CC5)N3)nc2c1 CHEMBL4080813 EC50 26.0 nM
O=C(N[C@@H]1CN2CCC1CC2)c1ccc(-c2ccccc2)s1 CHEMBL194984 Ki 26.9 nM
O=C1O[C@]2(CN3CCC2CC3)CN1c1ccc2sccc2c1 CHEMBL2113232 Ki 28.0 nM
CC(=O)Nc1ccc2cc(C(=O)N[C@H]3CN4CCC3CC4)sc2c1 CHEMBL3699107 Ki 28.0 nM
O=C(Nc1ccccc1)N[C@@H]1C2CCN(CC2)[C@H]1Cc1cccnc1 CHEMBL1258127 pKi 28.84 nM
O=C(N[C@@H]1C2CCN(CC2)[C@H]1Cc1cccnc1)c1cc2cccc(-c3ccccn3)c2o1 CHEMBL2180263 Ki 29.0 nM
Oc1ccc(-c2cn([C@@H]3CN4CCC3CC4)nn2)cc1 CHEMBL4453542 Ki 29.3 nM
CSCC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)[C@H](CS)NC(=O)CN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CS)C(N)=O CHEMBL451252 IC50 30.0 nM
C=CC[N+]12CC[C@@H]3[C@@H]4[C@@H]5[C@@H](OCC=C(C1)[C@@H]5C[C@@H]32)N1c2ccccc2[C@@]23CC[N+]5(CC=C)CC6=CCO[C@H]([C@@H]([C@H]12)[C@H]6C[C@@H]35)N4c1ccccc1 CHEMBL390135 Ki 30.0 nM
COc1ccccc1Oc1cncc(C2=CC3CNCC(C2)C3)c1 CHEMBL2177109 Ki 30.0 nM
O=C(N[C@@H]1C2CCN(CC2)[C@H]1Cc1cccnc1)c1ccc(Cl)cn1 CHEMBL2179857 Ki 30.0 nM
C[C@@H]1C[C@H]1C(=O)N1CC2CNCC(C2)C1 CHEMBL2409489 Ki 30.0 nM
COc1ccc(-c2cc(N(Cc3ccccn3)Cc3ccccn3)nc(N)n2)c(F)c1 CHEMBL4441937 EC50 30.0 nM
c1cnc2nc(N3CCN4CCC3CC4)oc2c1 CHEMBL597843 Ki 30.3 nM
O=C(N[C@@H]1C2CCN(CC2)[C@H]1Cc1cccnc1)c1ccc(F)cc1 CHEMBL2179839 Ki 31.0 nM
Cn1ccc2c(NC3=NC[C@@]4(CN5CCC4CC5)O3)ncnc21 CHEMBL3891441 EC50 31.0 nM
O=C(N[C@H]1CN2CCC1CC2)c1cc2cc(F)cc(F)c2s1 CHEMBL3699106 Ki 31.0 nM
CN1C(=O)[C@@H](CN2CCCCC2)C[C@H]1c1ccc(-c2ccccc2Cl)s1 CHEMBL462449 pEC50 31.62 nM
O=C(Cn1nc(C2CCC(F)(F)CC2)c2ccccc2c1=O)NCCOc1ccccc1 CHEMBL1210640 pEC50 31.62 nM
O=C(Nc1ccc(-c2nnc(NCCCCN3CCCCC3)o2)cc1)c1ccccc1F CHEMBL2022733 pEC50 31.62 nM
O=C(Nc1ccc(-c2nnc(NCCCCN3CCCCC3)o2)cc1)c1ccccc1 CHEMBL2022734 pEC50 31.62 nM
Clc1ccncc1C1=CC2CNCC(C1)C2 CHEMBL2177530 Ki 33.0 nM
Fc1ccc(COc2cccc(-c3cn([C@H]4CN5CCC4CC5)nn3)c2)cc1 CHEMBL4521227 Ki 33.2 nM
Cc1c(C(=O)N[C@@H]2C3CCN(CC3)[C@H]2Cc2cccnc2)oc2c(F)cccc12 CHEMBL2180256 Ki 33.8 nM
CC[N+](C)(CC)CCOc1ccc(/C=C/c2ccccc2)cc1 CHEMBL5192210 Ki 34.0 nM
c1cncc(C[C@@H]2[C@@H](Oc3ccc(-c4ccc5[nH]ccc5c4)nn3)C3CCN2CC3)c1 CHEMBL5279722 Ki 34.0 nM
CC[N+](CC)(CC)CCOc1ccc(-c2nc3ccccc3[nH]2)cc1 CHEMBL5433741 Ki 34.0 nM
Cc1ccc2nc(NC3=NCC4(CN5CCC4CC5)N3)oc2c1 CHEMBL4086223 EC50 35.0 nM
COc1c(C(=O)N[C@@H]2C3CCN(CC3)[C@H]2Cc2cccnc2)oc2ccc(Cl)cc12 CHEMBL2180260 Ki 36.1 nM
O=C(N[C@H]1CN2CCC1CC2)c1cc2cc(F)ccc2o1 CHEMBL3699091 Ki 37.0 nM
O=C(N[C@@H]1C2CCN(CC2)[C@H]1Cc1cccnc1)Oc1ccccc1 CHEMBL1258358 pKi 37.15 nM
FCCOc1cccc(-c2cn([C@H]3CN4CCC3CC4)nn2)c1 CHEMBL4474896 Ki 38.8 nM
O=C(Nc1ccc(Br)cc1)O[C@H]1CN2CCC1CC2 CHEMBL1255908 pKi 38.9 nM
Clc1ccccc1Oc1cncc(C2=CC3CNCC(C2)C3)c1 CHEMBL2178158 Ki 39.0 nM
Clc1ccc(C2=CC3CNCC(C2)C3)cn1 CHEMBL2177524 Ki 39.0 nM
Cc1ccc(-c2ccc(O[C@H]3CN4CCC3CC4)cn2)cc1 CHEMBL4532388 EC50 39.0 nM
Clc1ccc([C@@H]2C[C@H]3CC[C@@H]2N3)cn1 CHEMBL298517 pEC50 39.81 nM
O=C(Nc1ccc(-c2nnc(NCCCCN3CCCCC3)o2)c(Cl)c1)c1ccccc1F CHEMBL2022737 pEC50 39.81 nM
O=C(C1CC1)N1C[C@H]2CN[C@@H](C2)C1 CHEMBL2179964 Ki 40.0 nM
c1cncc(C2CC3CCN2CC3)c1 CHEMBL105374 Ki 40.0 nM
c1nc(NC2=NC[C@@]3(CN4CCC3CC4)O2)c2sccc2n1 CHEMBL3928422 EC50 40.0 nM
O=C(Nc1ccc(Br)cc1)OC1CN2CCC1CC2 CHEMBL372419 Ki 40.0 nM
Cc1ccc(Oc2ccc(C(=O)NCc3ccc4c(ccn4C)c3)cc2)cc1 CHEMBL4859529 EC50 40.0 nM
Cc1ccc(OCC2CN(C(=O)NCc3ccc4c(ccn4C)c3)C2)cc1 CHEMBL4876566 EC50 40.0 nM
Cn1ccc2cc(CNC(=O)N3CC(COc4ccc(C(F)(F)F)cn4)C3)ccc21 CHEMBL5415568 EC50 40.0 nM
c1cc2c(NC3=NC[C@@]4(CN5CCC4CC5)O3)ncnn2c1 CHEMBL3957600 EC50 41.0 nM
Cc1ccc2c(NC3=NC[C@@]4(CN5CCC4CC5)O3)ncnn12 CHEMBL3907100 EC50 41.0 nM
COc1cccc2cc(C(=O)N[C@H]3CN4CCC3CC4)oc12 CHEMBL3699087 Ki 42.0 nM
c1cncc(C[C@@H]2[C@@H](Oc3ccc(-c4ccc[nH]4)nn3)C3CCN2CC3)c1 CHEMBL5284592 Ki 42.0 nM
O=C(N[C@@H]1C2CCN(CC2)[C@H]1Cc1cccnc1)c1cccs1 CHEMBL1258125 pKi 43.65 nM
O=C(Nc1ccc(Br)cc1)N[C@H]1CN2CCC1CC2 CHEMBL1256000 pKi 43.65 nM
C1=C(c2cncc(OCc3ccccc3)c2)CC2CNCC1C2 CHEMBL2177547 Ki 43.9 nM
Brc1ccc2c(NC3=NC[C@@]4(CN5CCC4CC5)O3)ncnn12 CHEMBL3897030 EC50 45.0 nM
Cn1ccc2cc(CNC(=O)N3CC(COc4ccc(C(F)(F)F)c(F)c4)C3)ccc21 CHEMBL5434295 EC50 45.0 nM
O=C(N[C@@H]1C2CCN(CC2)[C@H]1Cc1cccnc1)c1cccc(Cl)c1 CHEMBL2179841 Ki 46.0 nM
CC[N+](CC)(CC)CCOc1ccc(/C=C/c2cc(OC)cc(OC)c2)cc1 CHEMBL4287656 IC50 47.0 nM
N[C@@H]1[C@@H]2CC[C@@H](C2)[C@H]1c1cccnc1 CHEMBL4550498 EC50 48.0 nM
Nc1ccc2sc(C(=O)N[C@H]3CN4CCC3CC4)cc2c1 CHEMBL3699097 Ki 50.0 nM
C=CC[N+]12CC[C@@H]3[C@@H]4[C@@H]5[C@@H](OCC=C(C1)[C@@H]5C[C@@H]32)N1c2ccccc2[C@@]23CCN5CC6=CCO[C@H]([C@@H]([C@H]12)[C@H]6C[C@H]53)N4c1ccccc1 CHEMBL244561 pKi 50.12 nM
COc1cc(NC(=O)c2ccccc2F)ccc1-c1nnc(NCCCN2CCCCC2)o1 CHEMBL2022495 pEC50 50.12 nM
O=C(Nc1ccc(-c2nnc(NCCCCN3CCCOCC3)o2)cc1)c1ccccc1F CHEMBL2022730 pEC50 50.12 nM
O=C(N[C@@H]1C2CCN(CC2)[C@H]1Cc1cccnc1)c1ccc(O)c(F)c1 CHEMBL2179847 Ki 52.5 nM
O=C(NC1CN2CCC1CC2)c1ccc(Sc2ccccc2)cc1 CHEMBL3640293 Ki 53.0 nM
c1ccc2oc(NC3=NCC4(CN5CCC4CC5)N3)nc2c1 CHEMBL4104136 EC50 53.0 nM
O=C(N[C@@H]1CN2CCC1CC2)c1cc2cccc(C(F)(F)F)c2s1 CHEMBL3699099 Ki 55.0 nM
Cn1ccc2cc(CNC(=O)N3CC(COc4ccc(Cl)cc4)C3)ccc21 CHEMBL4857691 EC50 55.0 nM
Cn1cc(F)c2cc(CNC(=O)N3CC(COc4ccc(C(F)(F)F)nc4)C3)ccc21 CHEMBL5439592 EC50 55.0 nM
Clc1ccc2nc(NC3=NCC4(CN5CCC4CC5)N3)sc2n1 CHEMBL4067446 EC50 56.0 nM
O=C(N[C@@H]1C2CCN(CC2)[C@H]1Cc1cccnc1)c1ccc(Br)o1 CHEMBL2179866 Ki 56.3 nM
CC(COc1ccc(/C=C\c2ccccc2)cc1)[N+](C)(C)C CHEMBL1669092 Ki 57.0 nM
O=C(N[C@H]1CN2CCC1CC2)c1cc2cccc(Br)c2o1 CHEMBL3699092 Ki 58.0 nM
c1cncc(C[C@H]2[C@H](Oc3ccc(-c4ccc5[nH]ccc5c4)cn3)C3CCN2CC3)c1 CHEMBL5266404 Ki 58.0 nM
COc1ccc(C[N+]23CC[C@@H]4[C@@H]5[C@@H]6[C@@H](OCC=C(C2)[C@@H]6C[C@@H]43)N2c3ccccc3[C@@]34CC[N+]6(Cc7ccc(OC)c(OC)c7)CC7=CCO[C@H]([C@@H]([C@H]23)[C@H]7C[C@@H]46)N5c2ccccc2)cc1OC CHEMBL389120 Ki 59.0 nM
COc1ccccc1-c1cccc2cc(C(=O)N[C@@H]3C4CCN(CC4)[C@H]3Cc3cccnc3)oc12 CHEMBL2180262 Ki 59.0 nM
C[N+]1(C)CCC(Oc2ccc(/C=C/c3ccccc3)cc2)C1 CHEMBL5202770 Ki 59.0 nM
c1cncc(C[C@@H]2[C@H](Oc3ccc(-c4ccc5[nH]ccc5c4)nn3)C3CCN2CC3)c1 CHEMBL5270469 Ki 59.0 nM
O=C(N[C@@H]1C2CCN(CC2)[C@H]1Cc1cccnc1)c1cc(Cl)ccn1 CHEMBL2179856 Ki 60.0 nM
Cc1ccc(Oc2ccc(C(=O)C(=O)Nc3ccc4c(ccn4C)c3)cc2)cc1 CHEMBL4854435 EC50 60.0 nM
COc1ccc(OCC2CN(C(=O)NCc3ccc4c(ccn4C)c3)C2)cc1 CHEMBL4848402 EC50 60.0 nM
Cc1cc2cc(CNC(=O)N3CC4(CC(=O)c5cc(F)cc(F)c5O4)C3)ccc2[nH]1 CHEMBL5412154 EC50 60.0 nM
CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)[C@H](CS)NC(=O)CN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CS)C(N)=O CHEMBL411736 IC50 61.0 nM
O=C(N[C@@H]1C2CCN(CC2)[C@H]1Cc1cccnc1)c1ccccc1 CHEMBL1257896 pKi 61.66 nM
Clc1ccc2c(NC3=NCC4(CN5CCC4CC5)N3)ncnn12 CHEMBL4078355 EC50 62.0 nM
FCCCOc1cccc(-c2cn([C@H]3CN4CCC3CC4)nn2)c1 CHEMBL4468230 Ki 62.3 nM
c1cc2occc2c(NC2=NC[C@@]3(CN4CCC3CC4)O2)n1 CHEMBL3937435 EC50 63.0 nM
O=C(N[C@H]1CN2CCC1CC2)c1cc2cccc([N+](=O)[O-])c2o1 CHEMBL3699089 Ki 63.0 nM
O=C(Nc1ccc(-c2nnc(NCCCN3CCCCC3)o2)cc1)c1ccccc1F CHEMBL2022496 pEC50 63.1 nM
O=C(Nc1ccc(-c2nnc(NCCCN3C[C@@H]4CC[C@H]3C4)o2)cc1)c1ccccc1F CHEMBL2022504 pEC50 63.1 nM
CCN(CC)CCCCNc1nnc(-c2ccc(NC(=O)c3ccccc3F)cc2)o1 CHEMBL2022732 pEC50 63.1 nM
COc1cc(NC(=O)c2ccccc2F)ccc1-c1nnc(NCCCCN2CCOCC2)o1 CHEMBL2022738 pEC50 63.1 nM
N=C(N)NCCC[C@H](NC(=O)CNC(=O)C(CCCCNC(=O)CCCc1cn(CCOCCOCCOCCOCCOCCOCCOCCOCCOCCC(=O)NCC(=O)N[C@H]2CSSC[C@@H]3NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]4CCCN4C(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CSSC[C@@H](C(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc4ccc(O)cc4)NC(=O)[C@H](CCCNC(=N)N)NC3=O)NC2=O)nn1)NC(=O)CCCc1cn(CCOCCOCCOCCOCCOCCOCCOCCOCCOCCC(=O)NCC(=O)N[C@H]2CSSC[C@@H]3NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]4CCCN4C(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CSSC[C@@H](C(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc4ccc(O)cc4)NC(=O)[C@H](CCCNC(=N)N)NC3=O)NC2=O)nn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(N)=O CHEMBL4555265 IC50 63.1 nM
O=C(N[C@@H]1C2CCN(CC2)[C@H]1Cc1cccnc1)c1cc(Cl)co1 CHEMBL2179864 Ki 66.2 nM
CC1(C)[C@@H](c2ccc(S(N)(=O)=O)cc2)[C@@H]1c1noc(C2CCCC2)n1 CHEMBL4290583 EC50 69.0 nM
COc1ccc(-c2cc(N(Cc3ccccn3)Cc3ccccn3)ncn2)c(F)c1 CHEMBL4537452 EC50 69.0 nM
O=C(N[C@@H]1C[C@H]2CCN(C2)C1)c1cc2sccc2cn1 CHEMBL403857 EC50 70.0 nM
CN1C[C@@H]2C=C(c3cccnc3)C[C@@H](C2)C1 CHEMBL2177539 Ki 70.0 nM
Cn1cnc2cnc(NC3=NC[C@@]4(CN5CCC4CC5)O3)cc21 CHEMBL3946303 EC50 70.0 nM
COc1ccccc1-c1cc(N(Cc2ccccn2)Cc2ccccn2)nc(N)n1 CHEMBL4527740 EC50 70.0 nM
COc1ccc(-c2cc(N(Cc3ccccn3)Cc3ccccn3)nc(N)n2)c(OC)c1 CHEMBL4536476 EC50 70.0 nM
Cc1cc2cc(CNC(=O)N3CC(COc4ccc(C(F)(F)F)cc4)C3)ccc2n1C CHEMBL5401869 EC50 70.0 nM
Cc1sc([C@@H]2C[C@H]2c2ccc(S(N)(=O)=O)cc2)nc1-c1ccccc1 CHEMBL4294379 EC50 71.0 nM
Fc1ccc(-c2cn(C3CN4CCC3CC4)nn2)cc1 CHEMBL4437323 Ki 72.8 nM
N#Cc1cncc(C2=C[C@H]3CNC[C@@H](C2)C3)c1 CHEMBL2178156 Ki 73.0 nM
Fc1ccc(-c2cn([C@H]3CN4CCC3CC4)nn2)cc1 CHEMBL3747760 Ki 73.0 nM
CN1C[C@H]2C=C(c3cccnc3)C[C@H](C2)C1 CHEMBL2177540 Ki 74.0 nM
FCCCOc1cccc(-c2cn(C3CN4CCC3CC4)nn2)c1 CHEMBL4453215 Ki 74.6 nM
FCCOc1cccc(-c2cn([C@@H]3CN4CCC3CC4)nn2)c1 CHEMBL4443082 Ki 74.9 nM
O=C1O[C@]2(CN3CCC2CC3)CN1c1cc2ccccc2s1 CHEMBL192237 Ki 75.0 nM
O=C(N[C@H]1CN2CCC1CC2)c1cc2ccc3ccccc3c2o1 CHEMBL3699093 Ki 75.0 nM
O=C(N[C@@H]1C2CCN(CC2)[C@H]1Cc1cccnc1)c1ccc(CO)cc1 CHEMBL2179846 Ki 76.0 nM
Clc1ccc(C2=CC3CNCC(C2)C3)nn1 CHEMBL2177516 Ki 77.0 nM
C[N+]1(C)CC(Oc2ccc(/C=C/c3ccccc3)cc2)C1 CHEMBL5176690 IC50 78.2 nM
N#Cc1cncc(C2=C[C@@H]3CNC[C@H](C2)C3)c1 CHEMBL2177535 Ki 79.0 nM
O=C(Nc1ccc(-c2nnc(NCCCCN3CCC(F)CC3)o2)cc1)c1ccccc1F CHEMBL2022741 pEC50 79.43 nM
O=C1O[C@]2(CN3CCC2CC3)CN1c1cccs1 CHEMBL362962 Ki 80.0 nM
Cc1ccc(C2=CC3CNCC(C2)C3)cn1 CHEMBL2177528 Ki 80.0 nM
Nc1cccc2cc(C(=O)N[C@H]3CN4CCC3CC4)oc12 CHEMBL3699090 Ki 80.0 nM
O=C(N[C@H]1CN2CCC1CC2)c1cc2c(F)cccc2s1 CHEMBL3699105 Ki 80.0 nM
Cn1ccc2cc(CNC(=O)N3CC(COc4ccc(C(F)(F)F)cc4)C3)ccc21 CHEMBL4859758 EC50 80.0 nM
Cn1ccc2cc(CNC(=O)N3CC(COc4ccc(Cl)c(Cl)c4)C3)ccc21 CHEMBL5396090 EC50 80.0 nM
O=C(N[C@@H]1C[C@H]2CCN(C2)C1)c1ccc2occc2c1 CHEMBL258031 EC50 81.0 nM
CC[N+](CC)(CC)CCOc1ccc(-c2ccc3ccccc3c2)cc1 CHEMBL5423336 Ki 81.0 nM
NS(=O)(=O)c1ccc([C@H]2[C@H](c3noc(-c4ccccc4)n3)C2(F)F)cc1 CHEMBL4287163 EC50 83.0 nM
CC1(C)[C@@H](c2ccc(S(N)(=O)=O)cc2)[C@@H]1c1noc(-c2c(F)ccc(F)c2F)n1 CHEMBL4284137 EC50 83.0 nM
Cc1ccc(CN2CCN(C(=O)C(=O)Nc3ccc4c(c3)c(F)cn4C)CC2)cc1 CHEMBL4855001 EC50 85.0 nM
O=C(NCc1ccc2[nH]ccc2c1)N1CC(COc2ccc(C(F)(F)F)c(F)c2)C1 CHEMBL5428639 EC50 85.0 nM
CC(C)C[C@@H]1NC(=O)[C@H](C)NC(=O)[C@H]2CSSC[C@H](NC(=O)CN)C(=O)N[C@@H](CSSC[C@@H](C(N)=O)NC(=O)[C@H](Cc3ccc(O)cc3)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]3CCCN3C(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC1=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N2 CHEMBL5083247 IC50 86.0 nM
O=C(N[C@@H]1C2CCN(CC2)[C@H]1Cc1cccnc1)c1cc(-c2ccccc2)on1 CHEMBL2179870 Ki 87.7 nM
NS(=O)(=O)c1ccc([C@@H]2C[C@H]2c2nsc(-c3cccc(F)c3)n2)cc1 CHEMBL4289508 EC50 88.0 nM
Cc1ccc(CN2CCN(C(=O)C(=O)Nc3ccc4c(ccn4C)c3)CC2)cc1 CHEMBL4873077 EC50 90.0 nM
c1ccc2c[n+](CCCCCc3cc(CCCCC[n+]4ccc5ccccc5c4)cc(CCCCC[n+]4ccc5ccccc5c4)c3)ccc2c1 CHEMBL241120 IC50 91.0 nM
CC(=O)C1=CCC[C@@H]2CC[C@H]1N2 CHEMBL2332144 Ki 91.0 nM
Brc1ccc2c(NC3=NC[C@@]4(CN5CCC4CC5)O3)nccn12 CHEMBL3951684 EC50 91.0 nM
c1ccc(COc2cccc(-c3cn(C4CN5CCC4CC5)nn3)c2)cc1 CHEMBL4468804 Ki 91.3 nM
O=C1NC[C@@]2(CN3CCC2CC3)O1 CHEMBL193016 Kd 92.0 nM
CC[N+](CC)(CC)CCCCCCCCOc1ccc(/C=C/c2ccccc2)cc1 CHEMBL4285772 IC50 92.0 nM
CC(Oc1cccc(Cl)c1)c1nc([C@H]2[C@H](c3ccc(S(N)(=O)=O)cc3)C2(C)C)no1 CHEMBL4293983 EC50 93.0 nM
CC1(C)[C@@H](c2ccc(S(N)(=O)=O)cc2)[C@@H]1c1noc(-c2ccc(F)cc2)n1 CHEMBL4279241 EC50 93.0 nM
O=C(N[C@@H]1C2CCN(CC2)[C@H]1Cc1cccnc1)c1ccccn1 CHEMBL2179853 Ki 94.0 nM
Clc1ccc2c(NC3=NC[C@@]4(CN5CCC4CC5)O3)ncnn12 CHEMBL3961124 EC50 95.0 nM
FCCCOc1cccc(-c2cn([C@@H]3CN4CCC3CC4)nn2)c1 CHEMBL4440403 Ki 96.9 nM
O=[N+]([O-])c1ccc(C[N+]23CCC4[C@@H]5/C(=C\N6c7ccccc7[C@@]78CC[N+]9(Cc%10ccc([N+](=O)[O-])cc%10)CC%10=CCO[C@H]([C@@H]([C@H]67)[C@H]%10C[C@@H]89)N5c5ccccc5)[C@@H](C[C@@H]42)/C(=C\CO)C3)cc1 CHEMBL415570 Ki 98.0 nM
CC1(C)[C@@H](c2ccc(S(N)(=O)=O)cc2)[C@@H]1c1noc(C2CC(F)(F)C2)n1 CHEMBL4282703 EC50 98.0 nM
Cc1nc([C@@H]2C[C@H]2c2ccc(S(N)(=O)=O)cc2)sc1-c1ccccc1 CHEMBL4283808 EC50 98.0 nM
FCCOc1cccc(-c2cn(C3CN4CCC3CC4)nn2)c1 CHEMBL4437189 Ki 98.7 nM
c1ccc(-c2ccc[n+](CCCCCc3cc(CCCCC[n+]4cccc(-c5ccccc5)c4)c(CCCCC[n+]4cccc(-c5ccccc5)c4)cc3CCCCC[n+]3cccc(-c4ccccc4)c3)c2)cc1 CHEMBL454767 IC50 99.0 nM
C/C=C/C[N+]12CC[C@@H]3[C@@H]4[C@@H]5[C@@H](OCC=C(C1)[C@@H]5C[C@@H]32)N1c2ccccc2[C@@]23CC[N+]5(C/C=C/C)CC6=CCO[C@H]([C@@H]([C@H]12)[C@H]6C[C@@H]35)N4c1ccccc1 CHEMBL230952 Ki 100.0 nM
C[C@H](OC(=O)N[C@@H]1CN2CCC1CC2)c1ccccc1F CHEMBL499536 pEC50 100.0 nM
O=C(Nc1ccc(-c2nnc(NCCCN3CCCCC3)o2)cc1)c1ccccc1 CHEMBL2022939 pEC50 100.0 nM
CCOc1cc(NC(=O)c2ccccc2F)ccc1-c1nnc(NCCCN2CCCCC2)o1 CHEMBL2023927 pEC50 100.0 nM
O=C(Nc1ccc(-c2nnc(NCCCCN3CCOCC3)o2)cc1)c1ccccc1F CHEMBL2022729 pEC50 100.0 nM
O=C(Nc1ccc(-c2nnc(NCCCCN3CCCCC3)o2)cc1)C1CCCCC1 CHEMBL2022735 pEC50 100.0 nM
O=C(Nc1ccc(-c2nnc(NCCCCN3CCOCC3)o2)c(F)c1)c1ccccc1 CHEMBL2022740 pEC50 100.0 nM
O=C(N[C@H]1CN2CCC1CC2)c1ccc2cc[nH]c2c1 CHEMBL212669 EC50 100.0 nM
C[C@H]1C[C@H]1C(=O)N1CC2CNCC(C2)C1 CHEMBL2409492 Ki 100.0 nM
O=C([C@H]1C[C@H]1F)N1CC2CNCC(C2)C1 CHEMBL2409486 Ki 100.0 nM
c1cn2nc(NC3=NC[C@@]4(CN5CCC4CC5)O3)ccc2n1 CHEMBL3969845 EC50 100.0 nM
c1ccc(-c2ccc(O[C@@H]3C4CCN(CC4)[C@H]3Cc3cccnc3)nn2)cc1 CHEMBL5276806 Ki 100.0 nM
Cc1cc2cc(CNC(=O)N3CC4(CC(=O)c5ccc(F)cc5O4)C3)ccc2[nH]1 CHEMBL5430539 EC50 100.0 nM
CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]2CSSC[C@H](NC(=O)CN)C(=O)N[C@@H](CSSC[C@@H](C(N)=O)NC1=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N2 CHEMBL3104240 IC50 103.0 nM
CC[C@H](C)[C@H](NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CS)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)[C@H](CS)NC(=O)CN)C(C)C)C(=O)N[C@@H](CS)C(=O)O CHEMBL5401803 IC50 103.0 nM
CC(C)Oc1cncc(C2=CC3CNCC(C2)C3)c1 CHEMBL2177543 Ki 105.0 nM
O=C(Nc1ccccc1)N[C@H]1CN2CCC1CC2 CHEMBL1255909 pKi 109.65 nM
CC[N+](CC)(CC)CCOc1ccc(/C=C/c2ccccc2)cc1 CHEMBL191491 IC50 110.0 nM
CC1(C)[C@@H](c2ccc(S(N)(=O)=O)cc2)[C@@H]1c1noc(-c2c(F)cccc2F)n1 CHEMBL4286080 EC50 110.0 nM
COc1ccccc1-c1cc(N(Cc2ccccn2)Cc2ccccn2)nc(SC)n1 CHEMBL4452777 EC50 110.0 nM
Cc1ccc(CN2CCN(C(=O)C(=O)Nc3cc(F)c4[nH]ccc4c3)CC2)cc1 CHEMBL4847388 EC50 110.0 nM
C[N+]1(C)CCC[C@@H]1COc1ccc(/C=C/c2ccccc2)cc1 CHEMBL5200914 Ki 110.0 nM
COc1cc(C2=CC3CNCC(C2)C3)cnc1Cl CHEMBL2177549 Ki 111.4 nM
CN(C)c1ccc(C(=O)N[C@@H]2C3CCN(CC3)[C@H]2Cc2cccnc2)cc1 CHEMBL2179843 Ki 112.0 nM
C[C@@H](O)[C@@H]1NC(=O)[C@H]2NC(=O)[C@H](NC(=O)CN)CSSC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]3CCCN3C(=O)[C@H](CC(=O)O)NC1=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)c(I)c1)C(=O)N[C@@H](CCCN)C(=O)N[C@H](C(=O)N[C@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)O)Cc1ccc(O)cc1)CSSC2(C)C CHEMBL5219936 IC50 115.0 nM
Fc1cccc(-c2cn([C@H]3CN4CCC3CC4)nn2)c1 CHEMBL3747258 Ki 117.0 nM
C[N+]1(C)CCC[C@H]1COc1ccc(/C=C/c2ccccc2)cc1 CHEMBL5197631 Ki 117.0 nM
O=C(NCCCCN1CCCCC1)Nc1ccc(-c2cccnc2)cc1 CHEMBL1086089 EC50 120.0 nM
Brc1cc(Br)n2ncnc(NC3=NC[C@@]4(CN5CCC4CC5)O3)c12 CHEMBL3891068 EC50 120.0 nM
O=C(Nc1ccccc1)OC1CN2CCC1CC2 CHEMBL193996 Ki 120.0 nM
Clc1cccc2sc(NC3=NCC4(CN5CCC4CC5)N3)nc12 CHEMBL4063687 EC50 120.0 nM
COc1cc(F)ccc1-c1cc(N(Cc2ccccn2)Cc2ccccn2)nc(N)n1 CHEMBL4566641 EC50 120.0 nM
Cc1ccc(OC2CCN(C(=O)C(=O)Nc3ccc4c(ccn4C)c3)CC2)cc1 CHEMBL4846787 EC50 120.0 nM
Cc1cc2cc(CNC(=O)N3CC4(CC(=O)c5cc(F)ccc5O4)C3)ccc2[nH]1 CHEMBL5429611 EC50 120.0 nM
O=C(NC1CN2CCC1CC2)c1csc(-c2ccccc2)n1 CHEMBL372895 Ki 121.2 nM
c1cnc2cc3c(cc2n1)[C@@H]1CNC[C@H]3C1 CHEMBL1076903 Ki 125.0 nM
CN1C(=O)[C@@H](CN2CCCCC2)C[C@H]1c1ccc(-c2ccccc2Cl)cc1 CHEMBL462236 pEC50 125.89 nM
O=C(Nc1ccc(-c2nnc(NCCCN3CCCCC3)o2)c(F)c1)c1ccccc1F CHEMBL2023928 pEC50 125.89 nM
CCc1cc(NC(=O)c2ccccc2F)ccc1-c1nnc(NCCCN2CCCCC2)o1 CHEMBL2023930 pEC50 125.89 nM
O=C(Nc1ccc(-c2nnc(NCCCCN3CCOCC3)o2)c(F)c1)c1ccccc1F CHEMBL2022739 pEC50 125.89 nM
Fc1ccc(COc2cccc(-c3cn(C4CN5CCC4CC5)nn3)c2)cc1 CHEMBL4557590 Ki 127.0 nM
O=C(N[C@@H]1C[C@H]2CCN(C2)C1)c1cc2cccn2cn1 CHEMBL404299 EC50 129.0 nM
CC[N+](CC)(CC)CCOc1ccc(-c2ccccc2)cc1 CHEMBL5435415 Ki 129.0 nM
O=C(NCCCCN1CCCCC1)Nc1ccc(-c2ccccn2)cc1 CHEMBL1084363 EC50 130.0 nM
CCCNc1ncc(-c2ccc(OCC)cc2)cc1C(=O)c1ccc(F)cc1 CHEMBL2440307 EC50 130.0 nM
Clc1ccc2c(n1)O[C@@]13CC[C@@H]1NC[C@@H]23 CHEMBL1086654 Ki 130.0 nM
Cc1ccc(Oc2ccc(C(=O)C(=O)Nc3ccc4c(ccn4C)c3)cn2)cc1 CHEMBL4871951 EC50 130.0 nM
Cn1cc(Cl)c2cc(CNC(=O)N3CC4(CC(=O)c5ccccc5O4)C3)ccc21 CHEMBL5439688 EC50 130.0 nM
Fc1cccc(-c2cn(C3CN4CCC3CC4)nn2)c1 CHEMBL4559236 Ki 133.0 nM
O=C(C1CC1)[C@H]1C[C@H]2CNC[C@H]2C1 CHEMBL3037927 Ki 140.0 nM
CCCNc1ncc(-c2ccc(OCC)cc2)cc1C(=O)c1ccc(Cl)cc1 CHEMBL2440299 EC50 140.0 nM
N#Cc1ccc2c(NC3=NC[C@@]4(CN5CCC4CC5)O3)ncnn12 CHEMBL3931382 EC50 140.0 nM
c1cn(-c2cc(NC3=NCC4(CN5CCC4CC5)N3)ncn2)cn1 CHEMBL4077127 EC50 140.0 nM
COc1ccccc1-c1cc(N(Cc2ccccn2)Cc2ccccn2)ncn1 CHEMBL4457546 EC50 140.0 nM
Cc1cc2cc(CNC(=O)N3CC4(CC(=O)c5ccccc5O4)C3)ccc2[nH]1 CHEMBL5434675 EC50 140.0 nM
c1cncc(OC[C@@H]2CCN2)c1 CHEMBL59986 Ki 148.0 nM
Fc1ccc(COc2cccc(-c3cn([C@@H]4CN5CCC4CC5)nn3)c2)cc1 CHEMBL4442125 Ki 149.0 nM
COc1cc(F)c(C(=O)N[C@@H]2C3CCN(CC3)[C@H]2Cc2cccnc2)c(F)c1 CHEMBL2179850 Ki 150.0 nM
Clc1ccc2nc(NC3=NCC4(CN5CCC4CC5)N3)sc2c1 CHEMBL4105038 EC50 150.0 nM
O=C(NCc1ccc2[nH]ccc2c1)N1CC(COc2ccc(C(F)(F)F)cn2)C1 CHEMBL5417166 EC50 150.0 nM
Cn1ccc2cc(CNC(=O)N3CC(COc4ccc(F)c(F)c4)C3)ccc21 CHEMBL5404259 EC50 150.0 nM
COc1ccc(/C=C2\CCCN=C2c2cccnc2)c(OC)c1 CHEMBL134713 Kd 158.0 nM
COc1cc(OC)c(NC(=O)Nc2cc(C)on2)cc1Cl CHEMBL257591 pEC50 158.49 nM
Cc1ccc(NC(=O)c2cc(-c3ccccc3)c(N3CCOCC3)s2)c(C)c1 CHEMBL1210703 pEC50 158.49 nM
O=C(Nc1ccc(-c2nnc(NCCCN3CCCC3)o2)cc1)c1ccccc1F CHEMBL2022499 pEC50 158.49 nM
O=C(Nc1ccc(-c2nnc(NCCCN3CCCCC3)o2)cc1)C1CCCCC1 CHEMBL2023919 pEC50 158.49 nM
N#Cc1cncc(C2=CC3CNCC(C2)C3)c1 CHEMBL2178155 Ki 160.0 nM
CCNc1ncc(-c2ccc(OCC)cc2)cc1C(=O)c1ccc(Cl)cc1 CHEMBL2440298 EC50 160.0 nM
Nc1nc(-c2ccccc2Cl)cc(N(Cc2ccccn2)Cc2ccccn2)n1 CHEMBL4475881 EC50 160.0 nM
O=C(NCc1ccc2[nH]ccc2c1)N1CC(COc2ccc(C(F)(F)F)cc2)C1 CHEMBL4872371 EC50 160.0 nM
CC[N+](CC)(CC)CCOc1ccc(-c2nc3ccccc3o2)cc1 CHEMBL5416962 Ki 166.0 nM
O=C(N[C@@H]1C2CCN(CC2)[C@H]1Cc1cccnc1)c1ccc2ccccc2n1 CHEMBL2179859 Ki 168.0 nM
c1ccc2c(c1)ccc[n+]2CCCCCc1cc(CCCCC[n+]2cccc3ccccc32)cc(CCCCC[n+]2cccc3ccccc32)c1 CHEMBL268074 IC50 170.0 nM
CN1C(Nc2nc3ccccc3s2)=NCC12CN1CCC2CC1 CHEMBL4060728 EC50 170.0 nM
Cc1ccc(OC2CCN(C(=O)NCc3ccc4c(ccn4C)c3)C2)cc1 CHEMBL4859390 EC50 170.0 nM
Fc1ccc(-c2cn([C@@H]3CN4CCC3CC4)nn2)cc1 CHEMBL3745799 Ki 174.5 nM
CCCC[C@@H]1NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCCC)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)[C@@H](C)O)CSSC[C@@H]2NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@@H]3CSSC[C@@H](C(=O)N4CCC[C@H]4C(=O)NCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CSSC[C@H](NC(=O)[C@H](CO)NC1=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N3)NC(=O)CNC(=O)[C@H](Cc1cnc[nH]1)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]c3ccccc13)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C(C)C)NC2=O CHEMBL5202162 IC50 176.0 nM
CCCNc1ncc(-c2ccc(OCC)cc2)cc1C(=O)c1ccc(F)c(F)c1 CHEMBL2440310 EC50 180.0 nM
c1cc2c(NC3=NC[C@@]4(CN5CC[C@@H]4C5)O3)ncnn2c1 CHEMBL3909099 EC50 180.0 nM
Cn1ccc2cc(CNC(=O)N3CC(COc4ccccc4)C3)ccc21 CHEMBL4867462 EC50 180.0 nM
O=C(N[C@@H]1C[C@H]2CCN(C2)C1)c1ccc2ncsc2c1 CHEMBL258239 EC50 182.0 nM
CC[N+](CC)(CC)CCOc1ccc(-c2ccc3cc[nH]c3c2)cc1 CHEMBL5409285 Ki 184.0 nM
C(#Cc1cc(C#CCCC[n+]2cccc(-c3ccccc3)c2)c(C#CCCC[n+]2cccc(-c3ccccc3)c2)cc1C#CCCC[n+]1cccc(-c2ccccc2)c1)CCC[n+]1cccc(-c2ccccc2)c1 CHEMBL451442 IC50 185.0 nM
C[C@@H](O)[C@@H]1NC(=O)[C@@H]2NC(=O)[C@H](NC(=O)CN)CSSC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]3CCCN3C(=O)[C@H](CC(=O)O)NC1=O)C(=O)N[C@@H](CCCNC(N)=O)C(=O)N[C@@H](Cc1ccc(O)c(I)c1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)CSCS2 CHEMBL5080428 IC50 186.0 nM
O=C(N[C@@H]1C[C@H]2CCN(C2)C1)c1ccc(Cl)cc1 CHEMBL256578 EC50 190.0 nM
NS(=O)(=O)N1CCC2(CC1)[C@H](c1cc(-c3ccccc3)ccn1)C2(F)F CHEMBL4869384 EC50 190.0 nM
Cn1ccc2cc(CNC(=O)N3CC4(CC(=O)c5ccc(F)cc5O4)C3)ccc21 CHEMBL5394744 EC50 190.0 nM
CN1CCC[C@H]1[C@H]1CCc2ccc(O)cc2O1 CHEMBL141379 EC50 197.0 nM
Clc1ccc(C2CC3CCC2N3)cn1 CHEMBL1788166 Ki 198.0 nM
CN1CCCC[C@H]1[C@H]1CCc2ccc(O)cc2O1 CHEMBL143572 EC50 199.0 nM
C1=C2C[N+]3(Cc4ccccc4)CC[C@@H]4[C@@H]5[C@H]([C@@H](OC1)N1c6ccccc6[C@@]67CC[N+]8(Cc9ccccc9)CC9=CCO[C@H]([C@@H]([C@H]16)[C@H]9C[C@@H]78)N5c1ccccc1)[C@H]2C[C@@H]43 CHEMBL396705 pKi 199.53 nM
COc1ccc(C[N+]23CC[C@@H]4[C@@H]5/C(=C\N6c7ccccc7[C@@]78CC[N+]9(Cc%10ccc(OC)c(OC)c%10)CC%10=CCO[C@H]([C@@H]([C@H]67)[C@H]%10C[C@@H]89)N5c5ccccc5)[C@@H](C[C@@H]42)/C(=C\CO)C3)cc1OC CHEMBL388049 pKi 199.53 nM
C[N+]12CC[C@@H]3[C@@H]4[C@@H]5[C@@H](OCC=C(C1)[C@@H]5C[C@@H]32)N1c2ccccc2[C@@]23CC[N+]5(C)CC6=CCO[C@H]([C@@H]([C@H]12)[C@H]6C[C@@H]35)N4c1ccccc1 CHEMBL395727 pKi 199.53 nM
CCN(CC)CCCNc1nnc(-c2ccc(NC(=O)c3ccccc3F)cc2)o1 CHEMBL2022935 pEC50 199.53 nM
O=C(Nc1ccc(-c2nnc(NCCCN3CCCCCC3)o2)cc1)c1ccccc1F CHEMBL2022938 pEC50 199.53 nM
O=C(Nc1ccc(-c2nnc(NCCCN3CCCCC3)o2)c(Cl)c1)c1ccccc1F CHEMBL2023924 pEC50 199.53 nM
O=C(Nc1ccc(-c2nnc(NCCCN3CCCCC3)o2)c(C(F)(F)F)c1)c1ccccc1F CHEMBL2023929 pEC50 199.53 nM
O=C(Nc1ccc(-c2nnc(NCCCN3CCC(F)CC3)o2)cc1)c1ccccc1F CHEMBL2022503 pEC50 199.53 nM
c1ccc(C2CN3CCC2CC3)cc1 CHEMBL1890808 pKi 199.53 nM
C[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)[C@H](CS)NC(=O)CN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCN=C(N)N)C(N)=O CHEMBL386114 IC50 200.0 nM
c1cncc(OC[C@H]2CNCCN2c2nc3ncccc3o2)c1 CHEMBL3262132 EC50 200.0 nM
Cn1cc(Cl)c2cc(CNC(=O)N3CC(COc4ccc(C(F)(F)F)cc4)C3)ccc21 CHEMBL5424913 EC50 200.0 nM
Cn1ccc2cc(CNC(=O)N3CC(COc4ccc(C(F)(F)F)cc4)C3)cnc21 CHEMBL5425943 EC50 200.0 nM
O=C(C1CC1)N1C[C@@H]2CN[C@H](C2)C1 CHEMBL2179965 Ki 210.0 nM
CCCNc1ncc(-c2ccc(OCC)cc2)cc1C(=O)c1ccccc1 CHEMBL2440313 EC50 210.0 nM
Cc1ccc(CN2CCN(C(=O)C(=O)Nc3cnc4c(c3)c(F)cn4C)CC2)cc1 CHEMBL4862421 EC50 210.0 nM
Cc1ccc(OC2CCN(C(=O)NCc3ccc4c(ccn4C)c3)CC2)cc1 CHEMBL4859122 EC50 210.0 nM
CCC(=O)c1cc(-c2ccc(Cl)cc2)n(-c2ccc(S(N)(=O)=O)cc2)c1C CHEMBL490153 EC50 212.0 nM
O=C(N[C@@H]1C2CCN(CC2)[C@H]1Cc1cccnc1)c1cccc(Cl)n1 CHEMBL2179858 Ki 219.0 nM
CN1C[C@@]2(CN3CCC2CC3)OC1=O CHEMBL611770 Kd 220.0 nM
CCCNc1ncc(-c2ccc(F)cc2)cc1C(=O)c1ccc(F)cc1 CHEMBL2440319 EC50 220.0 nM
Cn1ccc2cc(CNC(=O)N3CC(COc4ccc(F)cc4)C3)ccc21 CHEMBL4857578 EC50 220.0 nM
O=C(NCc1ccc2[nH]c(C(F)F)cc2c1)N1CC(COc2ccc(C(F)(F)F)cc2)C1 CHEMBL5432396 EC50 220.0 nM
CN1C2CCCC1CC(Nc1ccccc1Br)C2 CHEMBL4519018 Ki 221.0 nM
CC[N+]1(C)CC[C@@H](Oc2ccc(/C=C/c3ccccc3)cc2)C1 CHEMBL5176544 Ki 222.0 nM
OC/C=C1/C[N+]2(C3C=CCCC3)CC[C@@H]3[C@@H]4/C(=C\N5c6ccccc6[C@@]67CC[N+]8(C9C=CCCC9)CC9=CCO[C@H]([C@@H]([C@H]56)[C@H]9C[C@@H]78)N4c4ccccc4)[C@H]1C[C@@H]32 CHEMBL415569 Ki 230.0 nM
COc1ncccc1-c1cc(N(Cc2ccccn2)Cc2ccccn2)nc(N)n1 CHEMBL4583288 EC50 230.0 nM
Cn1ccc2cc(CNC(=O)N3CC4(CC(=O)c5ccccc5O4)C3)ccc21 CHEMBL5408775 EC50 230.0 nM
O=C1CC2(CN(C(=O)NCc3ccc4[nH]c(Cl)cc4c3)C2)Oc2ccccc21 CHEMBL5435254 EC50 230.0 nM
Cc1ccc(C(=O)N[C@@H]2C3CCN(CC3)[C@H]2Cc2cccnc2)o1 CHEMBL2179863 Ki 240.0 nM
CSc1ccccc1-c1cc(N(Cc2ccccn2)Cc2ccccn2)nc(N)n1 CHEMBL4445501 EC50 240.0 nM
c1cncc(C[C@H]2[C@H](Oc3cnc(-c4ccc5[nH]ccc5c4)cn3)C3CCN2CC3)c1 CHEMBL5271272 Ki 240.0 nM
CC[N+](CC)(CC)CCOc1ccc(/C=C/c2cc(O)cc(O)c2)cc1 CHEMBL5403618 Ki 242.0 nM
CC[C@H](C)[C@@H]1NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@@H]2CSSC[C@H](NC(=O)CNC(=O)[C@@H](N)CO)C(=O)N[C@@H](CSSC[C@@H](C(=O)O)NC1=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N2 CHEMBL5428298 IC50 242.0 nM
C[N+]12CCC(CC1)C(Oc1ccc(/C=C/c3ccccc3)cc1)C2 CHEMBL5182114 Ki 248.0 nM
Brc1cc2c(NC3=NC[C@@]4(CN5CCC4CC5)O3)ncnn2c1 CHEMBL3980345 EC50 250.0 nM
CC[N+](CC)(CC)CCOc1ccc(C(=O)Nc2ccccc2)cc1 CHEMBL5436520 Ki 250.0 nM
O=C(NCc1ccc2[nH]ccc2c1)N1CC(COc2ccc(C(F)(F)F)cc2F)C1 CHEMBL5403910 EC50 250.0 nM
CC(=O)OCC[N+]12CC[C@@H]3[C@@H]4[C@@H]5[C@@H](OCC=C(C1)[C@@H]5C[C@@H]32)N1c2ccccc2[C@@]23CC[N+]5(CCOC(C)=O)CC6=CCO[C@H]([C@@H]([C@H]12)[C@H]6C[C@@H]35)N4c1ccccc1 CHEMBL395960 pKi 251.19 nM
Brc1ccc(C[N+]23CC[C@@H]4[C@@H]5[C@@H]6[C@@H](OCC=C(C2)[C@@H]6C[C@@H]43)N2c3ccccc3[C@@]34CC[N+]6(Cc7ccc(Br)cc7)CC7=CCO[C@H]([C@@H]([C@H]23)[C@H]7C[C@@H]46)N5c2ccccc2)cc1 CHEMBL388046 pKi 251.19 nM
O=C(Nc1ccc(-c2nnc(NCCCN3CCCCC3)o2)cc1)c1ccc(F)cc1 CHEMBL2021948 pEC50 251.19 nM
O=C(Nc1ccc(-c2nnc(NCCCN3CCCCC3)o2)cc1)c1c(F)cccc1F CHEMBL2023917 pEC50 251.19 nM
O=C(Nc1ccc(-c2nnc(NCCCN3CCCOCC3)o2)cc1)c1ccccc1F CHEMBL2022498 pEC50 251.19 nM
C[C@@H]1CC[C@@H](C)N1CCCNc1nnc(-c2ccc(NC(=O)c3ccccc3F)cc2)o1 CHEMBL2022500 pEC50 251.19 nM
O=C(N[C@@H]1C2CCN(CC2)[C@H]1Cc1cccnc1)c1cc2cc(Cl)cc(Br)c2o1 CHEMBL2180261 Ki 259.0 nM
C[N+]1(CCOc2ccc(/C=C/c3ccccc3)cc2)CCOCC1 CHEMBL5193899 Ki 259.0 nM
CC[C@H](C)[C@@H]1NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H]2CSSC[C@H](NC(=O)CN)C(=O)N[C@@H](CSSC[C@@H](C(N)=O)NC1=O)C(=O)NC(CN)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N2 CHEMBL5203781 IC50 259.1 nM
Clc1cnn2ccc(NC3=NC[C@@]4(CN5CCC4CC5)O3)nc12 CHEMBL3917985 EC50 260.0 nM
Fc1ccc2c(NC3=NC[C@@]4(CN5CCC4CC5)O3)ncnn12 CHEMBL3905979 EC50 260.0 nM
Cc1ccc(OC2CCN(C(=O)C(=O)Nc3ccc4[nH]ccc4c3)CC2)cc1 CHEMBL4855193 EC50 260.0 nM
O=C(NCc1cnc2[nH]c(Cl)cc2c1)N1CC(COc2ccc(C(F)(F)F)cc2)C1 CHEMBL5421572 EC50 260.0 nM
COc1ccccc1-c1ccc(C(=O)NC2CN3CCC2CC3)s1 CHEMBL365181 Ki 268.4 nM
Cn1ccc2cc(CNC(=O)N3CC(COc4ccc(C(F)(F)F)nc4)C3)ccc21 CHEMBL5422187 EC50 270.0 nM
Cn1ccc2cc(CNC(=O)N3CC(COc4ccc(F)cc4F)C3)ccc21 CHEMBL5409548 EC50 270.0 nM
c1ccc(COc2cccc(-c3cn([C@@H]4CN5CCC4CC5)nn3)c2)cc1 CHEMBL4450133 Ki 279.0 nM
C[N+]1(C)C2CCC1CC(OC(=O)c1c[nH]c3ccccc13)C2 CHEMBL111583 EC50 280.0 nM
Cc1ccc(OCC2CCN(C(=O)NCc3ccc4c(ccn4C)c3)C2)cc1 CHEMBL4877102 EC50 280.0 nM
C1=C(c2cnccn2)CC2CNCC1C2 CHEMBL2177517 Ki 281.0 nM
CC[N+](C)(C)CCOc1ccc(/C=C/c2ccccc2)cc1 CHEMBL5170445 Ki 284.0 nM
C=Cc1ccc(OCC[N+](CC)(CC)CC)cc1 CHEMBL5435510 Ki 285.0 nM
Clc1cnc(NC2=NCC3(CN4CCC3CC4)N2)nc1 CHEMBL4077622 EC50 290.0 nM
CN1C[C@@H]2C[C@H]1CN2c1ccc(-c2ccc3[nH]ncc3c2)cn1 CHEMBL1085091 EC50 300.0 nM
C[C@H]1C[C@@H]1C(=O)N1CC2CNCC(C2)C1 CHEMBL2409490 Ki 300.0 nM
O=C([C@@H]1C[C@@H]1F)N1CC2CNCC(C2)C1 CHEMBL2409485 Ki 300.0 nM
Clc1ccc2c(NC3=NC[C@]4(CN5CCC4CC5)O3)ncnn12 CHEMBL3919130 EC50 300.0 nM
CCOC(=O)c1cc(-c2ccc(Cl)cc2)n(-c2ccc(S(N)(=O)=O)cc2)c1 CHEMBL4743406 EC50 300.0 nM
C[C@H](NC(=O)CCc1ccc(F)c(F)c1)c1cncc(N2CCN(c3ccccn3)CC2)n1 CHEMBL4278432 EC50 300.0 nM
Cc1cc2cc(CNC(=O)N3CC(COc4ccc(C(F)(F)F)cc4)C3)cnc2n1C CHEMBL5427869 EC50 300.0 nM
C[N+](C)(C)CCOc1ccc(/C=C/c2ccccc2)cc1 CHEMBL5191958 Ki 306.0 nM
C1=C2C[N+]3(Cc4ccc5ccccc5c4)CC[C@@H]4[C@@H]5[C@H]([C@@H](OC1)N1c6ccccc6[C@@]67CC[N+]8(Cc9ccc%10ccccc%10c9)CC9=CCO[C@H]([C@@H]([C@H]16)[C@H]9C[C@@H]78)N5c1ccccc1)[C@H]2C[C@@H]43 CHEMBL388047 pKi 316.23 nM
CN1C(=O)[C@@H](CN2CCCCC2)C[C@H]1c1ccc(C2CCCCC2)cc1 CHEMBL517411 pEC50 316.23 nM
CN1C(=O)[C@@H](CN2CCCCC2)C[C@H]1c1ccc(C2CCCC2)cc1 CHEMBL460541 pEC50 316.23 nM
CN1C(=O)[C@@H](CN2CCCCC2)C[C@H]1c1ccc(-c2ccccc2F)cc1 CHEMBL462235 pEC50 316.23 nM
O=C(Nc1ccc(-c2nnc(NCCCN3CCOCC3)o2)cc1)c1ccccc1F CHEMBL2022497 pEC50 316.23 nM
O=C(Nc1ccc(-c2nnc(NCCCN3CCCCC3)o2)cc1)c1cccc(F)c1 CHEMBL2023916 pEC50 316.23 nM
CN1C[C@@H]2CN(c3ccc(-c4ccc5[nH]ccc5c4)nn3)C[C@@H]2C1 CHEMBL496851 EC50 320.0 nM
Brc1ccn2ncnc(NC3=NC[C@@]4(CN5CCC4CC5)O3)c12 CHEMBL3910223 EC50 320.0 nM
C#CCNc1nc(NCCCCC2CCN(Cc3ccccc3)CC2)c(C#N)cc1C#N CHEMBL4225157 IC50 320.0 nM
CCC(=O)c1sc(-c2ccc(Cl)cc2)c(C)c1-c1ccc(S(N)(=O)=O)cc1 CHEMBL4457158 EC50 320.0 nM
c1ccc(-c2nnc(O[C@H]3C4CCN(CC4)[C@@H]3Cc3cccnc3)s2)cc1 CHEMBL5290540 Ki 320.0 nM
C[N+]12CCC(CC1)N(C(=O)c1ccc(-c3cccc(C(F)(F)F)c3)o1)CC2 CHEMBL4785409 EC50 322.0 nM
N#Cc1ccncc1C1=CC2CNCC(C1)C2 CHEMBL2177521 Ki 330.0 nM
NS(=O)(=O)N1CCC2(CC1)[C@H](c1cccc(-c3ccc(C(F)(F)F)cc3)n1)C2(F)F CHEMBL4851054 EC50 340.0 nM
CC[N+](CC)(CC)CCOc1ccc(/C=C/c2ccc(O)cc2)cc1 CHEMBL5407945 Ki 342.0 nM
Fc1ccc2c(c1)CC1CNCC2C1 CHEMBL191867 Ki 350.0 nM
O=C(CCCCN1CCCCC1)Nc1ccc(-c2cccnc2)cc1 CHEMBL565963 EC50 350.0 nM
O=C(C1CC1)N1CC2CNC(C2)C1 CHEMBL2179963 Ki 350.0 nM
C[C@@H]1C[C@@H]1C(=O)N1CC2CNCC2C1 CHEMBL2409482 Ki 350.0 nM
Cn1ccc2cc(CNC(=O)N3CC(COc4ccc(C#N)cc4)C3)ccc21 CHEMBL4856543 EC50 350.0 nM
Cc1c(C(=O)N[C@@H]2C3CCN(CC3)[C@H]2Cc2cccnc2)oc2c(Cl)cccc12 CHEMBL2180259 Ki 352.0 nM
CC[N+](CC)(CC)CCOc1ccc(/C=C/c2ccc(OC)cc2)cc1 CHEMBL5395819 Ki 353.0 nM
CC(C)C[C@@H]1NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H]2CSSC[C@H](NC(=O)CNC(=O)CCOCCOCCOCCOCCOCCOCCOCCOCCOCCn3cc(CCCC(=O)NCCCCC(NC(=O)CCCc4cn(CCOCCOCCOCCOCCOCCOCCOCCOCCOCCC(=O)NCC(=O)N[C@H]5CSSC[C@@H]6NC(=O)[C@H](C)NC(=O)[C@@H]7CCCN7C(=O)[C@H](Cc7cnc[nH]7)NC(=O)[C@H](CO)NC(=O)[C@H](CSSC[C@@H](C(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]7CCCN7C(=O)[C@H](Cc7cnc[nH]7)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CO)NC6=O)NC5=O)nn4)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(N)=O)nn3)C(=O)N[C@@H](CSSC[C@@H](C(N)=O)NC1=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N2 CHEMBL4526368 IC50 353.6 nM
Fc1ccccc1-c1cc(N(Cc2ccccn2)Cc2ccccn2)ncn1 CHEMBL4590635 EC50 360.0 nM
Cn1ccc2cc(CNC(=O)N3CC(COc4ccc(Cl)cc4)C3)cnc21 CHEMBL5419898 EC50 360.0 nM
CCOc1ccc(-c2cnc(NC)c(C(=O)c3ccc(Cl)cc3)c2)cc1 CHEMBL2440296 EC50 380.0 nM
CC(C)Oc1ccc([C@H](CO)NC(=O)[C@H]2C[C@@H]2c2ccccc2)cn1 CHEMBL2338385 EC50 390.0 nM
Cn1cc(Cl)c2cc(CNC(=O)N3CC(COc4ccc(C(F)(F)F)cc4)C3)cnc21 CHEMBL5412050 EC50 390.0 nM
O=C(Nc1ccc(-c2nnc(NCCCN3CCCCC3)o2)cc1)c1ccccc1Cl CHEMBL2022940 pEC50 398.11 nM
Cc1cc(NC(=O)c2ccccc2F)ccc1-c1nnc(NCCCN2CCCCC2)o1 CHEMBL2023925 pEC50 398.11 nM
CC1CCN2CCc3c([nH]c4ccccc34)C2C1 CHEMBL2147673 pKi 398.11 nM
Clc1cncc(N2CCCNCC2)c1 CHEMBL3341967 Ki 399.0 nM
Cc1cc2cc(-c3ccc(N4C[C@@H]5C[C@H]4CN5C)nn3)ccc2[nH]1 CHEMBL1083616 EC50 400.0 nM
O=C([C@H]1C[C@@H]1F)N1CC2CNCC(C2)C1 CHEMBL2409488 Ki 400.0 nM
CCC(=O)c1cc(-c2ccc(Cl)cc2)n(-c2ccc(S(N)(=O)=O)cc2)c1 CHEMBL4744652 EC50 400.0 nM
CCOC(=O)c1cc(-c2ccc(F)cc2)n(-c2ccc(S(N)(=O)=O)cc2)c1 CHEMBL4792581 EC50 400.0 nM
Cc1ccc(CN2CCN(C(=O)C(=O)Nc3cnc4c(ccn4C)c3)CC2)cc1 CHEMBL4868623 EC50 400.0 nM
c1nc(NC2=NC[C@@]3(CN4CCC3CC4)O2)c2ccsc2n1 CHEMBL3900472 EC50 410.0 nM
O=C(N[C@H]1C2CCN(CC2)[C@@H]1Cc1cccnc1)c1cc2ccccc2o1 CHEMBL2180264 Ki 413.0 nM
O=C1NC[C@]2(CN3CCC2CC3)O1 CHEMBL195519 Ki 420.0 nM
Cc1ccc(CN2CCN(C(=O)C(=O)Nc3ccc4c(c3)c(Cl)cn4C)CC2)cc1 CHEMBL4863064 EC50 420.0 nM
CCOc1ccc([C@H](COC)NC(=O)C2CC23CCc2ccccc23)cc1 CHEMBL5410450 EC50 420.0 nM
O=C(N[C@@H]1C[C@H]2CCN(C2)C1)c1ccc2c(c1)OCCO2 CHEMBL257145 EC50 430.0 nM
CN1CCC[C@H]1c1ccccc1 CHEMBL1199383 Ki 430.0 nM
NS(=O)(=O)N1CCC2(CC1)C(c1cccc(-c3cccc(C(F)(F)F)c3)c1)C2(F)F CHEMBL4856540 EC50 430.0 nM
c1cncc(C2CCC3CCN2CC3)c1 CHEMBL2151442 EC50 440.0 nM
C[C@H](N)C(=O)NCC(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCN=C(N)N)C(N)=O CHEMBL439347 IC50 441.0 nM
c1cncc(C2CCCCN2)c1 CHEMBL280963 Ki 450.0 nM
CCCNc1ncc(-c2ccc(OCC)cc2)cc1C(=O)c1cccc(F)c1 CHEMBL2440308 EC50 450.0 nM
CC[N+](CC)(CC)CCOc1ccc(-c2ccc3occc3c2)cc1 CHEMBL5400651 Ki 450.0 nM
Cc1[nH]c2ccc(CNC(=O)N3CC4(CC(=O)c5ccccc5O4)C3)cc2c1Cl CHEMBL5404870 EC50 460.0 nM
CCOc1ccc([C@H](COC)NC(=O)C2CC23COc2ccc(F)cc23)cc1 CHEMBL5405142 EC50 480.0 nM
c1ccc2nc(NC3=NCC4(CN5CCC4CC5)N3)cnc2c1 CHEMBL4076554 EC50 490.0 nM
Cc1ccc(CN2CCN(C(=O)NCc3ccc4c(ccn4C)c3)CC2)cc1 CHEMBL4845808 EC50 490.0 nM
Cc1ccc(OCC2CN(C(=O)NCc3ccc4[nH]c(C)c(C)c4c3)C2)cc1 CHEMBL5414064 EC50 490.0 nM
C[C@@H]1NC(=O)[C@@H]2CSSC[C@H](NC(=O)CN)C(=O)N[C@@H](CSSC[C@@H](C(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc3c[nH]c4ccccc34)NC1=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N2 CHEMBL3104242 IC50 497.0 nM
Cc1cc(/C(=C/Nc2ccc(Cl)cc2)C(=O)Nc2ccc(Cl)cc2)on1 CHEMBL429317 EC50 500.0 nM
O=C(N[C@@H]1C2CCN(CC2)[C@H]1Cc1cccnc1)c1ccccc1F CHEMBL2179837 Ki 500.0 nM
Nc1nc(-c2ccsc2)cc(N(Cc2ccccn2)Cc2ccccn2)n1 CHEMBL4533770 EC50 500.0 nM
CCC(=O)c1cc(-c2ccc(S(N)(=O)=O)cc2)n(-c2ccc(Cl)cc2)n1 CHEMBL4785311 EC50 500.0 nM
O=C(NCc1ccc2[nH]cc(Cl)c2c1)N1CC(COc2ccc(C(F)(F)F)cc2)C1 CHEMBL5406173 EC50 500.0 nM
O=C(Nc1ccc(-c2nnc(NCCCN3CCCCC3)o2)cc1)C1CCCCCC1 CHEMBL2023920 pEC50 501.19 nM
COc1cc(NC(=O)c2ccccc2F)ccc1-c1nnc(NCCCN2CCOCC2)o1 CHEMBL2023926 pEC50 501.19 nM
CC(=O)OCC[N+](C)(C)C CHEMBL667 pKi 501.19 nM
C[C@@H](O)[C@@H]1NC(=O)[C@@H]2CSSC[C@@H]3NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc4ccc(O)c(I)c4)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CSSC[C@H](NC(=O)CNC(=O)[C@@H](N)CCC(=O)NCCCC[C@H](C(=O)O)NC(=O)[C@H](Cc4ccc(O)cc4)NC3=O)C(=O)N2)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CC(=O)O)NC1=O CHEMBL4644407 IC50 504.0 nM
Fc1ccc2c(c1F)CC1CNCC2C1 CHEMBL365965 Ki 520.0 nM
O=C(NC1CN2CCC1CC2)c1ccc(-c2ccccc2Cl)s1 CHEMBL440387 Ki 524.5 nM
CC[N+](CC)(CC)CCOc1ccc(/C=C/c2ccccc2Br)cc1 CHEMBL5396300 Ki 525.0 nM
CC[N+](CC)(CC)CCOc1ccc(/N=N/c2ccccc2)cc1 CHEMBL5408237 Ki 526.0 nM
c1ccc2c(NC3=NCC4(CN5CCC4CC5)N3)ncnc2c1 CHEMBL4096397 EC50 530.0 nM
COc1ccccc1-c1cc(N(Cc2ccccn2)Cc2ccccn2)nc(C(F)(F)F)n1 CHEMBL4583746 EC50 530.0 nM
CN1C[C@@H]2C[C@H]1CN2c1cnc(-c2ccc3[nH]ccc3c2)cn1 CHEMBL1082466 EC50 540.0 nM
CN1C(Nc2nc3ccc(Cl)nc3s2)=NCC12CN1CCC2CC1 CHEMBL4082605 EC50 550.0 nM
C(=C/c1ccc(OCCCCCC[P+](c2ccccc2)(c2ccccc2)c2ccccc2)cc1)\c1ccccc1 CHEMBL4277852 Ki 559.0 nM
O=C(c1ccco1)N1C[C@H]2CN[C@@H](C2)C1 CHEMBL2179969 Ki 560.0 nM
CCCNc1ncc(-c2ccc(Oc3ccccc3)cc2)cc1C(=O)c1ccc(F)cc1 CHEMBL2440317 EC50 560.0 nM
O=S1(=O)c2cc(N3CCN4CCC3CC4)ccc2-c2cccc([18F])c21 CHEMBL3235491 Ki 562.0 nM
CC[N+](C)(CC)[C@H]1C[C@H]1Oc1ccc(/C=C/c2ccccc2)cc1 CHEMBL5193143 Ki 567.0 nM
CC[N+](CC)(CC)CCOc1ccc(/C=C/c2cccc(O)c2)cc1 CHEMBL5418191 Ki 573.0 nM
O=C(OC1CN2CCC1CC2)c1c[nH]c2ccccc12 CHEMBL108799 EC50 580.0 nM
C1=CC([N+]23CC[C@@H]4[C@@H]5[C@@H]6[C@@H](OCC=C(C2)[C@@H]6C[C@@H]43)N2c3ccccc3[C@@]34CC[N+]6(C7C=CCCC7)CC7=CCO[C@H]([C@@H]([C@H]23)[C@H]7C[C@@H]46)N5c2ccccc2)CCC1 CHEMBL231056 Ki 590.0 nM
C1=C(c2ccc(-c3ccccc3)nc2)CC2CNCC1C2 CHEMBL2177529 Ki 590.0 nM
CC[C@@H]1C[N+]2(C)CC[C@@]34c5ccccc5N5/C=C6/[C@H]7C[C@H]8[C@@]9(CC[N+]8(C)C[C@H]7CCO)c7ccccc7N(/C=C(/[C@H]1C[C@@H]32)[C@H]54)[C@@H]69 CHEMBL3337862 IC50 590.0 nM
CCOc1ccc([C@H](COC)NC(=O)C2CC23CCc2cc(F)ccc23)cc1 CHEMBL5420224 EC50 590.0 nM
Cn1ccc2cc(CNC(=O)N3CC(COc4ccc(F)c(C#N)c4)C3)ccc21 CHEMBL5394617 EC50 590.0 nM
C=CC[C@@H]1CC[C@@H](CC)[C@@H]2CCCCN12 CHEMBL2151574 IC50 600.0 nM
C[N+](C)(C)Cc1cn(Cc2cccc(O)c2)c2ccccc12 CHEMBL3133445 Ki 600.0 nM
Cc1ccc(CN2CCC(C(=O)C(=O)Nc3ccc4c(ccn4C)c3)CC2)cc1 CHEMBL4868738 EC50 600.0 nM
COc1cncc(C2=CC3CC(C2)CN(C)C3)c1 CHEMBL2177542 Ki 605.0 nM
C[N+]1(C)CCC(Oc2ccc(/C=C/c3ccccc3)cc2)CC1 CHEMBL5171118 Ki 613.0 nM
CCCCn1cnc2cc3c(cc21)C1CNCC3C1 CHEMBL198035 Ki 617.0 nM
C(=C/c1ccc(OCCCCCCC[P+](c2ccccc2)(c2ccccc2)c2ccccc2)cc1)\c1ccccc1 CHEMBL4291927 Ki 617.0 nM
CN1CCC[C@H]1c1cccnc1 CHEMBL3 Ki 620.0 nM
C[N+]12CC[C@@H]3[C@@H]4/C(=C\N5c6ccccc6[C@@]67CC[N+]8(C)CC9=CCO[C@H]([C@@H]([C@H]56)[C@H]9C[C@@H]78)N4c4ccccc4)[C@@H](C[C@@H]31)/C(=C\CO)C2 CHEMBL415568 Ki 620.0 nM
Cc1ccc(OC2CN(C(=O)NCc3ccc4c(ccn4C)c3)C2)cc1 CHEMBL4854890 EC50 620.0 nM
CC[N+](CC)(CC)CCOc1ccc(/C=C/c2cccc(OC)c2)cc1 CHEMBL5415738 Ki 621.0 nM
O=C(N[C@@H](CO)C1CCCCC1)C1CC12COc1ccccc12 CHEMBL5419039 EC50 630.0 nM
CN1C(=O)[C@@H](CN2CCCCC2)C[C@H]1c1ccc(Br)cc1 CHEMBL452455 pEC50 630.96 nM
Cc1ccc([C@@H]2C[C@H](CN3CCCCC3)C(=O)N2C)cc1 CHEMBL512768 pEC50 630.96 nM
Cc1cc([C@@H]2C[C@H](CN3CCCCC3)C(=O)N2C)sc1-c1ccccc1Cl CHEMBL459475 pEC50 630.96 nM
CN1C(=O)[C@@H](CN2CCCCC2)C[C@H]1c1nc(-c2ccccc2Cl)cn1C CHEMBL459903 pEC50 630.96 nM
Cc1ccccc1C(=O)Nc1ccc(-c2nnc(NCCCN3CCCCC3)o2)cc1 CHEMBL2022941 pEC50 630.96 nM
CC[N+]1(CC)CC[C@@H](Oc2ccc(/C=C/c3ccccc3)cc2)C1 CHEMBL5181363 Ki 635.0 nM
FC(F)(F)c1cncc(C2=CC3CNCC(C2)C3)c1 CHEMBL2177533 Ki 641.0 nM
Cc1ccc(Oc2cnc(C(=O)C(=O)Nc3ccc4c(ccn4C)c3)cn2)cc1 CHEMBL4877754 EC50 650.0 nM
Cc1ccc(CN2CCN(C(=O)c3nnc(-c4cccc5c4ccn5C)o3)CC2)cc1 CHEMBL4866453 EC50 660.0 nM
Fc1cccc(-c2cn([C@@H]3CN4CCC3CC4)nn2)c1 CHEMBL4438684 Ki 660.5 nM
CC[N+](CC)(CC)CCOc1ccc(C#Cc2ccccc2)cc1 CHEMBL5415788 Ki 664.0 nM
CC(C)Oc1ccc([C@H](C)NC(=O)[C@H]2C[C@@H]2c2ccccc2)cn1 CHEMBL2338389 EC50 670.0 nM
Cc1ccc(O[C@H]2CC[C@H](C(=O)C(=O)Nc3ccc4c(ccn4C)c3)CC2)cn1 CHEMBL4848669 EC50 670.0 nM
CCN1C[C@@]2(CN3CCC2CC3)OC1=O CHEMBL608835 Kd 690.0 nM
COc1ccccc1-c1cc(N(Cc2ccccn2)Cc2ccccn2)nc(S(C)(=O)=O)n1 CHEMBL4563052 EC50 690.0 nM
CCOc1ccc([C@H](COC)NC(=O)[C@@H]2C[C@]23CCc2ccccc23)cc1 CHEMBL5425759 EC50 690.0 nM
CN1C[C@@H]2C[C@H]1CN2c1ncc(-c2ccc3[nH]ccc3c2)cn1 CHEMBL1086524 EC50 700.0 nM
CCOC(=O)c1cc(-c2ccc(F)cc2)n(-c2ccc(S(N)(=O)=O)cc2)c1C CHEMBL4779926 EC50 700.0 nM
CCOc1ccc([C@H](COC)NC(=O)C2CC23CCc2ccc(F)cc23)cc1 CHEMBL5432699 EC50 700.0 nM
O=C(N[C@@H]1C2CCN(CC2)[C@H]1Cc1cccnc1)c1ccc(-c2ccccn2)o1 CHEMBL2179867 Ki 705.0 nM
CC[N+](CC)(CC)CCOc1ccc(/C=C/c2ccc(Br)cc2)cc1 CHEMBL5428774 Ki 723.0 nM
C[N+]1(Cc2cccc(/N=N/c3cccc(C[N+]4(C)CC=CCC4)c3)c2)CC=CCC1 CHEMBL4792178 Ki 730.0 nM
O=C(Oc1ccccc1)N1CCN2CCC1CC2 CHEMBL563848 Ki 739.0 nM
CCOc1ccc([C@H](COC)NC(=O)C2CC23CCCc2ccccc23)cc1 CHEMBL5393964 EC50 740.0 nM
COc1ccc2sc(NC3=NCC4(CN5CCC4CC5)N3)nc2c1 CHEMBL4085299 EC50 750.0 nM
O=C(c1ccco1)N1CCN2CCC1CC2 CHEMBL4777431 EC50 764.0 nM
O=C(N[C@@H](CO)C1CCCCC1)C1CC12COc1ccc(F)cc12 CHEMBL5399311 EC50 770.0 nM
O=C(N[C@@H](CO)c1ccc(OC2CCC2)nc1)[C@H]1C[C@@H]1c1ccc(F)cc1 CHEMBL2338387 EC50 790.0 nM
CCOc1ccc([C@H](CF)NC(=O)C2CC23COc2ccc(F)cc23)cn1 CHEMBL5435333 EC50 790.0 nM
CN1C(=O)[C@@H](CN2CCCCC2)C[C@H]1c1ccccc1Cl CHEMBL490959 pEC50 794.33 nM
CN1CCN(CCCNc2nnc(-c3ccc(NC(=O)c4ccccc4F)cc3)o2)CC1 CHEMBL2022501 pEC50 794.33 nM
CN1C[C@@H]2C[C@H]1CN2c1ncc(-c2ccc3[nH]ncc3c2)cn1 CHEMBL1086523 EC50 800.0 nM
CC[C@@H]1C[N+]2(C)CC[C@@]34c5ccccc5N5/C=C6/[C@H]7C[C@H]8[C@@]9(CC[N+]8(C)C[C@H]7CC)c7ccccc7N(/C=C(/[C@H]1C[C@@H]32)[C@H]54)[C@@H]69 CHEMBL3337866 pIC50 812.83 nM
O=C(N[C@H]1C2CCN(CC2)[C@H]1Cc1cccnc1)c1cc2ccccc2o1 CHEMBL2180265 Ki 818.0 nM
Cc1ccc(CN2CCN(C(=O)C(=O)Nc3ccc4c(c3)CCN4C)CC2)cc1 CHEMBL4877509 EC50 820.0 nM
O=C(NC1(c2ccc(F)cc2)COC1)C1CC12CCc1ccc(F)cc12 CHEMBL5426133 EC50 820.0 nM
Fc1cccc2c1CC1CNCC2C1 CHEMBL191988 Ki 830.0 nM
NS(=O)(=O)N1CCC2(CC1)[C@H](c1cccc(-c3ccccc3C3CC3)n1)C2(F)F CHEMBL4873854 EC50 830.0 nM
O=C(C1CC1)N1CC2CNCC2C1 CHEMBL2179961 Ki 840.0 nM
NS(=O)(=O)N1CCC2(CC1)C(c1cccc(-c3conc3C3CC3)n1)C2(F)F CHEMBL4875703 EC50 850.0 nM
O=C(N[C@@H]1C2CCN(CC2)[C@H]1Cc1cccnc1)c1ccc(Cl)cc1Cl CHEMBL2179848 Ki 851.0 nM
CC[N+](CC)(CC)CCOc1ccc(NC(=O)c2ccccc2)cc1 CHEMBL5396579 Ki 862.0 nM
C[N+]1(C)C2CCC1CC(OC1c3ccccc3CCc3ccccc31)C2 CHEMBL490843 IC50 880.0 nM
COc1ccc2nc(NC3=NCC4(CN5CCC4CC5)N3)sc2c1 CHEMBL4088682 EC50 880.0 nM
CC(C)Oc1ccccc1-c1cc(N(Cc2ccccn2)Cc2ccccn2)nc(N)n1 CHEMBL4578541 EC50 890.0 nM
CN1C[C@@H]2C[C@H]1CN2c1ccc(-c2ccc3[nH]ccc3c2)nn1 CHEMBL1083304 EC50 900.0 nM
CCC(=O)c1cc(-c2ccc(F)cc2)c(-c2ccc(S(N)(=O)=O)cc2)[nH]1 CHEMBL4781954 EC50 900.0 nM
CCC(=O)c1cc(-c2ccc(S(N)(=O)=O)cc2)n(-c2ccc(C(F)(F)F)cc2)n1 CHEMBL4761575 EC50 900.0 nM
Cc1ccc(CN2CCN(C(=O)C(=O)Nc3cc4ccn(C)c4cc3F)CC2)cc1 CHEMBL4859273 EC50 900.0 nM
C(=C/c1ccc(OCCCCCCCC[P+](c2ccccc2)(c2ccccc2)c2ccccc2)cc1)\c1ccccc1 CHEMBL4281312 Ki 909.0 nM
C[N+]1(Cc2cccc(/N=N/c3cccc(C[N+]4(C)CCCCC4)c3)c2)CCCCC1 CHEMBL4782657 Ki 910.0 nM
Cc1ccc(CC2CCN(C(=O)C(=O)Nc3ccc4[nH]ccc4c3)CC2)cc1 CHEMBL4864764 EC50 910.0 nM
COc1ccccc1-c1cc(N(Cc2ccccn2)Cc2ccccn2)nc([S+](C)[O-])n1 CHEMBL4558567 EC50 920.0 nM
Cc1ccc(CN2CCN(C(=O)C(=O)Nc3ccc4c(c3)c(C)cn4C)CC2)cc1 CHEMBL4865579 EC50 920.0 nM
C[N+]1(Cc2ccc(/N=N/c3ccc(C[N+]4(C)CCCC4)cc3)cc2)CCCC1 CHEMBL4786777 Ki 930.0 nM
NS(=O)(=O)N1CCC2(CC1)C[C@H]2c1nc2ccccc2s1 CHEMBL4872877 EC50 930.0 nM
Cc1cn2cccc2c(NC2=NC[C@@]3(CN4CCC3CC4)O2)n1 CHEMBL3901366 EC50 940.0 nM
O=C(N[C@@H]1C2CCN(CC2)[C@H]1Cc1cccnc1)c1ccncc1 CHEMBL2179854 Ki 961.0 nM
c1cncc(CC2CC3CCN2CC3)c1 CHEMBL1789658 Ki 979.0 nM
C(=C/c1ccc(OCCC[P+](c2ccccc2)(c2ccccc2)c2ccccc2)cc1)\c1ccccc1 CHEMBL4288118 Ki 984.0 nM
O=C([C@@H]1C[C@H]1F)N1CC2CNCC2C1 CHEMBL2409480 Ki 990.0 nM
Clc1cnc(NC2=NCC3(CN4CCC3CC4)N2)cn1 CHEMBL4093984 EC50 990.0 nM
COc1cc2c(cc1O)C[N+](C)(C)CC2 CHEMBL4064521 EC50 990.0 nM