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P50052 | AGTR2_HUMAN | Type-2 angiotensin II receptor (AGTR2)

3D structures mapped by conservation among orthologs

[ Domain: "Family A G protein-coupled receptor-like" // 7tm_1_1 ]

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[ Domain: "Family A G protein-coupled receptor-like" // 7tm_1_1,Cytochrom_B562_1 ]

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[ Domain: "Cytochromes" // 7tm_1_1 ]

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[ Alpha Fold Model ] (go)


Known binders annotated in ChEMBL

IC50 table Ki table

molecule_chembl_id structure assay_type relation values units mol_wt smiles organism assay_chembl_id bao_label
CHEMBL7550 OBDepict CH 3 N N N CH 3 H 3 C N N N N H IC50 = 0.2 nM 409.5 CCc1nc2c(C)cc(C)nc2n1Cc1ccc(-c2ccccc2-c2nn[nH]n2)cc1 Homo sapiens CHEMBL1670671 single protein format
CHEMBL1017 OBDepict CH 3 N N CH 3 N N H 3 C O HO IC50 = 0.33 nM 514.63 CCCc1nc2c(C)cc(-c3nc4ccccc4n3C)cc2n1Cc1ccc(-c2ccccc2C(=O)O)cc1 Homo sapiens CHEMBL1949357 single protein format
CHEMBL189568 OBDepict H 3 C O N H O S O O S H 3 C H 3 C N N Ki = 0.4 nM 475.64 CCCCOC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1ccc(Cn2ccnc2)cc1 Homo sapiens CHEMBL829700 assay format
CHEMBL361927 OBDepict H 3 C O N H O S O O S H 3 C H 3 C N CH 3 N Ki = 0.5 nM 489.66 CCCCOC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1ccc(Cn2ccnc2C)cc1 Homo sapiens CHEMBL829700 assay format
CHEMBL215160 OBDepict CH 3 O S HN O O O O CH 3 N N Ki = 0.5 nM 485.61 CCCCOC(=O)NS(=O)(=O)c1ccc(OCCCC)cc1-c1ccc(Cn2ccnc2)cc1 Homo sapiens CHEMBL907246 cell membrane format
CHEMBL157510 OBDepict CH 3 O O N H O _ O O + K IC50 = 0.58 nM 545.68 COc1ccc2c(c1OCc1ccccc1)C[C@@H](C(=O)[O-])N(C(=O)C(c1ccccc1)c1ccccc1)C2.[K+] Homo sapiens CHEMBL643791 cell membrane format
CHEMBL34124 OBDepict H 3 C O O N H O OH O IC50 = 0.58 nM 507.59 COc1ccc2c(c1OCc1ccccc1)C[C@@H](C(=O)O)N(C(=O)C(c1ccccc1)c1ccccc1)C2 Homo sapiens CHEMBL647513 single protein format
CHEMBL217673 OBDepict CH 3 O N H O S O O H 3 C CH 3 N N Ki = 0.6 nM 469.61 CCCCOC(=O)NS(=O)(=O)c1ccc(CC(C)C)cc1-c1ccc(Cn2ccnc2)cc1 Homo sapiens CHEMBL907246 cell membrane format
CHEMBL289614 OBDepict CH 3 O HN O S O O H 3 C CH 3 N N N H 3 C H 3 C CH 3 IC50 = 0.7 nM 576.76 CCCCOC(=O)NS(=O)(=O)c1ccc(CC(C)C)cc1-c1ccc(Cn2c(CC)nc3c(C)cc(C)nc32)cc1 Homo sapiens CHEMBL648580 cell membrane format
CHEMBL155836 OBDepict CH 3 O O N O HO O IC50 = 0.84 nM 507.59 COc1ccc2c(c1OCc1ccccc1)CC(C(=O)O)N(C(=O)C(c1ccccc1)c1ccccc1)C2 Homo sapiens CHEMBL643791 cell membrane format
CHEMBL290829 OBDepict O N N N H O OH N O IC50 = 0.89 nM 520.59 O=C(O)[C@@H]1CN(C(=O)N(c2ccccc2)c2ccccc2)CCN1C(=O)N(c1ccccc1)c1ccccc1 Homo sapiens CHEMBL643791 cell membrane format
CHEMBL187880 OBDepict H 3 C N H O N H H O N H N N S H O H N H O NH H H 3 C CH 3 OH O CH 3 Ki = 1.0 nM 599.71 CNC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CS[C@H]2C[C@@](Cc3ccc(O)cc3)(NC(=O)[C@@H](NC(C)=O)C(C)C)C(=O)N21 Homo sapiens CHEMBL829041 single protein format
CHEMBL216250 OBDepict CH 3 O HN O S O O S H 3 C CH 3 N N Ki = 1.0 nM 489.66 CCCCOCC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1ccc(Cn2ccnc2)cc1 Homo sapiens CHEMBL907246 cell membrane format
CHEMBL294512 OBDepict CH 3 N N CH 3 O O F CH 3 S N H O O O O H 3 C CH 3 IC50 = 1.0 nM 573.69 CCCc1nc(CC)c(C(=O)OC)n1Cc1ccc(-c2ccccc2S(=O)(=O)NC(=O)OCCC(C)C)cc1F Homo sapiens CHEMBL643595 single protein format
CHEMBL154057 OBDepict CH 3 O O N O HO O IC50 = 1.1 nM 499.61 COc1ccc2c(c1OCc1ccccc1)CC(C(=O)O)N(C(=O)C(c1ccccc1)C1CCCC1)C2 Homo sapiens CHEMBL643791 cell membrane format
CHEMBL39959 OBDepict CH 3 O N H O S O O H 3 C N N N CH 3 H 3 C CH 3 Ki = 1.5 nM 562.74 CCCCOC(=O)NS(=O)(=O)c1ccc(CCC)cc1-c1ccc(Cn2c(CC)nc3c(C)cc(C)nc32)cc1 Homo sapiens CHEMBL3777314 single protein format
CHEMBL156100 OBDepict CH 3 O O N O OH O CH 3 O CH 3 IC50 = 1.9 nM 551.64 COc1ccc(COc2c(OC)ccc3c2CC(C(=O)O)N(C(=O)C(c2ccccc2)c2ccccc2)C3)cc1C Homo sapiens CHEMBL643791 cell membrane format
CHEMBL288174 OBDepict H 3 C O N H O S O O S H 3 C H 3 C N N N CH 3 CH 3 CH 3 IC50 = 2.0 nM 582.79 CCCCOC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1ccc(Cn2c(CC)nc3c(C)cc(C)nc32)cc1 Homo sapiens CHEMBL648581 cell membrane format
CHEMBL214525 OBDepict CH 3 S N H O O O O CH 3 N N Ki = 2.0 nM 441.55 CCCCc1ccc(S(=O)(=O)NC(=O)OCC)c(-c2ccc(Cn3ccnc3)cc2)c1 Homo sapiens CHEMBL907246 cell membrane format
CHEMBL289614 OBDepict CH 3 O HN O S O O H 3 C CH 3 N N N H 3 C H 3 C CH 3 Ki = 2.1 nM 576.76 CCCCOC(=O)NS(=O)(=O)c1ccc(CC(C)C)cc1-c1ccc(Cn2c(CC)nc3c(C)cc(C)nc32)cc1 Homo sapiens CHEMBL3777314 single protein format
CHEMBL58156 OBDepict CH 3 N N N CH 3 CH 3 S N N N N H IC50 = 2.3 nM 415.53 CCc1nc2c(C)cc(C)nc2n1Cc1ccc(-c2ccsc2-c2nn[nH]n2)cc1 Homo sapiens CHEMBL1670671 single protein format
CHEMBL288174 OBDepict H 3 C O N H O S O O S H 3 C H 3 C N N N CH 3 CH 3 CH 3 Ki = 2.8 nM 582.79 CCCCOC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1ccc(Cn2c(CC)nc3c(C)cc(C)nc32)cc1 Homo sapiens CHEMBL648317 cell membrane format
CHEMBL190577 OBDepict H 3 C O N H O S O O S H 3 C H 3 C N N CH 3 Ki = 3.2 nM 553.75 CCCCOC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1ccc(Cn2c(CC)nc3ccccc32)cc1 Homo sapiens CHEMBL829700 assay format
CHEMBL190286 OBDepict H 3 C N H O N H H O N H N N S H O H N H O NH H H 3 C CH 3 OH O CH 3 Ki = 3.7 nM 599.71 CNC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CS[C@@H]2C[C@@](Cc3ccc(O)cc3)(NC(=O)[C@@H](NC(C)=O)C(C)C)C(=O)N21 Homo sapiens CHEMBL829041 single protein format
CHEMBL384462 OBDepict H 3 C N CH 3 N H O S O O S CH 3 H 3 C N N Ki = 4.0 nM 488.68 CCCCN(C)C(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1ccc(Cn2ccnc2)cc1 Homo sapiens CHEMBL907246 cell membrane format
CHEMBL366210 OBDepict H 3 C O N H O S O O S H 3 C H 3 C N N Ki = 4.0 nM 525.7 CCCCOC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1ccc(Cn2cnc3ccccc32)cc1 Homo sapiens CHEMBL829700 assay format
CHEMBL39959 OBDepict CH 3 O N H O S O O H 3 C N N N CH 3 H 3 C CH 3 IC50 = 4.2 nM 562.74 CCCCOC(=O)NS(=O)(=O)c1ccc(CCC)cc1-c1ccc(Cn2c(CC)nc3c(C)cc(C)nc32)cc1 Homo sapiens CHEMBL648580 cell membrane format
CHEMBL77029 OBDepict CH 3 N O + N _ O N N N N H Ki = 4.5 nM 438.49 CCCCc1nc2ccccc2[n+]([O-])c1Oc1ccc(-c2ccccc2-c2nn[nH]n2)cc1 Homo sapiens CHEMBL1670671 single protein format
CHEMBL156129 OBDepict CH 3 O O N O HO O IC50 = 4.8 nM 521.61 COc1ccc2c(c1OCCc1ccccc1)CC(C(=O)O)N(C(=O)C(c1ccccc1)c1ccccc1)C2 Homo sapiens CHEMBL643791 cell membrane format
CHEMBL214592 OBDepict CH 3 S HN O O O O CH 3 N N Ki = 5.0 nM 469.61 CCCCOC(=O)NS(=O)(=O)c1ccc(CCCC)cc1-c1ccc(Cn2ccnc2)cc1 Homo sapiens CHEMBL907246 cell membrane format
CHEMBL217249 OBDepict CH 3 S S HN O O O O CH 3 N N Ki = 5.0 nM 475.64 CCCCOC(=O)NS(=O)(=O)c1sc(CCCC)cc1-c1ccc(Cn2ccnc2)cc1 Homo sapiens CHEMBL907246 cell membrane format
CHEMBL348363 OBDepict CH 3 O O N O HO N O IC50 = 5.8 nM 508.57 COc1ccc2c(c1OCc1ccccc1)CC(C(=O)O)N(C(=O)N(c1ccccc1)c1ccccc1)C2 Homo sapiens CHEMBL643791 cell membrane format
CHEMBL2435825 OBDepict CH 3 N N H 3 C NH O O OH IC50 = 6.0 nM 503.6 CCCc1nc2c(C)cc(NC(=O)c3ccccc3)cc2n1Cc1ccc(-c2ccccc2C(=O)O)cc1 Homo sapiens CHEMBL2439560 single protein format
CHEMBL216688 OBDepict H 3 C S S N H O O O O H 3 C N N Ki = 6.0 nM 461.61 CCCCOC(=O)NS(=O)(=O)c1sc(CCC)cc1-c1ccc(Cn2ccnc2)cc1 Homo sapiens CHEMBL907246 cell membrane format
CHEMBL4779819 OBDepict H 3 C O N H O S O O S CH 3 CH 3 O N N H 3 C H 3 C CH 3 Ki = 6.6 nM 559.75 CCCCOC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1cccc(C(=O)Cn2ccnc2C(C)(C)C)c1 Homo sapiens CHEMBL4678991 cell-based format
CHEMBL177435 OBDepict H 3 C N N O N N N N H IC50 = 6.7 nM 448.53 CCCc1nc(-c2ccccc2)c(C=O)n1Cc1ccc(-c2ccccc2-c2nn[nH]n2)cc1 Homo sapiens CHEMBL647512 single protein format
CHEMBL190811 OBDepict H 3 C O N H O S O O S H 3 C H 3 C N N N Ki = 7.1 nM 526.68 CCCCOC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1ccc(Cn2cnc3cccnc32)cc1 Homo sapiens CHEMBL829700 assay format
CHEMBL4779945 OBDepict CH 3 O N H O S O O S CH 3 H 3 C O N N CH 3 CH 3 H 3 C Ki = 7.6 nM 531.7 CCOC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1cccc(C(=O)Cn2ccnc2C(C)(C)C)c1 Homo sapiens CHEMBL4678991 cell-based format
CHEMBL315275 OBDepict H 3 C N H N H O S O O N N S HO H 3 C CH 3 O OH CH 3 IC50 = 8.2 nM 588.75 CCCCc1nc(SC)c(C(C)(O)C(=O)O)n1Cc1ccc(-c2ccccc2S(=O)(=O)NC(=O)NCCC)cc1 Homo sapiens CHEMBL643790 cell membrane format
CHEMBL3394209 OBDepict H 3 C O N H O S O O CH 3 H 3 C N N Ki = 8.2 nM 469.61 CCCCOC(=O)NS(=O)(=O)c1cc(CC(C)C)ccc1-c1cccc(Cn2ccnc2)c1 Homo sapiens CHEMBL3777314 single protein format
CHEMBL4788892 OBDepict CH 3 O N H O S O O S H 3 C CH 3 O N N CH 3 H 3 C CH 3 Ki = 9.3 nM 517.67 COC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1cccc(C(=O)Cn2ccnc2C(C)(C)C)c1 Homo sapiens CHEMBL4678991 cell-based format
CHEMBL155728 OBDepict CH 3 O O N O HO N O H 3 C IC50 = 9.4 nM 446.5 COc1ccc2c(c1OCc1ccccc1)CC(C(=O)O)N(C(=O)N(C)c1ccccc1)C2 Homo sapiens CHEMBL643791 cell membrane format
CHEMBL1668008 OBDepict H 3 C N N Cl O OH N N N H N IC50 = 10.0 nM 474.95 CCCCc1nc(Cl)c2n1C(c1ccc(-c3ccccc3-c3nnn[nH]3)cc1)CC(C(=O)O)=C2 Homo sapiens CHEMBL1670671 single protein format
CHEMBL386269 OBDepict CH 3 O N H O S O O S CH 3 CH 3 N N Ki = 10.0 nM 447.58 CCOC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1ccc(Cn2ccnc2)cc1 Homo sapiens CHEMBL907246 cell membrane format
CHEMBL3394207 OBDepict H 3 C O N H O S O O CH 3 CH 3 N N Ki = 12.3 nM 469.61 CCCCOC(=O)NS(=O)(=O)c1ccc(CC(C)C)cc1-c1cccc(Cn2ccnc2)c1 Homo sapiens CHEMBL3768051 single protein format
CHEMBL216361 OBDepict H 3 C N H N H O S O O S H 3 C H 3 C N N Ki = 13.0 nM 474.65 CCCCNC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1ccc(Cn2ccnc2)cc1 Homo sapiens CHEMBL907246 cell membrane format
CHEMBL216515 OBDepict CH 3 O N H O S O O O H 3 C CH 3 N N Ki = 15.0 nM 471.58 CCCCOC(=O)NS(=O)(=O)c1ccc(OC(C)C)cc1-c1ccc(Cn2ccnc2)cc1 Homo sapiens CHEMBL907246 cell membrane format
CHEMBL376286 OBDepict H 3 C CH 3 H HN H O OH O N N Ki = 16.6 nM 315.37 CC[C@@H](C)[C@H](NC(=O)c1cccc(Cn2ccnc2)c1)C(=O)O Homo sapiens CHEMBL915840 cell membrane format
CHEMBL4759641 OBDepict H 3 C O N H O S O O S CH 3 CH 3 O N N CH 3 H 3 C Ki = 17.0 nM 545.73 CCCCOC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1cccc(C(=O)Cn2ccnc2C(C)C)c1 Homo sapiens CHEMBL4678991 cell-based format
CHEMBL2086892 OBDepict H 3 C O N H O S O O S CH 3 CH 3 N N Ki = 17.8 nM 475.64 CCCCOC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1cccc(Cn2ccnc2)c1 Homo sapiens CHEMBL3385518 single protein format
CHEMBL288705 OBDepict CH 3 N N HO N O HO IC50 = 20.0 nM 401.47 CCCCc1nc2ccnc(O)c2n1Cc1ccc(-c2ccccc2C(=O)O)cc1 Homo sapiens CHEMBL650859 tissue-based format
CHEMBL40381 OBDepict H 3 C N N N CH 3 O O OH Cl IC50 = 22.0 nM 449.94 CCCc1nc2c(C)ccnc2n1Cc1ccc(OC(C(=O)O)c2ccccc2Cl)cc1 Homo sapiens CHEMBL647845 tissue-based format
CHEMBL4751226 OBDepict H 3 C O N H O S O O S CH 3 CH 3 O N N H 3 C Ki = 26.0 nM 545.73 CCCCOC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1cccc(C(=O)Cn2ccnc2CCC)c1 Homo sapiens CHEMBL4678991 cell-based format
CHEMBL290286 OBDepict O N H O HO IC50 = 30.0 nM 447.53 O=C(O)[C@@H]1Cc2cc(-c3ccccc3)ccc2CN1C(=O)C(c1ccccc1)c1ccccc1 Homo sapiens CHEMBL647513 single protein format
CHEMBL386172 OBDepict H 3 C O O N H O S O O S H 3 C H 3 C N N Ki = 31.0 nM 477.61 COCCOC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1ccc(Cn2ccnc2)cc1 Homo sapiens CHEMBL907246 cell membrane format
CHEMBL217208 OBDepict H 3 C N H O S O O S CH 3 CH 3 N N Ki = 34.0 nM 459.64 CCCCC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1ccc(Cn2ccnc2)cc1 Homo sapiens CHEMBL907246 cell membrane format
CHEMBL156165 OBDepict CH 3 O O N O HO O Cl Cl IC50 = 35.0 nM 576.48 COc1ccc2c(c1OCc1ccccc1)CC(C(=O)O)N(C(=O)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1)C2 Homo sapiens CHEMBL643791 cell membrane format
CHEMBL384577 OBDepict H 3 C H 3 C S S N H O O O O H 3 C CH 3 N N Ki = 37.0 nM 475.64 CC(C)COC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1ccc(Cn2ccnc2)cc1 Homo sapiens CHEMBL907246 cell membrane format
CHEMBL219840 OBDepict HO O N H H O N N Ki = 37.5 nM 349.39 O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cccc(Cn2ccnc2)c1 Homo sapiens CHEMBL915840 cell membrane format
CHEMBL4784233 OBDepict H 3 C O N H O S O O S CH 3 CH 3 O N N CH 3 Ki = 39.0 nM 559.75 CCCCOC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1cccc(C(=O)Cn2ccnc2CCCC)c1 Homo sapiens CHEMBL4678991 cell-based format
CHEMBL34124 OBDepict H 3 C O O N H O OH O Ki = 39.5 nM 507.59 COc1ccc2c(c1OCc1ccccc1)C[C@@H](C(=O)O)N(C(=O)C(c1ccccc1)c1ccccc1)C2 Homo sapiens CHEMBL3768051 single protein format
CHEMBL156587 OBDepict CH 3 O O N O HO O NH 2 IC50 = 40.0 nM 508.57 COc1ccc2c(c1Oc1ccc(N)cc1)CC(C(=O)O)N(C(=O)C(c1ccccc1)c1ccccc1)C2 Homo sapiens CHEMBL643791 cell membrane format
CHEMBL219839 OBDepict HO O N H H O N N H Ki = 40.6 nM 349.39 O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cccc(Cc2cnc[nH]2)c1 Homo sapiens CHEMBL915840 cell membrane format
CHEMBL2435833 OBDepict H 3 C N N CH 3 N O O HO IC50 = 42.0 nM 495.62 CCCc1nc2c(C)cc(C(=O)N3CCCCC3)cc2n1Cc1ccc(-c2ccccc2C(=O)O)cc1 Homo sapiens CHEMBL2439560 single protein format
CHEMBL2086911 OBDepict H 3 C O N H O S O O S CH 3 CH 3 O N N CH 3 Ki = 48.0 nM 531.7 CCCCOC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1cccc(C(=O)Cn2ccnc2CC)c1 Homo sapiens CHEMBL4678991 cell-based format
CHEMBL1668009 OBDepict H 3 C N N Cl O OH N N N H N IC50 = 50.0 nM 474.95 CCCCc1nc(Cl)c2n1C(c1ccc(-c3ccccc3-c3nnn[nH]3)cc1)CC=C2C(=O)O Homo sapiens CHEMBL1670671 single protein format
CHEMBL307756 OBDepict H 3 C N N N O OH N N N N N H IC50 = 50.0 nM 562.68 CCCc1nc(CN2CCN(c3ccccc3)CC2)c(C(=O)O)n1Cc1ccc(-c2ccccc2-c2nn[nH]n2)cc1 Homo sapiens CHEMBL647511 single protein format
CHEMBL2435824 OBDepict CH 3 N N CH 3 HN O H 3 C O HO IC50 = 53.0 nM 469.59 CCCC(=O)Nc1cc(C)c2nc(CCC)n(Cc3ccc(-c4ccccc4C(=O)O)cc3)c2c1 Homo sapiens CHEMBL2439560 single protein format
CHEMBL4747530 OBDepict CH 3 O HN O S O O S H 3 C CH 3 O N N Ki = 53.0 nM 515.66 CCOC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1cccc(C(=O)Cn2ccnc2C2CC2)c1 Homo sapiens CHEMBL4678991 cell-based format
CHEMBL155987 OBDepict H 3 C O O N O O HO IC50 = 59.0 nM 507.59 COc1cc2c(cc1OCc1ccccc1)CC(C(=O)O)N(C(=O)C(c1ccccc1)c1ccccc1)C2 Homo sapiens CHEMBL643791 cell membrane format
CHEMBL308703 OBDepict CH 3 N N N O HO N N N N N N H IC50 = 60.0 nM 563.67 CCCc1nc(CN2CCN(c3ccccn3)CC2)c(C(=O)O)n1Cc1ccc(-c2ccccc2-c2nn[nH]n2)cc1 Homo sapiens CHEMBL647511 single protein format
CHEMBL2435834 OBDepict H 3 C N N CH 3 N H O O HO H 3 C IC50 = 61.0 nM 517.63 CCCc1nc2c(C)cc(C(=O)Nc3ccc(C)cc3)cc2n1Cc1ccc(-c2ccccc2C(=O)O)cc1 Homo sapiens CHEMBL2439560 single protein format
CHEMBL386671 OBDepict H 3 C CH 3 S S N H O O O O CH 3 CH 3 H 3 C N N Ki = 63.0 nM 475.64 CC(C)Cc1cc(-c2ccc(Cn3ccnc3)cc2)c(S(=O)(=O)NC(=O)OC(C)(C)C)s1 Homo sapiens CHEMBL907246 cell membrane format
CHEMBL535139 OBDepict OH O N N O N CH 3 NH 2 ClH IC50 = 66.0 nM 517.03 Cc1cc(Cn2cnc3c2CC(C(=O)O)N(C(=O)C(c2ccccc2)c2ccccc2)C3)ccc1N.Cl Homo sapiens CHEMBL647512 single protein format
CHEMBL292277 OBDepict HO O H N N O N H 3 C H 2 N IC50 = 66.0 nM 480.57 Cc1cc(Cn2cnc3c2C[C@@H](C(=O)O)N(C(=O)C(c2ccccc2)c2ccccc2)C3)ccc1N Homo sapiens CHEMBL643595 single protein format
CHEMBL309367 OBDepict CH 3 N N N O HO H CH 3 N N N N N H IC50 = 70.0 nM 576.71 CCCc1nc(CN2CCN(c3ccccc3)C[C@H]2C)c(C(=O)O)n1Cc1ccc(-c2ccccc2-c2nn[nH]n2)cc1 Homo sapiens CHEMBL647511 single protein format
CHEMBL155938 OBDepict CH 3 O O N O OH O Cl Cl IC50 = 70.0 nM 500.38 COc1ccc2c(c1OCc1ccccc1)CC(C(=O)O)N(C(=O)Cc1c(Cl)cccc1Cl)C2 Homo sapiens CHEMBL643791 cell membrane format
CHEMBL191468 OBDepict H 3 C O N H O S O O S H 3 C H 3 C N Ki = 70.0 nM 434.58 CCCCOC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1ccc(CC#N)cc1 Homo sapiens CHEMBL829700 assay format
CHEMBL215159 OBDepict H 3 C CH 3 S S N H O O O O H 3 C CH 3 N N Ki = 75.0 nM 461.61 CC(C)Cc1cc(-c2ccc(Cn3ccnc3)cc2)c(S(=O)(=O)NC(=O)OC(C)C)s1 Homo sapiens CHEMBL907246 cell membrane format
CHEMBL385714 OBDepict H 3 C S NH O O S O O S H 3 C CH 3 N N Ki = 76.0 nM 495.69 CCCCS(=O)(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1ccc(Cn2ccnc2)cc1 Homo sapiens CHEMBL907246 cell membrane format
CHEMBL2435827 OBDepict CH 3 N N CH 3 HN O O HO IC50 = 77.0 nM 517.63 CCCc1nc2c(C)cc(NC(=O)Cc3ccccc3)cc2n1Cc1ccc(-c2ccccc2C(=O)O)cc1 Homo sapiens CHEMBL2439560 single protein format
CHEMBL2435823 OBDepict CH 3 N N CH 3 N H O H 3 C O HO IC50 = 78.0 nM 455.56 CCCc1nc2c(C)cc(NC(=O)CC)cc2n1Cc1ccc(-c2ccccc2C(=O)O)cc1 Homo sapiens CHEMBL2439560 single protein format
CHEMBL386718 OBDepict CH 3 S NH O O O S CH 3 H 3 C N N Ki = 79.0 nM 459.64 CCCCS(=O)(=O)NC(=O)c1sc(CC(C)C)cc1-c1ccc(Cn2ccnc2)cc1 Homo sapiens CHEMBL907246 cell membrane format
CHEMBL306216 OBDepict CH 3 N N N O HO N N N N N F H IC50 = 80.0 nM 580.67 CCCc1nc(CN2CCN(c3ccc(F)cc3)CC2)c(C(=O)O)n1Cc1ccc(-c2ccccc2-c2nn[nH]n2)cc1 Homo sapiens CHEMBL647511 single protein format
CHEMBL309165 OBDepict H 3 C N N N O OH N N N N N N N H IC50 = 80.0 nM 564.65 CCCc1nc(CN2CCN(c3ncccn3)CC2)c(C(=O)O)n1Cc1ccc(-c2ccccc2-c2nn[nH]n2)cc1 Homo sapiens CHEMBL647511 single protein format
CHEMBL217752 OBDepict CH 3 O S S HN O O O O CH 3 N N Ki = 86.0 nM 477.61 CCCCOC(=O)NS(=O)(=O)c1sc(CCOC)cc1-c1ccc(Cn2ccnc2)cc1 Homo sapiens CHEMBL907246 cell membrane format
CHEMBL304137 OBDepict H 3 C N N N O HO H 3 C N N N N H IC50 = 90.0 nM 563.71 CCCCN(Cc1ccccc1)Cc1nc(CCC)n(Cc2ccc(-c3ccccc3-c3nn[nH]n3)cc2)c1C(=O)O Homo sapiens CHEMBL647511 single protein format
CHEMBL286134 OBDepict CH 3 N N O S N H O O O IC50 = 100.0 nM 543.69 CCCCC1=NC2(CCCC2)C(=O)N1Cc1ccc(-c2ccccc2S(=O)(=O)NC(=O)c2ccccc2)cc1 Homo sapiens CHEMBL643597 single protein format
CHEMBL4762752 OBDepict CH 3 O HN O S O O S H 3 C CH 3 O N N Ki = 110.0 nM 501.63 COC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1cccc(C(=O)Cn2ccnc2C2CC2)c1 Homo sapiens CHEMBL4678991 cell-based format
CHEMBL4209214 OBDepict H 3 C H 3 C S S N H O O O O H 3 C CH 3 N N Ki = 130.0 nM 475.64 CC(C)COC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1cccc(Cn2ccnc2)c1 Homo sapiens CHEMBL4184608 cell-based format
CHEMBL4207027 OBDepict H 3 C H 3 C S S N H O O O O N N Ki = 140.0 nM 473.62 CC(C)Cc1cc(-c2cccc(Cn3ccnc3)c2)c(S(=O)(=O)NC(=O)OCC2CC2)s1 Homo sapiens CHEMBL4184608 cell-based format
CHEMBL2435828 OBDepict CH 3 N N H 3 C NH O O OH IC50 = 149.0 nM 531.66 CCCc1nc2c(C)cc(NC(=O)CCc3ccccc3)cc2n1Cc1ccc(-c2ccccc2C(=O)O)cc1 Homo sapiens CHEMBL2439560 single protein format
CHEMBL423236 OBDepict CH 3 O O N O O O CH 3 IC50 = 150.0 nM 535.64 CCOC(=O)C1Cc2c(ccc(OC)c2OCc2ccccc2)CN1C(=O)C(c1ccccc1)c1ccccc1 Homo sapiens CHEMBL643791 cell membrane format
CHEMBL4213607 OBDepict CH 3 CH 3 S S NH O O O O CH 3 H 3 C N N Ki = 160.0 nM 461.61 CC(C)Cc1cc(-c2cccc(Cn3ccnc3)c2)c(S(=O)(=O)NC(=O)OC(C)C)s1 Homo sapiens CHEMBL4184608 cell-based format
CHEMBL2435831 OBDepict CH 3 N N CH 3 N H O O HO CH 3 IC50 = 164.0 nM 483.61 CCCCNC(=O)c1cc(C)c2nc(CCC)n(Cc3ccc(-c4ccccc4C(=O)O)cc3)c2c1 Homo sapiens CHEMBL2439560 single protein format
CHEMBL155847 OBDepict CH 3 O O N O HO NH O F IC50 = 170.0 nM 450.47 COc1ccc2c(c1OCc1ccccc1)CC(C(=O)O)N(C(=O)Nc1ccc(F)cc1)C2 Homo sapiens CHEMBL643791 cell membrane format
CHEMBL4797684 OBDepict CH 3 CH 3 S S N H O O O CH 3 O N N CH 3 H 3 C CH 3 Ki = 170.0 nM 501.67 CC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1cccc(C(=O)Cn2ccnc2C(C)(C)C)c1 Homo sapiens CHEMBL4678991 cell-based format
CHEMBL4206507 OBDepict CH 3 CH 3 S S NH O O O O N N Ki = 180.0 nM 487.65 CC(C)Cc1cc(-c2cccc(Cn3ccnc3)c2)c(S(=O)(=O)NC(=O)OC2CCCC2)s1 Homo sapiens CHEMBL4184608 cell-based format
CHEMBL216746 OBDepict CH 3 H 3 C S N N N N H N N Ki = 189.0 nM 364.48 CC(C)Cc1cc(-c2ccc(Cn3ccnc3)cc2)c(-c2nn[nH]n2)s1 Homo sapiens CHEMBL907246 cell membrane format
CHEMBL71953 OBDepict H 3 C N N N O OH H 3 C CH 3 N N N N H IC50 = 200.0 nM 557.74 CCCCCN(CCCCC)Cc1nc(CCC)n(Cc2ccc(-c3ccccc3-c3nn[nH]n3)cc2)c1C(=O)O Homo sapiens CHEMBL647511 single protein format