HOME LIGAND hPROTEOME OTHERS DOCUMENT

P01275 | GLUC_HUMAN | Pro-glucagon (GCG)

3D structures mapped by conservation among orthologs



[ Alpha Fold Model ] (go)


Known binders annotated in ChEMBL

Ki table

molecule_chembl_id structure assay_type relation values units mol_wt smiles organism assay_chembl_id bao_label
CHEMBL3617567 OBDepict HO O HN O N H CH 3 CH 3 N N N N F F F Ki = 5.55 nM 516.52 CC1(C)CC(C(Nc2cnc(-n3cc(C(F)(F)F)cn3)nc2)c2ccc(C(=O)NCCC(=O)O)cc2)C1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3648156 OBDepict OH O HN O O CH 3 CH 3 N N F F F Ki = 5.75 nM 515.53 Cc1cc(OC(c2ccc(C(=O)NCCC(=O)O)cc2)C2CCC2)cc(C)c1-n1cc(C(F)(F)F)cn1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3648139 OBDepict HO O HN O N H CH 3 CH 3 N N N F F F Ki = 7.6 nM 515.54 CC1(C)CC(C(Nc2ccc(-n3cc(C(F)(F)F)cn3)nc2)c2ccc(C(=O)NCCC(=O)O)cc2)C1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3648191 OBDepict HO O HN O N H H N N N F F F Ki = 9.05 nM 515.54 O=C(O)CCNC(=O)c1ccc([C@@H](Nc2ccc(-n3cc(C(F)(F)F)cn3)nc2)C2CCCCC2)cc1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3648133 OBDepict OH O NH O N H N N N F F F Ki = 17.0 nM 515.54 O=C(O)CCNC(=O)c1ccc(C(Nc2ccc(-n3cc(C(F)(F)F)cn3)nc2)C2CCCCC2)cc1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3648188 OBDepict CH 3 N H H N HN O N N O OH H 3 C H 3 C CH 3 Ki = 20.2 nM 463.58 CCC[C@H](Nc1ccc(-n2cc(C(C)(C)C)cn2)nc1)c1ccc(C(=O)NCCC(=O)O)cc1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3681967 OBDepict OH O HN O HN CH 3 CH 3 N F Ki = 25.0 nM 449.53 CC1(C)CC(C(Nc2cnc3cc(F)ccc3c2)c2ccc(C(=O)NCCC(=O)O)cc2)C1 Homo sapiens CHEMBL3705610 assay format
CHEMBL3648192 OBDepict HO O HN O N H H N N N F F F Ki = 26.7 nM 515.54 O=C(O)CCNC(=O)c1ccc([C@H](Nc2ccc(-n3cc(C(F)(F)F)cn3)nc2)C2CCCCC2)cc1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3648171 OBDepict CH 3 H 3 C N H H N H 3 C CH 3 N N NH O F F F O OH Ki = 27.4 nM 517.55 Cc1cc([C@@H](CC(C)C)Nc2ccc(C(=O)NCCC(=O)O)cn2)cc(C)c1-n1cc(C(F)(F)F)cn1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3648167 OBDepict H 3 C NH N HN O N N O OH Ki = 29.0 nM 483.57 CCCC(Nc1ccc(-n2cc(-c3ccccc3)cn2)nc1)c1ccc(C(=O)NCCC(=O)O)cc1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3648151 OBDepict CH 3 N H N N H O N N O OH Ki = 29.3 nM 483.57 CCCC(Nc1ccc(-n2cnc(-c3ccccc3)c2)nc1)c1ccc(C(=O)NCCC(=O)O)cc1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3648187 OBDepict CH 3 N H H N HN O N N O OH H 3 C H 3 C CH 3 Ki = 30.2 nM 463.58 CCC[C@@H](Nc1ccc(-n2cc(C(C)(C)C)cn2)nc1)c1ccc(C(=O)NCCC(=O)O)cc1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3648164 OBDepict CH 3 O CH 3 O N H O N CH 3 N O OH F F F Ki = 32.3 nM 519.52 CCCC(Oc1cc(C)c(-n2cc(C(F)(F)F)cn2)c(OC)c1)c1ccc(C(=O)NCCC(=O)O)cc1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3617574 OBDepict OH O NH O Cl N H Cl Cl Ki = 33.0 nM 553.87 O=C(O)CCNC(=O)c1ccc(-c2cc(Cl)ccc2CNc2ccc(-c3ccc(Cl)cc3Cl)cc2)cc1 Homo sapiens CHEMBL3705741 cell-based format
CHEMBL3648186 OBDepict HO O N H O N H H CH 3 CH 3 N N N F F F Ki = 35.0 nM 515.54 CC1(C)CC([C@H](Nc2ccc(-n3cnc(C(F)(F)F)c3)nc2)c2ccc(C(=O)NCCC(=O)O)cc2)C1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3648163 OBDepict OH O HN O O CH 3 CH 3 CH 3 CH 3 N N F F F Ki = 35.2 nM 543.59 Cc1cc(OC(c2ccc(C(=O)NCCC(=O)O)cc2)C2CC(C)(C)C2)cc(C)c1-n1cc(C(F)(F)F)cn1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3673117 OBDepict OH O NH O N H + N F O _ O Ki = 38.0 nM 513.53 O=C(O)CCNC(=O)c1ccc(-c2ccccc2CNc2ccc(-c3ccc(F)c([N+](=O)[O-])c3)cc2)cc1 Homo sapiens CHEMBL3705741 cell-based format
CHEMBL2381823 OBDepict CH 3 N H N N N H O N N O OH F F F Ki = 38.2 nM 476.46 CCCC(Nc1cnc(-n2cc(C(F)(F)F)cn2)nc1)c1ccc(C(=O)NCCC(=O)O)cc1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3617569 OBDepict OH O N H O N H N H 3 C H 3 C CH 3 F Ki = 39.0 nM 463.55 Cc1cc2cc(F)ccc2nc1NC(c1ccc(C(=O)NCCC(=O)O)cc1)C1CC(C)(C)C1 Homo sapiens CHEMBL3705610 assay format
CHEMBL3648195 OBDepict CH 3 O O N H O N H H 3 C H 3 C N N N N F F F Ki = 41.0 nM 544.58 CCOC(=O)CCNC(=O)c1ccc(C(Nc2cnc(-n3cc(C(F)(F)F)cn3)nc2)C2CC(C)(C)C2)cc1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3648181 OBDepict HO O HN O N H CH 3 CH 3 N N N F F F Ki = 42.2 nM 515.54 CC1(C)CC(C(Nc2ccc(-n3cnc(C(F)(F)F)c3)nc2)c2ccc(C(=O)NCCC(=O)O)cc2)C1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3648183 OBDepict HO O HN O N H N N N N F F F Ki = 44.7 nM 502.5 O=C(O)CCNC(=O)c1ccc(C(Nc2cnc(-n3cnc(C(F)(F)F)c3)nc2)C2CCCC2)cc1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3673116 OBDepict OH O NH O CH 3 N H Cl Ki = 45.0 nM 499.01 Cc1cc(C(=O)NCCC(=O)O)ccc1-c1ccccc1CNc1ccc(-c2ccc(Cl)cc2)cc1 Homo sapiens CHEMBL3705741 cell-based format
CHEMBL3648145 OBDepict HO O HN O N H N N N CH 3 H 3 C CH 3 Ki = 45.7 nM 489.62 CC(C)(C)c1cn(-c2ccc(NC(c3ccc(C(=O)NCCC(=O)O)cc3)C3CCCC3)cn2)cn1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3648184 OBDepict H 3 C O H CH 3 H 3 C NH O N N O OH Ki = 47.8 nM 485.58 CCC[C@H](Oc1cc(C)c(-n2cc3ccccc3n2)c(C)c1)c1ccc(C(=O)NCCC(=O)O)cc1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3681968 OBDepict OH O HN O HN CH 3 CH 3 N F Ki = 50.0 nM 449.53 CC1(C)CC(C(Nc2cnc3ccc(F)cc3c2)c2ccc(C(=O)NCCC(=O)O)cc2)C1 Homo sapiens CHEMBL3705610 assay format
CHEMBL3648153 OBDepict HO O NH O O CH 3 H 3 C N N F F F Ki = 51.0 nM 529.56 Cc1cc(OC(c2ccc(C(=O)NCCC(=O)O)cc2)C2CCCC2)cc(C)c1-n1cnc(C(F)(F)F)c1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3648190 OBDepict H 3 C CH 3 N H H N N NH O N N O OH F F F Ki = 57.4 nM 490.49 CC(C)C[C@H](Nc1ccc(-n2cc(C(F)(F)F)cn2)nc1)c1ccc(C(=O)NCCC(=O)O)cn1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3648155 OBDepict H 3 C O N HN O N N O OH Ki = 58.0 nM 484.56 CCCC(Oc1ccc(-n2cc(-c3ccccc3)cn2)nc1)c1ccc(C(=O)NCCC(=O)O)cc1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3673123 OBDepict OH O NH O N H Cl Ki = 60.0 nM 484.98 O=C(O)CCNC(=O)c1ccc(-c2ccccc2CNc2ccc(-c3ccc(Cl)cc3)cc2)cc1 Homo sapiens CHEMBL3705741 cell-based format
CHEMBL3648160 OBDepict CH 3 O CH 3 CH 3 NH O N N O HO Ki = 62.6 nM 475.59 CCCC(Oc1cc(C)c(-n2cc(C3CC3)cn2)c(C)c1)c1ccc(C(=O)NCCC(=O)O)cc1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3648158 OBDepict CH 3 O N H O N N O OH Cl Ki = 62.8 nM 491.98 CCCC(Oc1ccc(-n2cc3cc(Cl)ccc3n2)cc1)c1ccc(C(=O)NCCC(=O)O)cc1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3648168 OBDepict HO O HN O N H N N N Cl CH 3 Ki = 65.9 nM 481.98 Cc1nn(-c2ccc(NC(c3ccc(C(=O)NCCC(=O)O)cc3)C3CCCC3)cn2)cc1Cl Homo sapiens CHEMBL3705314 single protein format
CHEMBL3648134 OBDepict CH 3 H 3 C N H N CH 3 HN O N N O OH F F F Ki = 69.8 nM 503.53 Cc1cc(NC(CC(C)C)c2ccc(C(=O)NCCC(=O)O)cc2)cnc1-n1cc(C(F)(F)F)cn1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3648136 OBDepict OH O NH O NH N N N F F F Ki = 71.6 nM 487.48 O=C(O)CCNC(=O)c1ccc(C(CC2CC2)Nc2ccc(-n3cc(C(F)(F)F)cn3)nc2)cc1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3617568 OBDepict OH O N H O N H N H 3 C H 3 C CH 3 Ki = 74.0 nM 445.56 Cc1cc2ccccc2nc1NC(c1ccc(C(=O)NCCC(=O)O)cc1)C1CC(C)(C)C1 Homo sapiens CHEMBL3705610 assay format
CHEMBL3648176 OBDepict OH O NH O N H H 3 C CH 3 H 3 C N N N F F F Ki = 87.2 nM 489.5 CC(C)(C)C(Nc1ccc(-n2cnc(C(F)(F)F)c2)nc1)c1ccc(C(=O)NCCC(=O)O)cc1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3648146 OBDepict HO O HN O N H N N N CH 3 CH 3 Ki = 88.4 nM 475.59 CC(C)c1cn(-c2ccc(NC(c3ccc(C(=O)NCCC(=O)O)cc3)C3CCCC3)cn2)cn1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3648159 OBDepict CH 3 O CH 3 H 3 C N H O N N O OH F F F Ki = 89.5 nM 503.52 CCCC(Oc1cc(C)c(-n2cnc(C(F)(F)F)c2)c(C)c1)c1ccc(C(=O)NCCC(=O)O)cc1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3681963 OBDepict CH 3 H 3 C N H N NH O F F F O HO Ki = 91.0 nM 473.5 CC(C)CC(Nc1ccc2cc(C(F)(F)F)ccc2n1)c1ccc(C(=O)NCCC(=O)O)cc1 Homo sapiens CHEMBL3705610 assay format
CHEMBL3648135 OBDepict OH O N H O N H N N N F F F Ki = 91.9 nM 487.48 O=C(O)CCNC(=O)c1ccc(C(Nc2ccc(-n3cc(C(F)(F)F)cn3)nc2)C2CCC2)cc1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3648132 OBDepict HO O HN O N H N N N F F F Ki = 93.0 nM 501.51 O=C(O)CCNC(=O)c1ccc(C(Nc2ccc(-n3cnc(C(F)(F)F)c3)nc2)C2CCCC2)cc1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3648193 OBDepict HO O HN O O CH 3 CH 3 N N N N F F F Ki = 94.9 nM 517.51 CC1(C)CC(C(Oc2cnc(-n3cc(C(F)(F)F)cn3)nc2)c2ccc(C(=O)NCCC(=O)O)cc2)C1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3648147 OBDepict CH 3 O N H O N N O OH CH 3 Ki = 98.2 nM 471.56 CCCC(Oc1ccc(-n2cc3cccc(C)c3n2)cc1)c1ccc(C(=O)NCCC(=O)O)cc1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3681959 OBDepict H 3 C CH 3 N H N CH 3 HN O O OH Ki = 101.0 nM 419.53 Cc1cc2ccccc2nc1NC(CC(C)C)c1ccc(C(=O)NCCC(=O)O)cc1 Homo sapiens CHEMBL3705610 assay format
CHEMBL3648174 OBDepict H 3 C NH N HN O N N O OH Ki = 101.0 nM 447.54 CCCC(Nc1ccc(-n2cc(C3CC3)cn2)nc1)c1ccc(C(=O)NCCC(=O)O)cc1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3648142 OBDepict HO O HN O O N N Ki = 103.0 nM 483.57 O=C(O)CCNC(=O)c1ccc(C(Oc2ccc(-n3cc4ccccc4n3)cc2)C2CCCC2)cc1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3681965 OBDepict CH 3 H 3 C N H N CH 3 NH O O HO Ki = 109.0 nM 419.53 Cc1c(NC(CC(C)C)c2ccc(C(=O)NCCC(=O)O)cc2)cnc2ccccc12 Homo sapiens CHEMBL3705610 assay format
CHEMBL3648180 OBDepict CH 3 O CH 3 H 3 C N H O N N O OH Ki = 109.0 nM 485.58 CCCC(Oc1cc(C)c(-n2cc3ccccc3n2)c(C)c1)c1ccc(C(=O)NCCC(=O)O)cc1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL2381825 OBDepict CH 3 O N H O N N O OH Ki = 109.0 nM 457.53 CCCC(Oc1ccc(-n2cc3ccccc3n2)cc1)c1ccc(C(=O)NCCC(=O)O)cc1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3648185 OBDepict HO O N H O N H H CH 3 CH 3 N N N F F F Ki = 110.0 nM 515.54 CC1(C)CC([C@@H](Nc2ccc(-n3cnc(C(F)(F)F)c3)nc2)c2ccc(C(=O)NCCC(=O)O)cc2)C1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3648152 OBDepict CH 3 O CH 3 H 3 C N H O N N Cl O OH Ki = 116.0 nM 469.97 CCCC(Oc1cc(C)c(-n2cc(Cl)cn2)c(C)c1)c1ccc(C(=O)NCCC(=O)O)cc1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3673118 OBDepict HO O N H O F Cl N H Cl Ki = 120.0 nM 537.42 O=C(O)CCNC(=O)c1ccc(-c2cc(Cl)ccc2CNc2ccc(-c3ccc(Cl)cc3)cc2)cc1F Homo sapiens CHEMBL3705741 cell-based format
CHEMBL3648161 OBDepict CH 3 O CH 3 H 3 C N H O N N N O OH F F F Ki = 125.0 nM 504.51 CCCC(Oc1cc(C)c(-n2cc(C(F)(F)F)nn2)c(C)c1)c1ccc(C(=O)NCCC(=O)O)cc1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3648154 OBDepict H 3 C NH N N HN O N N O OH Ki = 132.0 nM 484.56 CCCC(Nc1ccc(-n2cc(-c3ccccc3)cn2)nc1)c1ccc(C(=O)NCCC(=O)O)cn1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3681966 OBDepict OH O N H O N H N H 3 C H 3 C CH 3 F Ki = 133.0 nM 463.55 Cc1cc2ccc(F)cc2nc1NC(c1ccc(C(=O)NCCC(=O)O)cc1)C1CC(C)(C)C1 Homo sapiens CHEMBL3705610 assay format
CHEMBL3648178 OBDepict CH 3 O N H O N N O OH F Ki = 137.0 nM 475.52 CCCC(Oc1ccc(-n2cc3cc(F)ccc3n2)cc1)c1ccc(C(=O)NCCC(=O)O)cc1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3648170 OBDepict H 3 C NH N N O N CH 3 N O OH Ki = 142.0 nM 497.6 CCCC(Nc1ccc(-n2cc(-c3ccccc3)cn2)nc1)c1ccc(C(=O)N(C)CCC(=O)O)cc1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3648137 OBDepict CH 3 N H F N N H O N N O OH F F F Ki = 153.0 nM 493.46 CCCC(Nc1ccc(-n2cc(C(F)(F)F)cn2)nc1)c1ccc(C(=O)NCCC(=O)O)cc1F Homo sapiens CHEMBL3705314 single protein format
CHEMBL3681969 OBDepict H 3 C CH 3 N H N HN O CH 3 O OH Ki = 160.0 nM 419.53 Cc1ccc2ncc(NC(CC(C)C)c3ccc(C(=O)NCCC(=O)O)cc3)cc2c1 Homo sapiens CHEMBL3705610 assay format
CHEMBL3648148 OBDepict CH 3 O N H O N N O OH H 3 C Ki = 161.0 nM 471.56 CCCC(Oc1ccc(-n2cc3ccc(C)cc3n2)cc1)c1ccc(C(=O)NCCC(=O)O)cc1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3681950 OBDepict H 3 C N H H N CH 3 N H O O OH Ki = 173.0 nM 405.5 CCC[C@@H](Nc1nc2ccccc2cc1C)c1ccc(C(=O)NCCC(=O)O)cc1 Homo sapiens CHEMBL3705610 assay format
CHEMBL3648179 OBDepict CH 3 O N H O N N O OH F Ki = 175.0 nM 475.52 CCCC(Oc1ccc(-n2cc3ccc(F)cc3n2)cc1)c1ccc(C(=O)NCCC(=O)O)cc1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3648141 OBDepict OH O N H O N HN H 3 C N N F F F Ki = 183.0 nM 529.56 Cc1cc(-n2cc(C(F)(F)F)cn2)ccc1C(Nc1ccc(C(=O)NCCC(=O)O)cn1)C1CCCCC1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3648169 OBDepict H 3 C NH N HN O N N O OH N Ki = 192.0 nM 484.56 CCCC(Nc1ccc(-n2cc(-c3ccccn3)cn2)nc1)c1ccc(C(=O)NCCC(=O)O)cc1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3648172 OBDepict CH 3 H 3 C N H H N H 3 C CH 3 N N NH O F F F O OH Ki = 193.0 nM 517.55 Cc1cc([C@H](CC(C)C)Nc2ccc(C(=O)NCCC(=O)O)cn2)cc(C)c1-n1cc(C(F)(F)F)cn1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3681958 OBDepict H 3 C CH 3 N H N CH 3 HN O O OH Ki = 198.0 nM 419.53 Cc1cc(NC(CC(C)C)c2ccc(C(=O)NCCC(=O)O)cc2)nc2ccccc12 Homo sapiens CHEMBL3705610 assay format
CHEMBL3681961 OBDepict CH 3 H 3 C N H N NH O Cl O HO Ki = 199.0 nM 439.94 CC(C)CC(Nc1ccc2cccc(Cl)c2n1)c1ccc(C(=O)NCCC(=O)O)cc1 Homo sapiens CHEMBL3705610 assay format
CHEMBL3648138 OBDepict CH 3 N H CH 3 N N H O N N O OH F F F Ki = 202.0 nM 489.5 CCCC(Nc1ccc(-n2cc(C(F)(F)F)cn2)nc1)c1ccc(C(=O)NCCC(=O)O)cc1C Homo sapiens CHEMBL3705314 single protein format
CHEMBL2381850 OBDepict CH 3 O CH 3 N H O N N O OH F F F Ki = 203.0 nM 489.49 CCCC(Oc1ccc(-n2cc(C(F)(F)F)cn2)c(C)c1)c1ccc(C(=O)NCCC(=O)O)cc1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3648150 OBDepict CH 3 O N H O N N O OH CH 3 Ki = 208.0 nM 471.56 CCCC(Oc1ccc(-n2cc3cc(C)ccc3n2)cc1)c1ccc(C(=O)NCCC(=O)O)cc1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3648173 OBDepict OH O NH O N N H CH 3 CH 3 N N F F F Ki = 224.0 nM 529.56 Cc1cc(C(Nc2ccc(C(=O)NCCC(=O)O)cn2)C2CCCC2)cc(C)c1-n1cc(C(F)(F)F)cn1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3648143 OBDepict HO O HN O N H N N N Cl Ki = 225.0 nM 467.96 O=C(O)CCNC(=O)c1ccc(C(Nc2ccc(-n3cnc(Cl)c3)nc2)C2CCCC2)cc1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL2381829 OBDepict CH 3 O N N H O N N O OH F F F Ki = 233.0 nM 476.46 CCCC(Oc1ccc(-n2cc(C(F)(F)F)cn2)nc1)c1ccc(C(=O)NCCC(=O)O)cc1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3648165 OBDepict OH O HN O N H F F N N N F F F Ki = 235.0 nM 523.46 O=C(O)CCNC(=O)c1ccc(C(Nc2ccc(-n3cnc(C(F)(F)F)c3)nc2)C2CC(F)(F)C2)cc1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3681952 OBDepict CH 3 H 3 C N H N NH O O HO Ki = 240.0 nM 405.5 CC(C)CC(Nc1cnc2ccccc2c1)c1ccc(C(=O)NCCC(=O)O)cc1 Homo sapiens CHEMBL3705610 assay format
CHEMBL3648177 OBDepict CH 3 O F F N H O N N O OH F F F Ki = 240.0 nM 511.45 CCCC(Oc1cc(F)c(-n2cc(C(F)(F)F)cn2)c(F)c1)c1ccc(C(=O)NCCC(=O)O)cc1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3673120 OBDepict OH O NH O F Cl N H Cl Cl Ki = 240.0 nM 571.86 O=C(O)CCNC(=O)c1ccc(-c2cc(Cl)ccc2CNc2ccc(-c3ccc(Cl)cc3Cl)cc2)cc1F Homo sapiens CHEMBL3705741 cell-based format
CHEMBL3673119 OBDepict HO O N H O F Cl N H F Ki = 240.0 nM 520.96 O=C(O)CCNC(=O)c1ccc(-c2cc(Cl)ccc2CNc2ccc(-c3ccc(F)cc3)cc2)cc1F Homo sapiens CHEMBL3705741 cell-based format
CHEMBL3681960 OBDepict H 3 C CH 3 N H N CH 3 HN O F O OH Ki = 242.0 nM 437.52 Cc1cc(NC(CC(C)C)c2ccc(C(=O)NCCC(=O)O)cc2)nc2cc(F)ccc12 Homo sapiens CHEMBL3705610 assay format
CHEMBL3648194 OBDepict CH 3 O O N H O O H 3 C H 3 C N N N N F F F Ki = 251.0 nM 545.56 CCOC(=O)CCNC(=O)c1ccc(C(Oc2cnc(-n3cc(C(F)(F)F)cn3)nc2)C2CC(C)(C)C2)cc1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3645574 OBDepict H 3 C O N NH O O HO CH 3 H 3 C Ki = 254.0 nM 474.6 CCCC(Oc1ccc(-c2ccc(CC(C)C)cc2)nc1)c1ccc(C(=O)NCCC(=O)O)cc1 Homo sapiens CHEMBL3705719 single protein format
CHEMBL3645573 OBDepict CH 3 H 3 C S NH O CH 3 O HO H 3 C Ki = 265.0 nM 475.65 Cc1ccc(-c2ccc(SC(CC(C)C)c3ccc(C(=O)NCCC(=O)O)cc3)cc2)cc1C Homo sapiens CHEMBL3705719 single protein format
CHEMBL3673121 OBDepict OH O N H O Cl N H CH 3 Cl Ki = 270.0 nM 533.46 CC(Nc1ccc(-c2ccc(Cl)cc2)cc1)c1ccc(Cl)cc1-c1ccc(C(=O)NCCC(=O)O)cc1 Homo sapiens CHEMBL3705741 cell-based format
CHEMBL3681951 OBDepict H 3 C N H H N CH 3 N H O O OH Ki = 280.0 nM 405.5 CCC[C@H](Nc1nc2ccccc2cc1C)c1ccc(C(=O)NCCC(=O)O)cc1 Homo sapiens CHEMBL3705610 assay format
CHEMBL3648144 OBDepict HO O HN O N H F F F N N N F F F Ki = 298.0 nM 501.39 O=C(O)CCNC(=O)c1ccc(C(Nc2ccc(-n3cnc(C(F)(F)F)c3)nc2)C(F)(F)F)cc1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3648166 OBDepict CH 3 O CH 3 N H O N N O OH F F F Ki = 315.0 nM 489.49 CCCC(Oc1ccc(-n2cc(C(F)(F)F)cn2)cc1C)c1ccc(C(=O)NCCC(=O)O)cc1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3648149 OBDepict CH 3 O N H O N N O OH H 3 C Ki = 316.0 nM 471.56 CCCC(Oc1ccc(-n2cc3c(C)cccc3n2)cc1)c1ccc(C(=O)NCCC(=O)O)cc1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3648157 OBDepict CH 3 O N H O N N O OH Cl Ki = 354.0 nM 491.98 CCCC(Oc1ccc(-n2cc3cccc(Cl)c3n2)cc1)c1ccc(C(=O)NCCC(=O)O)cc1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3681964 OBDepict H 3 C CH 3 N H CH 3 N HN O O OH Ki = 360.0 nM 419.53 Cc1nc2ccccc2cc1NC(CC(C)C)c1ccc(C(=O)NCCC(=O)O)cc1 Homo sapiens CHEMBL3705610 assay format
CHEMBL3648182 OBDepict H 3 C NH N N N N N H O F F F O OH Ki = 399.0 nM 476.46 CCCC(Nc1ccc(C(=O)NCCC(=O)O)cn1)c1ccc(-n2cc(C(F)(F)F)cn2)nc1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3648175 OBDepict OH O NH O N H O N N N F F F Ki = 432.0 nM 517.51 O=C(O)CCNC(=O)c1ccc(C(Nc2ccc(-n3cc(C(F)(F)F)cn3)nc2)C2CCOCC2)cc1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3648162 OBDepict CH 3 O N CH 3 N H O N N O OH F F F Ki = 446.0 nM 490.48 CCCC(Oc1cnc(-n2cc(C(F)(F)F)cn2)c(C)c1)c1ccc(C(=O)NCCC(=O)O)cc1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3681954 OBDepict CH 3 H 3 C N H N NH O O HO Ki = 452.0 nM 405.5 CC(C)CC(Nc1ccc2ccccc2n1)c1ccc(C(=O)NCCC(=O)O)cc1 Homo sapiens CHEMBL3705610 assay format
CHEMBL3648140 OBDepict CH 3 O CH 3 N H O N N O OH Ki = 464.0 nM 471.56 CCCC(Oc1ccc(-n2cc3ccccc3n2)c(C)c1)c1ccc(C(=O)NCCC(=O)O)cc1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3681962 OBDepict CH 3 H 3 C N H N NH O F F F O HO Ki = 479.0 nM 473.5 CC(C)CC(Nc1ccc2ccc(C(F)(F)F)cc2n1)c1ccc(C(=O)NCCC(=O)O)cc1 Homo sapiens CHEMBL3705610 assay format
CHEMBL3681957 OBDepict CH 3 H 3 C N H N NH O O HO Ki = 531.0 nM 405.5 CC(C)CC(Nc1cc2ccccc2cn1)c1ccc(C(=O)NCCC(=O)O)cc1 Homo sapiens CHEMBL3705610 assay format
CHEMBL3648131 OBDepict CH 3 O N H O N H 3 C N O OH F F F Ki = 556.0 nM 489.49 CCCC(Oc1ccc(-c2cc(C(F)(F)F)nn2C)cc1)c1ccc(C(=O)NCCC(=O)O)cc1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3648189 OBDepict H 3 C CH 3 N H H N N NH O N N O OH F F F Ki = 636.0 nM 490.49 CC(C)C[C@@H](Nc1ccc(-n2cc(C(F)(F)F)cn2)nc1)c1ccc(C(=O)NCCC(=O)O)cn1 Homo sapiens CHEMBL3705314 single protein format
CHEMBL3648129 OBDepict CH 3 O N H O N N Cl H 3 C O OH Ki = 665.0 nM 455.94 CCCC(Oc1ccc(-n2cc(Cl)c(C)n2)cc1)c1ccc(C(=O)NCCC(=O)O)cc1 Homo sapiens CHEMBL3705314 single protein format