c1ccc2c(c1)C[C@]1(c3c[nH]cn3)C[C@H]21 CHEMBL1256414 pKi 0.02818 nM
CCOP(=O)(OCC)C1(c2ccccc2)N=CC2C(=O)N(c3ccccc3)C(=O)C21 CHEMBL4482861 pKi 0.04169 nM
CCOP(=O)(OCC)C1N=CC2C(=O)N(c3ccc(OC)cc3)C(=O)C21 CHEMBL4536304 pKi 0.0537 nM
CCOP(=O)(OCC)C1(c2ccccc2)N=CC2C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)C21 CHEMBL4438801 pKi 0.06607 nM
COCCOc1ccc2c(c1)OC[C@@H]1C2=NO[C@H]1CN1CCN(C/C(C)=C/c2ccccc2)CC1 CHEMBL435352 Ki 0.1 nM
C/C(=C\c1ccccc1)CN1CCN(C[C@@H]2ON=C3c4ccc(OCCN(C)C)cc4OC[C@H]32)CC1 CHEMBL176261 Ki 0.1 nM
CCN(CC)C(=O)N[C@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1 CHEMBL157138 Ki 0.116 nM
CC[C@H]1[C@@H]2c3ccccc3C[C@]12c1c[nH]cn1 CHEMBL1255723 pKi 0.138 nM
C[C@H]1[C@@H]2c3ccccc3C[C@]12c1c[nH]cn1 CHEMBL1256378 pKi 0.1738 nM
C/C(=C\c1ccccc1)CN1CCN(C[C@@H]2ON=C3c4ccc(O)cc4OC[C@H]32)CC1 CHEMBL180470 Ki 0.2 nM
Cc1nc2ccc(Cl)cn2c(=O)c1CCN1CCc2oc3ccccc3c2C1 CHEMBL351483 pIC50 0.2138 nM
C[C@H]1c2ccccc2[C@H]2C[C@]21c1c[nH]cn1 CHEMBL1256609 pKi 0.2188 nM
Cc1nc2ccc(I)cn2c(=O)c1CCN1CCc2oc3ccccc3c2C1 CHEMBL162682 pIC50 0.2399 nM
Cc1ccc2c(c1)c1c(n2/C=C\c2ccccc2)CCN(C)C1 CHEMBL605405 pKi 0.2399 nM
Cc1nc2cccc(C)n2c(=O)c1CCN1CCc2oc3ccccc3c2C1 CHEMBL163190 pIC50 0.2884 nM
Cc1cc(C(C)(C)C)c(O)c(C)c1CC1=NCCN1 CHEMBL762 Ki 0.29 nM
COc1cccn2c(=O)c(CCN3CCc4oc5ccccc5c4C3)c(C)nc12 CHEMBL162490 pIC50 0.2951 nM
COc1cc2c(cc1OC)C1=NO[C@@H](CN3CCN(C/C(C)=C/c4cc(F)ccc4F)CC3)[C@@H]1CO2 CHEMBL319119 Ki 0.3 nM
COc1cc2c(cc1OC)C1=NO[C@@H](CN3CCN(C/C=C(\C)c4ccccc4)CC3)[C@@H]1CO2 CHEMBL419316 Ki 0.3 nM
COc1cc2c(cc1OC)C1=NO[C@@H](CN3CCN(C/C=C(\C)c4cccs4)CC3)[C@@H]1CO2 CHEMBL100879 Ki 0.3 nM
COc1cc2c(cc1OC)C1=NO[C@@H](CN3CCN(C/C(C)=C/c4ccccc4)CC3)[C@@H]1CO2 CHEMBL91157 Ki 0.3 nM
CCOP(=O)(OCC)C1N=CC2C(=O)N(C3CCCCC3)C(=O)C21 CHEMBL4483022 pKi 0.3236 nM
c1ccc2c(c1)[C@H]1C[C@@]1(c1c[nH]cn1)C21CC1 CHEMBL1255617 pKi 0.3311 nM
Cc1cc(C)n2c(=O)c(CCN3CCc4oc5ccccc5c4C3)c(C)nc2c1 CHEMBL162232 pIC50 0.3388 nM
Cc1ccc2nc(C)c(CCN3CCc4oc5ccccc5c4C3)c(=O)n2c1 CHEMBL162370 pIC50 0.3467 nM
Cc1nc2ccc(Br)cn2c(=O)c1CCN1CCc2oc3ccccc3c2C1 CHEMBL165350 pIC50 0.3548 nM
COC1(C2=NCCN2)COc2ccccc2O1 CHEMBL10332 pKi 0.3631 nM
CN1C[C@H](C(=O)N[C@]2(C)O[C@@]3(O)[C@@H]4CCCN4C(=O)[C@H](Cc4ccccc4)N3C2=O)C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]21 CHEMBL1732 Ki 0.387 nM
O=C(NCCCCCCCCCCNC(=O)[C@@H]1[C@H]2C[C@H]3c4[nH]c5ccccc5c4CCN3C[C@@H]2CC[C@@H]1O)[C@@H]1[C@H]2C[C@H]3c4[nH]c5ccccc5c4CCN3C[C@@H]2CC[C@@H]1O CHEMBL554019 Ki 0.39 nM
CC(=O)Oc1ccc2c(c1)OC[C@@H]1C2=NO[C@H]1CN1CCN(C/C(C)=C/c2ccccc2)CC1 CHEMBL176116 Ki 0.4 nM
CCC[C@H]1[C@@H]2c3ccccc3C[C@]12c1c[nH]cn1 CHEMBL1255724 pKi 0.4074 nM
COC(=O)[C@@H]1[C@H]2C[C@H]3c4[nH]c5ccccc5c4CCN3C[C@@H]2CC[C@@H]1O CHEMBL15245 Ki 0.42 nM
Cc1ccn2c(=O)c(CCN3CCc4oc5ccccc5c4C3)c(C)nc2c1 CHEMBL165796 pIC50 0.4467 nM
C[C@]12C[C@@]1(c1c[nH]cn1)Cc1ccccc12 CHEMBL1255771 pKi 0.4467 nM
COc1cc2c(cc1OC)C1=NO[C@@H](CN3CCN(C/C=C(\C)c4ccco4)CC3)[C@@H]1CO2 CHEMBL319530 Ki 0.5 nM
COc1ccc2c(c1)OCC1C2=NOC1CN1CCN(C/C=C/c2ccccc2)CC1 CHEMBL90247 Ki 0.5 nM
COc1ccc2c(c1)OC[C@@H]1C2=NO[C@H]1CN1CCN(C/C(C)=C/c2ccccc2)CC1 CHEMBL176002 Ki 0.5 nM
Cc1ccc(OCC(O)C(C)NC(C)C)c2c1CCC2 CHEMBL513389 IC50 0.5 nM
CC[C@H]1c2ccccc2[C@H]2C[C@]21c1c[nH]cn1 CHEMBL1256610 pKi 0.5129 nM
Cc1nc2ccccn2c(=O)c1CCN1CCc2oc3ccccc3c2C1 CHEMBL162501 pIC50 0.5495 nM
CO[C@H]1c2ccccc2[C@H]2C[C@]21c1c[nH]cn1 CHEMBL1256503 pKi 0.5623 nM
Cc1nc2c(Cl)cc(Cl)cn2c(=O)c1CCN1CCc2oc3ccccc3c2C1 CHEMBL163247 pIC50 0.5888 nM
CCCCCNC(=O)/N=C(\N)NCCCc1sc(N)nc1C CHEMBL4860528 Kd 0.6 nM
CCCCCNC(=O)/N=C(\N)NCCCc1nnc(N)s1 CHEMBL5207281 Kd 0.6 nM
N/C(=N\C(=O)NCc1ccccc1)NCCCc1nnc(N)s1 CHEMBL5206565 Kd 0.6 nM
C[C@@H](NC(=O)/N=C(\N)NCCCc1ncn[nH]1)c1ccccc1 CHEMBL5201074 Kd 0.6 nM
Cc1nc2c(C)cccn2c(=O)c1CCN1CCc2oc3ccccc3c2C1 CHEMBL351200 pIC50 0.6026 nM
Brc1c(NC2=NCCN2)ccc2nccnc12 CHEMBL844 Log EC50 0.6166 nM
Cc1cccc([C@H](C)c2c[nH]cn2)c1C CHEMBL2106195 EC50 0.6747 nM
Cc1nc2c(O)cccn2c(=O)c1CCN1CCc2oc3ccccc3c2C1 CHEMBL162826 pIC50 0.6918 nM
COCC(=O)Oc1ccc2c(c1)OC[C@@H]1C2=NO[C@H]1CN1CCN(C/C(C)=C/c2ccccc2)CC1 CHEMBL175853 Ki 0.7 nM
CC(C)[C@@]1(NC(=O)[C@@H]2C[C@@H]3c4cccc5[nH]cc(c45)C[C@H]3N(C)C2)O[C@@]2(O)[C@@H]3CCCN3C(=O)[C@H](Cc3ccccc3)N2C1=O CHEMBL1255837 Ki 0.747 nM
O=C(NCCCCCCCCNC(=O)[C@@H]1[C@H]2C[C@H]3c4[nH]c5ccccc5c4CCN3C[C@@H]2CC[C@@H]1O)[C@@H]1[C@H]2C[C@H]3c4[nH]c5ccccc5c4CCN3C[C@@H]2CC[C@@H]1O CHEMBL538808 Ki 0.76 nM
CN1C[C@H](C(=O)N[C@]2(C)O[C@@]3(O)[C@@H]4CCCN4C(=O)[C@H](Cc4ccccc4)N3C2=O)C=C2c3cccc4[nH]cc(c34)C[C@H]21 CHEMBL442 Ki 0.796 nM
COc1cc2c(cc1OC)C1=NOC(CN3CCN(C/C(C)=C/c4ccccc4)CC3)C1CO2 CHEMBL93171 Ki 0.8 nM
COc1ccc2c(c1)C1=NOC(CN3CCN(C/C=C/c4ccccc4)CC3)C1CO2 CHEMBL422597 Ki 0.8 nM
Cc1cccc([C@H](C)c2c[nH]cn2)c1C CHEMBL778 EC50 0.8 nM
Cc1ccc(CCn2c3c(c4cc(C)ccc42)CN(C)CC3)cc1 CHEMBL605081 pKi 0.8128 nM
CCC[C@H]1c2ccccc2[C@H]2C[C@]21c1c[nH]cn1 CHEMBL1255616 pKi 0.8511 nM
O=C(NCCCCCCCNC(=O)[C@@H]1[C@H]2C[C@H]3c4[nH]c5ccccc5c4CCN3C[C@@H]2CC[C@@H]1O)[C@@H]1[C@H]2C[C@H]3c4[nH]c5ccccc5c4CCN3C[C@@H]2CC[C@@H]1O CHEMBL543232 Ki 0.87 nM
Cc1nc2ccccn2c(=O)c1CCN1CCc2oc3c(Cl)cccc3c2C1 CHEMBL164612 pIC50 0.8913 nM
C(=C/c1ccccc1)\CN1CCN(CC2ON=C3c4ccccc4OCC32)CC1 CHEMBL90943 Ki 0.9 nM
C(=C/c1ccccc1)\CN1CCN(C[C@@H]2ON=C3c4ccccc4OC[C@H]32)CC1 CHEMBL2112978 Ki 0.9 nM
C/C(=C\c1ccccc1)CN1CCN(C[C@@H]2ON=C3c4ccc(OC(=O)C5CC5)cc4OC[C@H]32)CC1 CHEMBL175911 Ki 0.9 nM
C=CC(=O)Oc1ccc2c(c1)OC[C@@H]1C2=NO[C@H]1CN1CCN(C/C(C)=C/c2ccccc2)CC1 CHEMBL180322 Ki 0.9 nM
CCOP(=O)(OCC)C1(c2ccccc2)N=CC2C(=O)N(C3CCCCC3)C(=O)C21 CHEMBL4535472 pKi 0.9772 nM
COc1ccccc1/C=C(\C)CN1CCN(C[C@@H]2ON=C3c4cc(OC)c(OC)cc4OC[C@H]32)CC1 CHEMBL99868 Ki 1.0 nM
C/C(=C\c1ccccc1)CN1CCN(C[C@@H]2ON=C3c4ccc(OC(=O)c5ccncc5)cc4OC[C@H]32)CC1 CHEMBL425324 Ki 1.0 nM
CNC(=O)C(CCN1CCC(O)(c2ccc(Cl)cc2)CC1)(c1ccccc1)c1ccccc1 CHEMBL1627 Ki 1.0 nM
CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(NCCc4ccc(CCC(=O)Nc5ccc(OC(C)=O)c([N+](=O)[O-])c5)cc4)nc32)[C@H](O)[C@@H]1O CHEMBL3335523 Kd 1.03 nM
CC1(C)[C@@H]2c3ccccc3C[C@@]21c1c[nH]cn1 CHEMBL1255770 pKi 1.072 nM
COc1cc2c(cc1OC)C1=NO[C@@H](CN3CCN(C/C(C)=C/c4ccsc4)CC3)[C@@H]1CO2 CHEMBL101596 Ki 1.1 nM
COc1cc2c(cc1OC)C1=NO[C@@H](CN3CCN(C/C(C)=C/c4cccc(F)c4)CC3)[C@@H]1CO2 CHEMBL263424 Ki 1.1 nM
Cc1nc2c(Cl)cc(C(F)(F)F)cn2c(=O)c1CCN1CCc2oc3ccccc3c2C1 CHEMBL162147 pIC50 1.175 nM
c1ccc2c(c1)CCCC2NC1=NCCO1 CHEMBL75030 Log EC50 1.175 nM
O=C(NCCCCCCCCCCCCNC(=O)[C@@H]1[C@H]2C[C@H]3c4[nH]c5ccccc5c4CCN3C[C@@H]2CC[C@@H]1O)[C@@H]1[C@H]2C[C@H]3c4[nH]c5ccccc5c4CCN3C[C@@H]2CC[C@@H]1O CHEMBL551711 Ki 1.18 nM
Cc1c(NC2=NCCN2)ccc2c1NCCO2 CHEMBL298936 Ki 1.2 nM
CCC1(c2c[nH]cn2)Cc2ccccc2C1 CHEMBL353972 Ki(app) 1.2 nM
Cc1c(NC2=NCCN2)ccc2nccnc12 CHEMBL49137 Log EC50 1.202 nM
O=C(NCCCCCCCCCNC(=O)[C@@H]1[C@H]2C[C@H]3c4[nH]c5ccccc5c4CCN3C[C@@H]2CC[C@@H]1O)[C@@H]1[C@H]2C[C@H]3c4[nH]c5ccccc5c4CCN3C[C@@H]2CC[C@@H]1O CHEMBL539606 Ki 1.25 nM
C1=NC[C@]2(CC[C@@H]3Cc4ccccc4C[C@H]3C2)N1 CHEMBL165529 Log Ki 1.259 nM
COc1cc2c(cc1OC)C1=NO[C@@H](CN3CCN(Cc4ccc5ccccc5c4)CC3)[C@@H]1CO2 CHEMBL92860 Ki 1.3 nM
CCOCCOCCOc1ccc2c(c1)OC[C@@H]1C2=NO[C@H]1CN1CCN(C/C(C)=C/c2ccccc2)CC1 CHEMBL179237 Ki 1.3 nM
C/C(=C\c1ccccc1)CN1CCN(C[C@@H]2ON=C3c4ccc(OC5CCCC5)cc4OC[C@H]32)CC1 CHEMBL369378 Ki 1.3 nM
COc1cc2c(cc1OC)C1=NOC(CN3CCN(C/C(C)=C/c4ccccc4)CC3)C1CN2 CHEMBL390718 Ki 1.3 nM
O=C(NCCCCCCNC(=O)[C@@H]1[C@H]2C[C@H]3c4[nH]c5ccccc5c4CCN3C[C@@H]2CC[C@@H]1O)[C@@H]1[C@H]2C[C@H]3c4[nH]c5ccccc5c4CCN3C[C@@H]2CC[C@@H]1O CHEMBL542527 Ki 1.35 nM
COc1cc2c(cc1OC)C1=NO[C@@H](CN3CCN(C/C=C(\C)c4ccsc4)CC3)[C@@H]1CO2 CHEMBL328195 Ki 1.4 nM
COc1cc2c(cc1OC)C1=NOC(CN3CCN(C/C=C(\C)c4ccccc4)CC3)C1CO2 CHEMBL327875 Ki 1.4 nM
c1ccc(CC[C@H]2CCCC[C@@H]2NC2=NCCO2)cc1 CHEMBL47313 Log Ki 1.445 nM
NC1=NC2(CCc3cccc(Cl)c3C2)CO1 CHEMBL133231 Ki 1.6 nM
CN1C[C@@H]2C(=NO[C@H]2CN2CCN(C/C=C/c3ccccc3)CC2)c2ccccc21 CHEMBL2112970 Ki 1.6 nM
CN1CC2C(=NO[C@H]2CN2CCN(C/C=C/c3ccccc3)CC2)c2ccccc21 CHEMBL1085510 Ki 1.6 nM
CCC[C@H]1CCCC[C@@H]1NC1=NCCO1 CHEMBL297752 Log EC50 1.622 nM
CCC[C@H]1CCCCC1NC1=NCCO1 CHEMBL310335 Log EC50 1.622 nM
Brc1c(NC2=NCCN2)ccc2nccnc12 CHEMBL1200389 EC50 1.666 nM
COc1ccccc1N1CCN(CCNC(=O)c2ccc3ccccc3c2)CC1 CHEMBL1221498 Ki 1.69 nM
COc1cc2c(cc1OC)C1=NO[C@@H](CN3CCN(C/C(C)=C/c4ccco4)CC3)[C@@H]1CO2 CHEMBL99916 Ki 1.7 nM
COc1cc2c(cc1OC)C1=NO[C@@H](CN3CCN(C/C(C)=C/c4cccs4)CC3)[C@@H]1CO2 CHEMBL98646 Ki 1.7 nM
Cc1c(Nc2ncc[nH]2)ccc2c1OCCO2 CHEMBL308570 Ki 1.7 nM
Cc1ccc(N(CC2=NCCN2)c2cccc(O)c2)cc1 CHEMBL597 Ki 1.7 nM
O=C(NCCCCCNC(=O)[C@@H]1[C@H]2C[C@H]3c4[nH]c5ccccc5c4CCN3C[C@@H]2CC[C@@H]1O)[C@@H]1[C@H]2C[C@H]3c4[nH]c5ccccc5c4CCN3C[C@@H]2CC[C@@H]1O CHEMBL555190 Ki 1.73 nM
Cc1nc2ccccn2c(=O)c1CCN1CCc2sc3ccccc3c2C1 CHEMBL165181 pIC50 1.738 nM
COc1ccc2c(c1)C=C[C@@H]1C2=NO[C@H]1CN1CCN(C/C=C/c2ccccc2)CC1 CHEMBL2112982 Ki 1.8 nM
COc1ccc2c(c1)C=C[C@@H]1C2=NO[C@H]1CN1CCN(Cc2ccc3ccccc3c2)CC1 CHEMBL2112972 Ki 1.8 nM
COC(=O)[C@@H]1[C@H]2C[C@H]3c4[nH]c5ccccc5c4CCN3C[C@@H]2CC[C@@H]1O CHEMBL537669 Ki 1.8 nM
COc1cc2c(cc1OC)C1=NO[C@@H](CN3CCN(C/C=C(\C)c4ccc(O)cc4)CC3)[C@@H]1CO2 CHEMBL329065 Ki 1.9 nM
COC1(C2=NCCN2)COc2ccccc2O1 CHEMBL1256176 pKi 1.905 nM
Cc1ccc2c(c1)c1c(n2CCc2ccccc2)CCN(C)C1 CHEMBL592752 pKi 1.995 nM
O=c1c(CCN2CCc3oc4ccccc4c3C2)c(Cc2ccccc2)nc2ccccn12 CHEMBL162436 pIC50 2.188 nM
Clc1c(NC2=NCCN2)ccc2nccnc12 CHEMBL72753 Log EC50 2.344 nM
CC(C)[C@H]1C(=O)N2CCC[C@H]2[C@]2(O)O[C@](NC(=O)[C@@H]3C=C4c5cccc6[nH]cc(c56)C[C@H]4N(C)C3)(C(C)C)C(=O)N12 CHEMBL1385840 Ki 2.361 nM
COc1cccc2c1CCC[C@H]2CN(C)CCc1ccc2ccoc2c1 CHEMBL268258 Ki 2.4 nM
COc1cc2c(cc1OC)C1=NO[C@@H](CN3CCN(C/C(C)=C/c4ccccc4)CC3)[C@@H]1CN2 CHEMBL2112985 Ki 2.4 nM
COc1cc2c(cc1OC)C1=NO[C@@H](CN3CCN(C/C=C/c4ccccc4)CC3)[C@@H]1CO2 CHEMBL328114 Ki 2.6 nM
COc1ccccc1N1CCN(CCCCNC(=O)c2ccc3ccccc3c2)CC1 CHEMBL25236 Ki 2.75 nM
Brc1c(NC2=NCCN2)ccc2c1NCCN2 CHEMBL74283 Log EC50 2.818 nM
COc1ccccc1N1CCN(CCCCCCNS(=O)(=O)c2ccc3ccccc3c2)CC1 CHEMBL1221594 Ki 2.87 nM
Nc1cc(Cl)c(N=C2NCCN2)c(Cl)c1 CHEMBL647 Ki 2.9 nM
COc1cc2c(cc1OC)C1=NO[C@@H](CN3CCN(C/C=C/c4ccccc4F)CC3)[C@@H]1CO2 CHEMBL319573 Ki 2.9 nM
COc1cc2c(cc1OC)C1=NO[C@@H](CN3CCN(C/C=C(\C)c4ccc(F)cc4)CC3)[C@@H]1CO2 CHEMBL98541 Ki 2.9 nM
CC(C)C[C@H]1C(=O)N2CCC[C@H]2[C@]2(O)O[C@](NC(=O)[C@@H]3C=C4c5cccc6[nH]cc(c56)C[C@H]4N(C)C3)(C(C)C)C(=O)N12 CHEMBL1403281 Ki 2.98 nM
COc1cc2c(cc1OC)C1=NO[C@@H](CN3CCN(C/C(C)=C/c4cccc(F)c4F)CC3)[C@@H]1CO2 CHEMBL419336 Ki 3.0 nM
Clc1cc(Cl)c2c(c1)CC1(CC2)CN=CN1 CHEMBL338683 Ki 3.0 nM
COc1cc2c(cc1OC)C1=NO[C@@H](CN3CCN(C/C(C)=C/c4ccc(F)cc4)CC3)[C@@H]1CO2 CHEMBL318235 Ki 3.1 nM
C1=NC[C@@H](C2C[C@@]23CCc2ccccc2C3)N1 CHEMBL354611 Log Ki 3.162 nM
CCOP(=O)(OCC)C1N=CC2C(=O)N(c3ccc(F)c(Cl)c3)C(=O)C21 CHEMBL4439953 pKi 3.236 nM
Cc1cc(C(C)(C)C)c(O)c(C)c1CC1=NCCN1 CHEMBL1200791 EC50 3.29 nM
CCO[C@H]1c2ccccc2[C@H]2C[C@]21c1c[nH]cn1 CHEMBL1256565 pKi 3.311 nM
COc1cccc(OC)c1OCCNCC1COc2ccccc2O1 CHEMBL25554 Ki 3.5 nM
COc1cc2nc(C)c(CCN3CCc4oc5ccccc5c4C3)c(=O)n2cc1OC CHEMBL162058 pIC50 3.548 nM
Cc1nc2n(c(=O)c1CCN1CCC(c3noc4cc(F)ccc34)CC1)CCCC2 CHEMBL85 Ki 3.628 nM
Clc1cccc(Cl)c1NC1=NCCN1 CHEMBL134 Ki 3.8 nM
Cc1nc2ccccn2c(=O)c1CCN1CCc2oc3ccc(Cl)cc3c2C1 CHEMBL165677 pIC50 3.89 nM
C1=NCC(CC2Cc3ccccc3C2)N1 CHEMBL353843 Log Ki 3.981 nM
CCCO[C@H]1c2ccccc2[C@H]2C[C@]21c1c[nH]cn1 CHEMBL1256566 pKi 3.981 nM
c1ccc2c(c1)NC[C@@H]1C2=NO[C@H]1CN1CCN(Cc2ccc3ccccc3c2)CC1 CHEMBL2112984 Ki 4.0 nM
COc1ccccc1N1CCN(CCCCNS(=O)(=O)c2ccc3ccccc3c2)CC1 CHEMBL1221545 Ki 4.1 nM
COc1cccc(N(NC2=NCCO2)c2ccc(C)cc2)c1 CHEMBL194323 Ki 4.16 nM
CC(Oc1c(Cl)cccc1Cl)C1=NCCN1 CHEMBL17860 pKi 4.365 nM
CCC1(C2=NCCN2)Cc2ccccc2O1 CHEMBL57895 Ki(app) 4.4 nM
CCOP(=O)(OCC)C1N=CC2C(=O)N(C)C(=O)C21 CHEMBL4467833 pKi 4.467 nM
COc1ccccc1N1CCN(CCCNC(=O)c2ccc3ccccc3c2)CC1 CHEMBL1221544 Ki 4.59 nM
COC(=O)[C@H]1[C@H]2C[C@H]3c4[nH]c5ccccc5c4CCN3C[C@H]2CC[C@@H]1O CHEMBL10347 Ki 4.6 nM
COc1ccccc1N1CCN(CCCNS(=O)(=O)c2ccc3ccccc3c2)CC1 CHEMBL497749 Ki 4.64 nM
C/C(=C\c1ccccc1)CN1CCN(C[C@@H]2ON=C3c4ccc(OC(=O)C(C)(C)C)cc4OC[C@H]32)CC1 CHEMBL178588 Ki 4.7 nM
Cc1ccc(N(NC2=NCCO2)c2cccc(O)c2)cc1 CHEMBL370818 Ki 4.73 nM
CN1CCN2c3ccccc3Cc3ccccc3C2C1 CHEMBL6437 Ki 4.8 nM
COc1c(C(C)(C)C)cc(C)c(Nc2ncc[nH]2)c1C CHEMBL75257 Ki 4.9 nM
COc1cc2c(cc1OC)C1=NOC(CN3CCN(Cc4ccc5ccccc5c4)CC3)C1CO2 CHEMBL94129 Ki 5.0 nM
Cc1cc(C(C)(C)C)cc(C)c1CC1=NCCN1 CHEMBL312448 AC50 5.0 nM
COc1ccccc1N1CCN(CCNS(=O)(=O)c2ccc3ccccc3c2)CC1 CHEMBL1221499 Ki 5.19 nM
COc1cc2c(cc1OC)C1=NO[C@@H](CN3CCN(C/C=C(\C)c4ccccc4OC)CC3)[C@@H]1CO2 CHEMBL101361 Ki 5.2 nM
Clc1cccc(Cl)c1NC1=NCCN1 CHEMBL1705 EC50 5.259 nM
NC[C@H](O)c1ccc(O)c(O)c1 CHEMBL1437 AC50 5.3 nM
C1CCCC(NC2=NCCO2)CC1 CHEMBL305928 Log Ki 5.37 nM
CC(C)C[C@H]1C(=O)N2CCC[C@H]2[C@]2(O)O[C@](NC(=O)[C@@H]3C=C4c5cccc6[nH]c(Br)c(c56)C[C@H]4N(C)C3)(C(C)C)C(=O)N12 CHEMBL493 Ki 5.533 nM
CN(C)c1nc(NCC2CCN(S(=O)(=O)c3ccc(Br)cc3OC(F)(F)F)CC2)nc2ccccc12 CHEMBL194173 IC50 5.6 nM
CNC[C@H](O)c1ccc(O)c(O)c1 CHEMBL679 EC50 5.626 nM
COc1cc2c(cc1OC)C1=NO[C@@H](CN3CCN(C/C=C/c4cccc(F)c4)CC3)[C@@H]1CO2 CHEMBL95218 Ki 5.9 nM
Fc1ccc2c(c1)CC(CC1CN=CN1)C2 CHEMBL90997 Ki 5.9 nM
Cc1c(Nc2ncc[nH]2)ccc2c1NCCO2 CHEMBL432155 Ki 6.0 nM
COc1ccccc1N1CCN(CCCCCCNC(=O)c2ccc3ccccc3c2)CC1 CHEMBL1221593 Ki 6.15 nM
COc1cccc(N(NC2=NCCN2)c2ccc(C)cc2)c1 CHEMBL362954 Ki 6.3 nM
CNCCC(Oc1ccc(C(F)(F)F)cc1)c1ccccc1 CHEMBL41 Log Ki 6.31 nM
CSc1ccc(Cl)cc1NCC1=NCCN1 CHEMBL70751 Log EC50 6.31 nM
COc1cc2c(cc1OC)C1=NO[C@@H](CN3CCN(C/C=C(\C)c4ccccc4)CC3)[C@@H]1CN2 CHEMBL2112971 Ki 6.5 nM
Ic1c(NC2=NCCN2)ccc2nccnc12 CHEMBL70676 Log Ki 6.761 nM
COC(=O)[C@H]1[C@H]2C[C@H]3c4[nH]c5ccccc5c4CCN3C[C@H]2CC[C@@H]1O CHEMBL1257131 IC50 6.822 nM
Cc1ccc2c(c1)CC1(CC2)CN=CN1 CHEMBL98471 Ki 7.0 nM
c1ccc2c(c1)OCC(C1=NCCN1)O2 CHEMBL10316 pKi 7.079 nM
CCC1(c2c[nH]cn2)Cc2ccc(F)cc2C1 CHEMBL1255582 pKi 7.244 nM
CN(C)c1nc(NC[C@H]2CC[C@H](CNS(=O)(=O)c3ccc(Br)cc3OC(F)(F)F)CC2)nc2ccccc12 CHEMBL537846 IC50 7.7 nM
CN(C)c1nc(NCC2CCC(CNS(=O)(=O)c3ccc(Br)cc3OC(F)(F)F)CC2)nc2ccccc12 CHEMBL193438 IC50 7.7 nM
CCOP(=O)(OCC)C1(c2ccccc2)N=CC2C(=O)N(Cc3ccccc3)C(=O)C21 CHEMBL4438158 pKi 7.762 nM
COc1cc2c(cc1OC)C1=NO[C@@H](CN3CCN(C/C=C/c4ccccc4)CC3)[C@@H]1CN2 CHEMBL2112983 Ki 7.9 nM
N=C(N)N/N=C/c1c(Cl)cccc1Cl CHEMBL420 AC50 8.1 nM
COc1ccccc1N1CCN(CCCCCNS(=O)(=O)c2ccc3ccccc3c2)CC1 CHEMBL1221592 Ki 8.53 nM
c1ccc2c(CC3=NCCN3)cccc2c1 CHEMBL761 AC50 8.7 nM
Oc1cccc2c1CCCC2c1c[nH]cn1 CHEMBL317912 Log Ki 8.71 nM
COc1cc2c(cc1OC)C1=NOC(CN3CCN(C/C=C/c4ccccc4)CC3)C1CO2 CHEMBL93489 Ki 8.8 nM
COc1cc2c(cc1OC)C1=NO[C@@H](CN3CCN(C/C=C/c4ccc(F)cc4)CC3)[C@@H]1CO2 CHEMBL419894 Ki 9.0 nM
COc1cc2c(cc1OC)C1=NOC(CN3CCN(C/C=C/c4ccc(F)cc4)CC3)C1CO2 CHEMBL226636 Ki 9.0 nM
COc1cc2c(cc1OC)C1=NO[C@@H](CN3CCN(CCOc4ccc(F)cc4)CC3)[C@@H]1CN2 CHEMBL2112969 Ki 9.1 nM
COc1cc2c(cc1OC)C1=NO[C@@H](CN3CCN(C/C=C(\C)c4ccc(F)cc4F)CC3)[C@@H]1CO2 CHEMBL328631 Ki 9.3 nM
CN1CCc2cccc(Cl)c2CC1 CHEMBL123349 Ki 9.4 nM
Cc1c(NC2=NCCN2)ccc2c1NCCN2 CHEMBL49284 Ki 9.6 nM
c1ccc2c(SC3=NCCN3)c[nH]c2c1 CHEMBL2107015 AC50 9.8 nM
CN(C)c1nc(NCC2CCC(CNC(=O)c3ccc(Br)cc3OC(F)(F)F)CC2)nc2ccccc12 CHEMBL367355 IC50 9.9 nM
COc1ccc(Nc2ncc[nH]2)c(C)c1 CHEMBL77913 Ki 10.0 nM
CN(C)C[C@H]1CC2c3ccccc3Oc3ccc(Cl)cc3[C@H]2O1 CHEMBL435301 Ki 10.0 nM
Cc1nc2ccccn2c(=O)c1CCCN1CCc2oc3ccccc3c2C1 CHEMBL165776 pIC50 10.23 nM
CCC[C@H]1C2CCC(C2)[C@H]1NC1=NCCO1 CHEMBL296660 Log EC50 10.96 nM
COc1cc2c(cc1OC)N(C)C[C@@H]1C2=NO[C@H]1CN1CCN(CCC/C(C)=C/c2ccccc2)CC1 CHEMBL2112977 Ki 11.0 nM
COc1ccccc1N1CCN(CCCCCNC(=O)c2ccc3ccccc3c2)CC1 CHEMBL1221591 Ki 11.1 nM
CO[C@@H]1c2ccccc2[C@H]2C[C@]21c1c[nH]cn1 CHEMBL1256502 pKi 11.75 nM
Cc1cccc(C)c1OC(C)C1=NCCN1 CHEMBL155866 pKi 11.75 nM
CCc1cccc(CC)c1OC(C)C1=NCCN1 CHEMBL157955 pEC50 11.75 nM
N=C(N)NC(=O)Cc1c(Cl)cccc1Cl CHEMBL1200494 EC50 11.77 nM
COc1cccc2c1CCC1(CN=CN1)C2 CHEMBL336332 Ki 12.0 nM
Fc1cccc2c1CC1(CC2)CN=CN1 CHEMBL131220 Ki 12.0 nM
COc1cc2c(cc1OC)C1=NOC(CN3CCN(CCC(=O)c4ccccc4)CC3)C1CO2 CHEMBL328735 Ki 12.0 nM
CCOc1ccccc1OCCN[C@H](C)Cc1ccc(OC)c(S(N)(=O)=O)c1 CHEMBL836 Ki 13.4 nM
CN1CC2c3ccccc3Oc3ccc(Cl)cc3C2C1 CHEMBL3187365 AC50 13.7 nM
c1ccc(C[C@H]2C3CCC(C3)[C@H]2NC2=NCCO2)cc1 CHEMBL295186 Log Ki 13.8 nM
Cc1cccc2[nH]nc(N=C3NCCN3)c12 CHEMBL1641682 EC50 14.0 nM
CC[C@H]1CN2CCc3cc(OC)c(OC)cc3[C@@H]2C[C@@H]1C[C@H]1NCCc2cc(OC)c(OC)cc21 CHEMBL50588 Ki 14.0 nM
CN1C[C@H](C(=O)N[C@]2(C)O[C@@]3(O)[C@@H]4CCCN4C(=O)[C@H](Cc4ccccc4)N3C2=O)C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]21 CHEMBL1200517 Ki 14.62 nM
CC(Oc1ccccc1-c1cccc(F)c1)C1=NCCN1 CHEMBL223836 Log Ki 14.79 nM
Clc1cccc2cnn(N=C3NCCN3)c12 CHEMBL1641690 EC50 15.0 nM
c1ccc(CCC[C@H]2CCCC[C@@H]2NC2=NCCO2)cc1 CHEMBL50720 Log Ki 15.14 nM
O=C(NCCCCNC(=O)[C@@H]1[C@H]2C[C@H]3c4[nH]c5ccccc5c4CCN3C[C@@H]2CC[C@@H]1O)[C@@H]1[C@H]2C[C@H]3c4[nH]c5ccccc5c4CCN3C[C@@H]2CC[C@@H]1O CHEMBL539824 Ki 15.3 nM
c1ccc(Oc2ncccc2-c2noc(CN3CCCN(CC4COc5ccccc5O4)CC3)n2)cc1 CHEMBL491420 Ki 15.4 nM
C(=C/c1ccccc1)\C[C@H]1C2CCC(C2)[C@H]1NC1=NCCO1 CHEMBL297827 Log Ki 15.85 nM
CC(=O)Nc1ccc(OCCCN2CCC(c3noc4cc(F)ccc34)CC2)cc1 CHEMBL4784373 Ki 16.3 nM
C=CCc1cccc(CC=C)c1OC(C)C1=NCCN1 CHEMBL157206 pKi 16.6 nM
CC(Oc1ccccc1-c1cccs1)C1=NCCN1 CHEMBL223829 Log Ki 16.98 nM
CCN(CC)C(=O)N[C@H]1C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1 CHEMBL73151 AC50 18.0 nM
CSc1ccc(F)cc1NCC1=NCCN1 CHEMBL72768 Log Ki 18.2 nM
c1ccc([C@H]2CCCC[C@@H]2NC2=NCCO2)cc1 CHEMBL297228 Log Ki 18.2 nM
Cc1c(NC2=NCCN2)cccc1-c1ccccc1 CHEMBL92221 Ki 19.0 nM
C1=NCC(Cc2cc3ccccc3o2)N1 CHEMBL167644 Log Ki 19.95 nM
C(=C/c1ccccc1)\CN1CCN(C[C@@H]2ON=C3c4ccccc4NC[C@H]32)CC1 CHEMBL2112981 Ki 20.0 nM
CCNC(=O)N1C[C@@H]2C(=NO[C@H]2CN2CCN(C/C=C/c3ccccc3)CC2)c2ccccc21 CHEMBL2112973 Ki 20.0 nM
CN1CCN2c3ncccc3Cc3ccccc3C2C1 CHEMBL654 Ki 20.0 nM
c1ccc(C[C@H]2CCCC[C@@H]2NC2=NCCO2)cc1 CHEMBL50719 Log Ki 20.89 nM
C[C@H](Oc1ccccc1C1CC1)C1=NCCN1 CHEMBL1276220 pKi 20.89 nM
CN(C)c1nc(NCC2CCC(NS(=O)(=O)c3ccc(Br)cc3OC(F)(F)F)CC2)nc2ccccc12 CHEMBL193970 IC50 21.0 nM
COc1cc2c(cc1OC)C1=NO[C@@H](CN3CCN(C/C(C)=C/c4cccnc4)CC3)[C@@H]1CO2 CHEMBL98889 Ki 22.0 nM
COc1cc2c(cc1OC)C1=NOC(CN3CCN(CC4=Cc5ccccc5C4)CC3)C1CO2 CHEMBL328377 Ki 22.0 nM
CN1C[C@H](CNC(=O)OCc2ccccc2)C[C@@H]2c3cccc4c3c(cn4C)C[C@H]21 CHEMBL19215 Ki 22.0 nM
CCS(=O)(=O)Nc1ccc2c(c1)C(c1c[nH]cn1)CCC2 CHEMBL327116 Log Ki 22.91 nM
CC(OC1=NCCN1)c1ccccc1C1CC1 CHEMBL576623 pKi 22.91 nM
CC(Oc1ccccc1C1CC1)C1=NCCN1 CHEMBL1276218 pKi 22.91 nM
CC(Oc1ccccc1Br)C1=NCCN1 CHEMBL1956192 pKi 22.91 nM
COc1cc2c(cc1OC)C1=NO[C@@H](CN3CCN(C/C=C\c4ccccc4)CC3)[C@@H]1CO2 CHEMBL420830 Ki 23.0 nM
Cc1ccc(N(NC2=NCCN2)c2cccc(O)c2)cc1 CHEMBL194849 Ki 23.8 nM
CCc1ccccc1OC(C)C1=NCCN1 CHEMBL156336 pKi 23.99 nM
C=Cc1sc2ccc(Cl)c3c2c1CN(C)CC3 CHEMBL25467 Ki 24.0 nM
CN1CCN(C2=Nc3cc(Cl)ccc3Nc3ccccc32)CC1 CHEMBL42 Ki 24.0 nM
Cc1ccccc1C(C)OC1=NCCN1 CHEMBL570863 pKi 24.55 nM
Cc1sc(C)c2c1CCC=C2c1c[nH]cn1 CHEMBL284795 Ki 25.0 nM
NC(=O)C1CCN(CCCN2c3ccccc3Sc3ccc(Cl)cc32)CC1 CHEMBL1909072 Ki 25.0 nM
Clc1cccc2ccc(CC3CN=CN3)cc12 CHEMBL168168 Log Ki 25.12 nM
CSc1ccc(C)cc1NCC1=NCCN1 CHEMBL72441 Log EC50 25.12 nM
c1ccc2c(c1)CCCC2NC1=NCCCO1 CHEMBL306377 Log Ki 25.7 nM
COc1cc2c(cc1OC)C1=NOC(CN3CCN(CCCc4ccccc4)CC3)C1CO2 CHEMBL90419 Ki 26.0 nM
O=C(NCCNC(=O)[C@@H]1[C@H]2C[C@H]3c4[nH]c5ccccc5c4CCN3C[C@@H]2CC[C@@H]1O)[C@@H]1[C@H]2C[C@H]3c4[nH]c5ccccc5c4CCN3C[C@@H]2CC[C@@H]1O CHEMBL542520 Ki 26.4 nM
CC(Oc1ccccc1)C1=NCCN1 CHEMBL273485 pKi 26.92 nM
CC(OC1=NCCN1)c1ccccc1 CHEMBL571314 pKi 26.92 nM
c1nc(C2CCCc3sccc32)c[nH]1 CHEMBL284213 Ki 27.0 nM
COc1cccc2c1CCC2c1ncc[nH]1 CHEMBL402388 EC50 27.0 nM
O=C(NCCN1CCN(CC2COc3ccccc3O2)CC1)c1cccnc1Oc1ccccc1 CHEMBL478026 Ki 27.0 nM
CC(Oc1ccccc1-c1cccc(O)c1)C1=NCCN1 CHEMBL374584 Log Ki 27.54 nM
NCCCCCCn1cc(CCCCN2CCC(c3ccc(-c4cc(C(=O)O)cc5cc(-c6ccc(C(F)(F)F)cc6)ccc45)cc3)CC2)nn1 CHEMBL4216870 Ki 28.0 nM
COc1ccccc1N1CCN(CCCNC(=O)Nc2ccccc2-c2ccccc2)CC1 CHEMBL5400232 Ki 28.0 nM
CC(Oc1ccccc1Cl)C1=NCCN1 CHEMBL1956191 pKi 28.84 nM
O=C(CCCNC(=O)[C@@H]1C2C[C@H]3c4[nH]c5ccccc5c4CCN3C[C@@H]2CC[C@@H]1O)OCc1ccccc1 CHEMBL196451 Ki 29.0 nM
NC[C@H](O)c1ccc(O)c(O)c1 CHEMBL5087452 EC50 30.11 nM
c1ccc(CCC[C@H]2C3CCC(C3)[C@H]2NC2=NCCO2)cc1 CHEMBL48341 Log Ki 30.9 nM
CCc1sc2ccc(Cl)c3c2c1CN(C)CC3 CHEMBL123448 Ki 31.0 nM
Cc1c(Nc2ncc[nH]2)ccc2nccnc12 CHEMBL75491 Ki 31.0 nM
CN(C)c1nc(NCC2CCC(CNCc3ccc(Br)cc3OC(F)(F)F)CC2)nc2ccccc12 CHEMBL360117 IC50 31.0 nM
Clc1cccc2c1C=C(CC1CN=CN1)CC2 CHEMBL353200 Log Ki 31.62 nM
CC(Oc1ccccc1C=O)C1=NCCN1 CHEMBL1956201 pEC50 31.62 nM
Clc1ccc2nsnc2c1NC1=NCCN1 CHEMBL1200329 EC50 32.91 nM
CCOC(=O)N1C[C@@H]2C(=NO[C@H]2CN2CCN(C/C=C/c3ccccc3)CC2)c2ccccc21 CHEMBL2112975 Ki 33.0 nM
Fc1ccc2cnn(N=C3NCCN3)c2c1 CHEMBL3343699 Ki 33.0 nM
CS(=O)(=O)Nc1c(O)ccc2c1CCCC2C1=NCCN1 CHEMBL109783 Log Ki 33.11 nM
CS(=O)(=O)Nc1c(O)ccc2c1CCCC2C1=NCCN1 CHEMBL2261346 pKi 33.11 nM
CC(Oc1ccccc1-c1ccc(O)cc1)C1=NCCN1 CHEMBL222798 Log Ki 33.88 nM
C1=NCC2(CCc3ccccc3C2)N1 CHEMBL130853 Ki 34.0 nM
COc1cc2c(cc1OC)C1=NOC(CN3CCN(Cc4cnc5ccccc5c4)CC3)C1CO2 CHEMBL91824 Ki 34.0 nM
CN(C)c1nc(NCC2CCC(CN(C)S(=O)(=O)c3ccc(Br)cc3OC(F)(F)F)CC2)nc2ccccc12 CHEMBL181727 IC50 34.0 nM
Cc1ccccc1COC1=NCCN1 CHEMBL576819 pKi 34.67 nM
CC(Oc1ccccc1CC1CC1)C1=NCCN1 CHEMBL1956195 pKi 36.31 nM
C1COC(NC(C2CC2)C2CC2)=N1 CHEMBL289480 pKi 36.31 nM
Cc1cccc2cnn(N=C3NCCN3)c12 CHEMBL1186788 EC50 37.0 nM
CC(Oc1ccccc1-c1cccc(N)c1)C1=NCCN1 CHEMBL222371 Log Ki 37.15 nM
COc1cc(C)c(Nc2ncc[nH]2)cc1C(C)(C)C CHEMBL78190 Ki 39.0 nM
Oc1cccc([C@H]2CCCN(C[C@H]3COc4ccccc4O3)C2)c1 CHEMBL5173443 Kb 39.0 nM
Fc1cccc2c1C=C(CC1CN=CN1)CC2 CHEMBL353139 Log Ki 39.81 nM
CSc1ccccc1NCC1=NCCN1 CHEMBL540542 Log EC50 39.81 nM
C[C@@H](Oc1ccccc1-c1cccc(O)c1)C1=NCCN1 CHEMBL1278084 pKi 39.81 nM
COc1ccccc1OCCNCC(O)COc1cccc2[nH]c3ccccc3c12 CHEMBL723 Ki 40.0 nM
Cc1ccc(-c2ccccc2OC(C)C2=NCCN2)cc1 CHEMBL426900 Log Ki 41.69 nM
C[C@H](Oc1ccccc1CC1CC1)C1=NCCN1 CHEMBL2089156 pKi 41.69 nM
COc1cc2c(cc1OC)CN(Cc1ccc(OC)c3oc(C(=O)NC4CN5CCC4CC5)cc13)CC2 CHEMBL394218 Ki 42.0 nM
CN1CCC(=C2c3ccccc3Sc3ccccc32)CC1 CHEMBL152408 AC50 42.2 nM
CO[C@]12C[C@@H](COC(=O)c3cncc(Br)c3)CN(C)[C@@H]1Cc1cn(C)c3cccc2c13 CHEMBL1372950 AC50 42.6 nM
O=C(c1ccc(OCCCc2c[nH]cn2)cc1)C1CC1 CHEMBL14638 pKi 42.66 nM
C1=C[C@@H]2C(=NO[C@H]2CN2CCN(C/C=C/c3ccccc3)CC2)c2ccccc21 CHEMBL2112979 Ki 43.0 nM
CN(Cc1ccc(Br)cc1OC(F)(F)F)CC1CCC(CNc2nc(N(C)C)c3ccccc3n2)CC1 CHEMBL182235 IC50 44.0 nM
CS(=O)(=O)Nc1c(O)ccc2c1CCCC2c1c[nH]cn1 CHEMBL108804 Log Ki 44.67 nM
C[C@@H](Oc1ccccc1C1CC1)C1=NCCN1 CHEMBL1276219 pKi 44.67 nM
C[C@H](Oc1ccccc1-c1ccsc1)C1=NCCN1 CHEMBL1276248 pKi 44.67 nM
C[C@@H](Oc1ccccc1CC1CC1)C1=NCCN1 CHEMBL2089155 pKi 44.67 nM
CC1CN([C@H]2CCCN(C[C@H]3COc4ccccc4O3)C2)C(=O)N1 CHEMBL5173747 Kb 44.9 nM
O=C1CCCN1c1cccnc1N1CCN(C[C@H]2COc3ccccc3O2)CC1 CHEMBL5267200 Kb 44.9 nM
CC(Oc1ccccc1-c1ccsc1)C1=NCCN1 CHEMBL385310 Log Ki 45.71 nM
CC(C)O[C@H]1c2ccccc2[C@H]2C[C@]21c1c[nH]cn1 CHEMBL1256608 pKi 45.71 nM
Cc1ccccc1-c1ccccc1OC(C)C1=NCCN1 CHEMBL223830 Log Ki 46.77 nM
CC(=O)N1C[C@@H]2C(=NO[C@H]2CN2CCN(CCC/C=C/c3ccccc3)CC2)c2ccccc21 CHEMBL426959 Ki 47.0 nM
CN(C)c1nc(N[C@H]2CC[C@@H](NC(=O)c3ccc(Cl)c(Cl)c3)CC2)nc2ccccc12 CHEMBL362400 IC50 47.0 nM
CN(C)c1nc(NC2CCC(NS(=O)(=O)c3ccc(Br)cc3OC(F)(F)F)CC2)nc2ccccc12 CHEMBL193771 IC50 47.0 nM
CC(Oc1ccccc1-c1ccccc1)C1=NCCN1 CHEMBL128168 Log Ki 47.86 nM
CCCCOc1cccc(C(=O)NCCN2CCCN(CC3COc4ccccc4O3)CC2)n1 CHEMBL476569 Ki 48.4 nM
CCCc1ccccc1COC1=NCCN1 CHEMBL569933 pKi 48.98 nM
CCCc1ccccc1OCC1=NCCN1 CHEMBL13917 pKi 48.98 nM
N=C(N)NC(=O)Cc1c(Cl)cccc1Cl CHEMBL862 Ki 50.0 nM
CSc1ccc2c(c1)N(CCC1CCCCN1C)c1ccccc1S2 CHEMBL479 Ki 50.0 nM
CN[C@H](CC(C)C)C(=O)N[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H]2C(=O)N[C@H]3C(=O)N[C@H](C(=O)N[C@H](C(=O)O)c4cc(O)cc(O)c4-c4cc3ccc4O)[C@H](O)c3ccc(c(Cl)c3)Oc3cc2cc(c3O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@H]2C[C@](C)(N)[C@H](O)[C@H](C)O2)Oc2ccc(cc2Cl)[C@H]1O CHEMBL262777 Log Ki 50.12 nM
CC(Oc1ccccc1C1CCCC1)C1=NCCN1 CHEMBL495096 pKi 50.12 nM
CCCc1ccccc1C(C)OC1=NCCN1 CHEMBL576078 pKi 50.12 nM
CCCc1ccccc1OC(C)C1=NCCN1 CHEMBL2431282 pKi 50.12 nM
COc1ccc2c(c1)CC1(CC2)CN=CN1 CHEMBL133579 Ki 51.0 nM
COc1cccc2c1CC1(CC2)CN=CN1 CHEMBL131417 Ki 51.0 nM
Cc1cccc(-c2ccccc2OC(C)C2=NCCN2)c1 CHEMBL222973 Log Ki 51.29 nM
O=C(NCCCNC(=O)[C@@H]1[C@H]2C[C@H]3c4[nH]c5ccccc5c4CCN3C[C@@H]2CC[C@@H]1O)[C@@H]1[C@H]2C[C@H]3c4[nH]c5ccccc5c4CCN3C[C@@H]2CC[C@@H]1O CHEMBL540594 Ki 52.0 nM
c1ccc2c(c1)cnn2N=C1NCCN1 CHEMBL1186220 Ki 52.0 nM
C=CCc1ccccc1O[C@@H](C)C1=NCCN1 CHEMBL1276140 pKi 52.48 nM
CCOP(=O)(OCC)C1(c2ccccc2)N=CC2C(=O)N(c3ccc(F)c(Cl)c3)C(=O)C21 CHEMBL4450506 Ki 53.0 nM
CN1CCc2c(Cl)ccc3oc(Br)c(c23)C1 CHEMBL123138 Ki 54.0 nM
CN(C)c1nc(N[C@H]2CC[C@@H](NS(=O)(=O)c3ccc(Br)cc3OC(F)(F)F)CC2)nc2ccccc12 CHEMBL180003 IC50 57.0 nM
O=S(=O)(NC1CCC(Nc2ncc3ccccc3n2)CC1)c1ccc(Br)cc1OC(F)(F)F CHEMBL195346 IC50 57.0 nM
C=CCc1ccccc1OC(C)C1=NCCN1 CHEMBL495095 pKi 57.54 nM
C=CCc1ccccc1C(C)OC1=NCCN1 CHEMBL570973 pKi 57.54 nM
COc1ccccc1OC(C)C1=NCCN1 CHEMBL1956199 pKi 57.54 nM
CCCCS(=O)(=O)NCC1CCC(CNc2nc(N(C)C)c3ccccc3n2)CC1 CHEMBL193666 IC50 58.0 nM
CSc1cc(F)ccc1NCC1=NCCN1 CHEMBL306792 Log Ki 58.88 nM
c1ccc(C2CC2)c(OCC2=NCCN2)c1 CHEMBL13852 pKi 58.88 nM
c1cnc(N2CCN(Cc3ccc4c(c3)OCO4)CC2)nc1 CHEMBL1371770 AC50 59.0 nM
CN(C)c1nc(N[C@H]2CC[C@@H](NC(=O)c3cccc(C(F)(F)F)c3)CC2)nc2ccccc12 CHEMBL181632 IC50 60.0 nM
COc1cc(C(C)=O)ccc1OCCCN1CCC(c2noc3cc(F)ccc23)CC1 CHEMBL14376 AC50 60.0 nM
CC(Oc1ccccc1-c1cccc([N+](=O)[O-])c1)C1=NCCN1 CHEMBL222928 Log Ki 60.26 nM
CN(C)c1nc(N[C@H]2CC[C@@H](NC(=O)c3cccc(Br)c3)CC2)nc2ccccc12 CHEMBL359510 IC50 63.0 nM
CN1CCN(CCCN2c3ccccc3Sc3ccc(Cl)cc32)CC1 CHEMBL728 Ki 63.0 nM
C1=NC[C@H](C[C@]23CCc4ccccc4C2C3)N1 CHEMBL353212 Log Ki 63.1 nM
CC(=O)c1ccccc1OC(C)C1=NCCN1 CHEMBL1956202 pEC50 63.1 nM
CN1CCC2C(C1)c1cccc3c1N2c1ccccc1CS3 CHEMBL3217984 pKi 63.1 nM
c1ccc(-c2ccccc2NCC2=NCCN2)cc1 CHEMBL337862 pEC50 63.1 nM
CCOP(=O)(OCC)C1(Cc2ccc(F)cc2)N=CC2C(=O)N(c3ccccc3)C(=O)C21 CHEMBL4568994 pKi 63.1 nM
Fc1cccc2cnn(N=C3NCCN3)c12 CHEMBL3343700 Ki 65.0 nM
COc1cc2c(cc1OC)C1=NOC(CN3CCN(Cc4csc5ccccc45)CC3)C1CO2 CHEMBL93801 Ki 66.0 nM
CN(C)C[C@H]1CC2c3ccccc3Sc3ccc(F)cc3[C@H]2O1 CHEMBL193639 Ki 66.0 nM
c1ccc(Oc2ncccc2COCCN2CCCN(CC3COc4ccccc4O3)CC2)cc1 CHEMBL491419 Ki 66.1 nM
c1ccc2c(c1)CCCC2C1=NCCN1 CHEMBL1266 AC50 66.7 nM
CO[C@@H]1[C@@H](OC)[C@H](C)[C@@](O)(CC(=O)O)O[C@H]1[C@H](C)[C@H]1O[C@@]2(CC[C@@](C)([C@H]3CC[C@@](C)([C@@H]4O[C@@H]([C@H]5O[C@](C)(O)[C@H](C)C[C@@H]5C)C[C@@H]4O[C@@H]4C[C@H](OC)[C@@H](OC)[C@H](C)O4)O3)O2)C[C@H](O)[C@H]1C CHEMBL1909065 Ki 67.0 nM
Cc1sc(C)c2c1CCCC2c1c[nH]cn1 CHEMBL30739 Ki 68.0 nM
COc1cc2c(cc1OC)C1=NO[C@@H](CN3CCN(C/C=C/c4ccc(Cl)cc4)CC3)[C@@H]1CO2 CHEMBL101411 Ki 69.0 nM
CN(C)CCCOc1ccc(CCNC(=O)c2cc(Br)c[nH]2)cc1Br CHEMBL493091 Ki 69.0 nM
CN1CCC[C@@H]1CCO[C@](C)(c1ccccc1)c1ccc(Cl)cc1 CHEMBL1626 Ki 69.0 nM
COc1cc(OC)cc(C(=O)N[C@H]2CC[C@@H](Nc3nc(N(C)C)c4ccccc4n3)CC2)c1 CHEMBL360081 IC50 71.0 nM
CN(C)C[C@@H]1CC2c3ccccc3Sc3ccc(F)cc3[C@H]2O1 CHEMBL363581 Ki 72.0 nM
O=C1CCCN1[C@H]1CCCN(C[C@H]2COc3ccccc3O2)C1 CHEMBL5205746 Kb 72.3 nM
O=C1CCC(=O)N1[C@H]1CCCN(C[C@H]2COc3ccccc3O2)C1 CHEMBL5190072 Kb 72.4 nM
Nc1cccc2c1CCCC2c1c[nH]cn1 CHEMBL323402 Log Ki 72.44 nM
C[C@H](Oc1ccccc1-c1cccc([N+](=O)[O-])c1)C1=NCCN1 CHEMBL397753 Log Ki 72.44 nM
CC(Oc1ccccc1C(C)C)C1=NCCN1 CHEMBL266613 pKi 72.44 nM
C=C(C)c1ccccc1OC(C)C1=NCCN1 CHEMBL1956194 pKi 72.44 nM
CC1(C)CN([C@H]2CCCN(C[C@H]3COc4ccccc4O3)C2)C(=O)N1 CHEMBL5176375 Kb 72.8 nM
Clc1cccc2c(N=C3NCCN3)n[nH]c12 CHEMBL1641689 EC50 73.0 nM
CCCCOc1ncccc1C(=O)NCCN1CCCN(CC2COc3ccccc3O2)CC1 CHEMBL514837 Ki 73.6 nM
COc1cc2c(cc1OC)C1=NO[C@@H](CN3CCN(Cc4ccc5ccccc5c4)CC3)[C@@H]1CN2 CHEMBL2112976 Ki 74.0 nM
CN1CCN(c2cc(-c3ccc(C#N)cc3)nc(N)n2)CC1 CHEMBL494678 Ki 74.0 nM
Cc1cnc2c(Br)c(NC3=NCCN3)ccc2n1 CHEMBL72147 Log Ki 74.13 nM
C[C@H](Oc1ccccc1-c1ccccc1)C1=NCCN1 CHEMBL396013 Log EC50 74.13 nM
CC(Oc1ccccc1C1CCCCC1)C1=NCCN1 CHEMBL451229 pKi 74.13 nM
CCCN[C@H]1CCc2nc(N)sc2C1 CHEMBL301265 Ki 75.7 nM
c1c[nH]c(Nc2ccc3[nH]cnc3c2)n1 CHEMBL74544 Ki 76.0 nM
CN(C)c1nc(N[C@H]2CC[C@@H](NC(=O)c3cccc(Cl)c3)CC2)nc2ccccc12 CHEMBL179878 IC50 76.0 nM
O=C1OC(c2ccccc2)C(=O)N1[C@H]1CCCN(C[C@H]2COc3ccccc3O2)C1 CHEMBL5191398 Kb 76.3 nM
c1ccc(OCC2=NCCN2)c(CC2CC2)c1 CHEMBL2431281 pKi 77.62 nM
COc1ccccc1N1CCN(CCn2c(=O)[nH]c3scc(-c4ccccc4)c3c2=O)CC1 CHEMBL268758 Ki 77.8 nM
CCOc1ccc(N=C2NCCN2)cc1 CHEMBL3289551 pKi 79.43 nM
OCCN1CCN(CCCN2c3ccccc3Sc3ccc(C(F)(F)F)cc32)CC1 CHEMBL726 Ki 80.0 nM
CCSc1ccccc1NCC1=NCCN1 CHEMBL540035 Log Ki 81.28 nM
CC(C)Sc1ccccc1NCC1=NCCN1 CHEMBL553276 Log Ki 81.28 nM
C[C@@H](Oc1ccccc1-c1cccc([N+](=O)[O-])c1)C1=NCCN1 CHEMBL242693 Log Ki 81.28 nM
C=CCN(CC=C)CCc1c[nH]c2ccc(Cl)cc12 CHEMBL3752900 pKi 81.28 nM
c1ccc2c(N=C3NCCN3)n[nH]c2c1 CHEMBL1641679 EC50 82.0 nM
COc1ccccc1N1CCN(CCn2c(=O)[nH]c3scc(-c4cccc(C)c4)c3c2=O)CC1 CHEMBL13856 Ki 82.5 nM
C=CCN1CCc2nc(N)sc2CC1 CHEMBL279085 AC50 83.0 nM
CC(C)Oc1ccccc1OC(C)C1=NCCN1 CHEMBL14208 pKi 83.18 nM
CC(Oc1ccccc1OC1CC1)C1=NCCN1 CHEMBL1956197 pKi 83.18 nM
C=CCN(CC=C)CCc1c[nH]c2ccc(Br)cc12 CHEMBL3754166 pKi 83.18 nM
CN(c1cccc2c1CCCC2c1c[nH]cn1)S(C)(=O)=O CHEMBL111463 Log Ki 85.11 nM
CN(C)c1nc(NCC2CCC(CNS(C)(=O)=O)CC2)nc2ccccc12 CHEMBL195123 IC50 86.0 nM
Clc1ccc2nsnc2c1NC1=NCCN1 CHEMBL1079 EC50 86.0 nM
COc1ccc2c(c1)CCC1(CN=CN1)C2 CHEMBL336970 Ki 87.0 nM
COc1nc(C)nc(Cl)c1NC1=NCCN1 CHEMBL19236 AC50 88.0 nM
COc1scnc1N1CCN(C[C@H]2COc3ccccc3O2)CC1 CHEMBL5290877 Kb 88.3 nM
CCCCCCCCCCCCCCCC[n+]1ccccc1 CHEMBL334255 Ki 91.0 nM
CC(Nc1ccccc1-c1ccccc1)C1=NCCN1 CHEMBL130884 Log Ki 91.2 nM
CN1CCc2ccc3c4c2[C@H]1Cc1cccc(c1-4)[C@@H]3N CHEMBL27251 Ki 92.8 nM
c1ccc(OC(C2=NCCN2)c2ccccc2)cc1 CHEMBL494885 pKi 93.33 nM
O=C(NCCN1CCCN(C[C@H]2COc3ccccc3O2)CC1)c1cccnc1Oc1ccccc1 CHEMBL524153 Ki 94.4 nM
COc1cccc2c1CC[C@H]1CN(CCn3c(=O)[nH]c4c(sc5cccnc54)c3=O)C[C@@H]21 CHEMBL40650 Ki 94.9 nM
Clc1cccc(Cl)c1Nc1ncc[nH]1 CHEMBL1022 Ki 95.0 nM
O=C(OCCN1CCCC1)N1c2ccccc2Sc2ccccc21 CHEMBL481153 Ki 95.0 nM
Brc1ccccc1OCC1=NCCN1 CHEMBL2431279 pKi 95.5 nM
COc1ccccc1N1CCN(CCCCn2ncc(=O)n(C)c2=O)CC1 CHEMBL2413154 Ki 96.0 nM
CN(C)c1nc(N[C@H]2CC[C@@H](NC(=O)c3cccc([N+](=O)[O-])c3)CC2)nc2ccccc12 CHEMBL181383 IC50 97.0 nM
Nc1nc(NC[C@H]2CC[C@H](CNS(=O)(=O)c3cccc4ccccc34)CC2)nc2ccccc12 CHEMBL17645 IC50 97.0 nM
CCS(=O)(=O)Nc1cccc2c1CCC2c1c[nH]cn1 CHEMBL111771 Log Ki 97.72 nM
C[C@H](Oc1ccccc1-c1cccc(O)c1)C1=NCCN1 CHEMBL1278085 pKi 97.72 nM
CCOc1ccccc1OC(C)C1=NCCN1 CHEMBL1956196 pKi 97.72 nM
COc1cc2c(cc1OC)C1=NOC(CN3CCN(Cc4cc5ccccc5s4)CC3)C1CO2 CHEMBL94435 Ki 98.0 nM
CCC1=C(C(N)=O)C(c2ccc([N+](=O)[O-])cc2)C(C(=O)NCCCN2CCC(c3ccccc3)(c3ccccc3)CC2)=C(CCCCOC)N1 CHEMBL99864 Ki 99.0 nM
CCCN1C[C@H](CSC)C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]21 CHEMBL531 Ki 99.0 nM
CN1CCC2=C(C1)c1ccccc1Cc1ccccc12 CHEMBL2104895 AC50 99.6 nM