HOME LIGAND hPROTEOME OTHERS DOCUMENT

P32745 | SSR3_HUMAN | Somatostatin receptor type 3 (SSTR3)

3D structures mapped by conservation among orthologs



[ 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
CHEMBL3323074 OBDepict CH 3 O O N NH N H N N H N N CH 3 H F IC50 = 0.64 nM 561.62 CCOC(=O)c1ccnc([C@]2(c3cnn(C)c3)N[C@@H](c3nc(-c4ccc(F)cc4)c[nH]3)Cc3c2[nH]c2ccccc32)c1 Homo sapiens CHEMBL3378639 cell-based format
CHEMBL2069499 OBDepict H 3 C N H N H H CH 3 N N H Ki = 0.64 nM 426.61 CCCCC1(CCCC)N[C@@H](c2nc(-c3ccccc3)c[nH]2)Cc2c1[nH]c1ccccc21 Homo sapiens CHEMBL807040 cell-based format
CHEMBL2204935 OBDepict F N N H H N H N N N H O N N CH 3 H 3 C IC50 = 0.66 nM 494.53 Cc1nc([C@]2(c3cnn(C)c3)N[C@@H](c3nc(-c4ccc(F)cc4)c[nH]3)Cc3c2[nH]c2ccccc32)no1 Homo sapiens CHEMBL2210526 cell-based format
CHEMBL2204939 OBDepict F N N H H N H N H N N N N CH 3 H 3 C IC50 = 0.74 nM 492.56 Cn1cc(C2(c3cnn(C)c3)N[C@@H](c3nc(-c4ccc(F)cc4)c[nH]3)Cc3c2[nH]c2ccccc32)cn1 Homo sapiens CHEMBL2210526 cell-based format
CHEMBL2204934 OBDepict F N N H H NH N H IC50 = 0.76 nM 484.58 Fc1ccc(-c2c[nH]c([C@H]3Cc4c([nH]c5ccccc45)C(c4ccccc4)(c4ccccc4)N3)n2)cc1 Homo sapiens CHEMBL2210526 cell-based format
CHEMBL3323076 OBDepict CH 3 O O N NH N H N N H N N CH 3 H F IC50 = 0.78 nM 561.62 CCOC(=O)c1cncc([C@]2(c3cnn(C)c3)N[C@@H](c3nc(-c4ccc(F)cc4)c[nH]3)Cc3c2[nH]c2ccccc32)c1 Homo sapiens CHEMBL3378639 cell-based format
CHEMBL1788167 OBDepict OH O O OH H 3 C N H N H H CH 3 N N H Ki = 0.79 nM 516.64 CCCCC1(CCCC)N[C@H](c2nc(-c3ccccc3)c[nH]2)Cc2c1[nH]c1ccccc21.O=C(O)C(=O)O Homo sapiens CHEMBL807040 cell-based format
CHEMBL2069500 OBDepict H N N H HN N H IC50 = 0.8 nM 396.54 c1ccc(-c2c[nH]c([C@H]3Cc4c([nH]c5ccccc45)C(C4CCCCC4)N3)n2)cc1 Homo sapiens CHEMBL2072489 cell-based format
CHEMBL3287628 OBDepict O N H H H HN Cl Cl Ki = 0.815 nM 427.38 O=C(N[C@@H]1CCCC[C@@H]1NCc1ccc(Cl)c(Cl)c1)c1ccc2ccccc2c1 Homo sapiens CHEMBL3296531 cell membrane format
CHEMBL3323072 OBDepict CH 3 O O N NH N H N N H N N CH 3 H F IC50 = 0.83 nM 561.62 CCOC(=O)c1cccc([C@]2(c3cnn(C)c3)N[C@@H](c3nc(-c4ccc(F)cc4)c[nH]3)Cc3c2[nH]c2ccccc32)n1 Homo sapiens CHEMBL3378639 cell-based format
CHEMBL2367844 OBDepict H N N H HN H 3 C N H Ki = 0.9 nM 410.57 CC1(C2CCCCC2)N[C@H](c2nc(-c3ccccc3)c[nH]2)Cc2c1[nH]c1ccccc21 Homo sapiens CHEMBL807040 cell-based format
CHEMBL2367837 OBDepict H 3 C N H N H H N N H 3 C H Ki = 0.92 nM 454.66 CCCCCC1(CCCCC)N[C@H](c2nc(-c3ccccc3)c[nH]2)Cc2c1[nH]c1ccccc21 Homo sapiens CHEMBL807040 cell-based format
CHEMBL2204938 OBDepict F N N H H N H N N N H O N N CH 3 H 3 C IC50 = 0.94 nM 494.53 Cc1nc([C@]2(c3cnn(C)c3)N[C@H](c3nc(-c4ccc(F)cc4)c[nH]3)Cc3c2[nH]c2ccccc32)no1 Homo sapiens CHEMBL2210526 cell-based format
CHEMBL2204940 OBDepict F N N H H N H N N N N N H O O CH 3 H 3 C IC50 = 0.97 nM 496.51 Cc1nc(C2(c3noc(C)n3)N[C@@H](c3nc(-c4ccc(F)cc4)c[nH]3)Cc3c2[nH]c2ccccc32)no1 Homo sapiens CHEMBL2210526 cell-based format
CHEMBL2204936 OBDepict F N N H H N H N N N H O N N CH 3 H 3 C IC50 = 1.1 nM 494.53 Cc1nc([C@@]2(c3cnn(C)c3)N[C@@H](c3nc(-c4ccc(F)cc4)c[nH]3)Cc3c2[nH]c2ccccc32)no1 Homo sapiens CHEMBL2210526 cell-based format
CHEMBL3582321 OBDepict F N N N H H N H N N N H O N N CH 3 IC50 = 1.1 nM 535.59 Cc1nc([C@]2(c3cnn(CC4CC4)c3)N[C@@H](c3nc(-c4ccc(F)cn4)c[nH]3)Cc3c2[nH]c2ccccc32)no1 Homo sapiens CHEMBL3583381 cell-based format
CHEMBL3680938 OBDepict H 3 C O N H N O N H N H N N CH 3 H N CH 3 F IC50 = 1.2 nM 539.62 COC1CC2C(C1)C2C1(c2nnc(C)o2)N[C@@H](c2nc(-c3ccc(F)c(C)n3)c[nH]2)Cc2c1[nH]c1ccccc21 Homo sapiens CHEMBL3705198 cell-based format
CHEMBL3323084 OBDepict F N N H H N H N H N N N CH 3 O HO IC50 = 1.22 nM 533.57 Cn1cc([C@@]2(c3cncc(C(=O)O)c3)N[C@@H](c3nc(-c4ccc(F)cc4)c[nH]3)Cc3c2[nH]c2ccccc32)cn1 Homo sapiens CHEMBL3378639 cell-based format
CHEMBL3605798 OBDepict CH 3 N N H N H Ki = 1.3 nM 359.52 Cc1ccc(-c2c[nH]c(C3(NCCCc4ccccc4)CCCC3)n2)cc1 Homo sapiens CHEMBL3606126 cell-based format
CHEMBL3775042 OBDepict CH 3 O N N NH N H N N H N N CH 3 H IC50 = 1.4 nM 476.54 Cc1nc([C@]2(c3cnn(C)c3)N[C@@H](c3nc(-c4ccccc4)c[nH]3)Cc3c2[nH]c2ccccc32)no1 Homo sapiens CHEMBL3779603 single protein format
CHEMBL3582341 OBDepict H 3 C N N NH N O N H N H N N O H N F IC50 = 1.4 nM 565.61 CCn1cc([C@@]2(c3nn(CC4CC4)c(=O)o3)N[C@@H](c3nc(-c4ccc(F)cn4)c[nH]3)Cc3c2[nH]c2ccccc32)cn1 Homo sapiens CHEMBL3583381 cell-based format
CHEMBL3323073 OBDepict CH 3 O O N NH N H N N H N N CH 3 H F IC50 = 1.52 nM 561.62 CCOC(=O)c1cccc([C@@]2(c3cnn(C)c3)N[C@@H](c3nc(-c4ccc(F)cc4)c[nH]3)Cc3c2[nH]c2ccccc32)n1 Homo sapiens CHEMBL3378639 cell-based format
CHEMBL3680937 OBDepict H 3 C N O N NH O N H H N N H N CH 3 F IC50 = 1.7 nM 513.58 Cc1nnc(C2(C3CCCCO3)N[C@@H](c3nc(-c4ccc(F)c(C)n4)c[nH]3)Cc3c2[nH]c2ccccc32)o1 Homo sapiens CHEMBL3705198 cell-based format
CHEMBL2069505 OBDepict H N N H HN N H S IC50 = 1.7 nM 414.58 c1ccc(-c2c[nH]c([C@H]3Cc4c([nH]c5ccccc45)C(C4CCSCC4)N3)n2)cc1 Homo sapiens CHEMBL2072489 cell-based format
CHEMBL2069500 OBDepict H N N H HN N H Ki = 1.7 nM 396.54 c1ccc(-c2c[nH]c([C@H]3Cc4c([nH]c5ccccc45)C(C4CCCCC4)N3)n2)cc1 Homo sapiens CHEMBL2072626 single protein format
CHEMBL1201959 OBDepict OH O O OH H N N NH N H Ki = 1.7 nM 486.57 O=C(O)C(=O)O.c1ccc(-c2c[nH]c(C3Cc4c([nH]c5ccccc45)C(C4CCCCC4)N3)n2)cc1 Homo sapiens CHEMBL807040 cell-based format
CHEMBL3323078 OBDepict H 3 C O O N NH N H N N H N N CH 3 H F IC50 = 1.72 nM 561.62 CCOC(=O)c1ccc([C@]2(c3cnn(C)c3)N[C@@H](c3nc(-c4ccc(F)cc4)c[nH]3)Cc3c2[nH]c2ccccc32)nc1 Homo sapiens CHEMBL3378639 cell-based format
CHEMBL3775532 OBDepict H N N H HN H F N F H O IC50 = 1.8 nM 434.49 Fc1ccc(-c2c[nH]c([C@H]3Cc4c([nH]c5ccccc45)[C@@H](C4CCOCC4)N3)n2)cc1F Homo sapiens CHEMBL3779603 single protein format
CHEMBL3582329 OBDepict CH 3 S N O N NH N H N N H N N H CH 3 N F IC50 = 1.9 nM 541.62 CCn1cc([C@@]2(c3nnc(SC)o3)N[C@@H](c3nc(-c4ccc(F)cn4)c[nH]3)Cc3c2[nH]c2ccccc32)cn1 Homo sapiens CHEMBL3583381 cell-based format
CHEMBL3582335 OBDepict F N N N H H N H N N O H N N N H 3 C O CH 3 H 3 C IC50 = 2.0 nM 539.58 CC(C)n1nc([C@]2(c3cnn(C)c3)N[C@@H](c3nc(-c4ccc(F)cn4)c[nH]3)Cc3c2[nH]c2ccccc32)oc1=O Homo sapiens CHEMBL3583381 cell-based format
CHEMBL3605789 OBDepict F N N H N H N H Ki = 2.0 nM 374.46 Fc1ccc(-c2c[nH]c(C3(NCc4c[nH]c5ccccc45)CCCC3)n2)cc1 Homo sapiens CHEMBL3606126 cell-based format
CHEMBL3582342 OBDepict CH 3 N N NH N O N H N H N N O H N N H 3 C CH 3 F IC50 = 2.1 nM 582.64 CCn1cc([C@@]2(c3nn(CCN(C)C)c(=O)o3)N[C@@H](c3nc(-c4ccc(F)cn4)c[nH]3)Cc3c2[nH]c2ccccc32)cn1 Homo sapiens CHEMBL3583381 cell-based format
CHEMBL3582311 OBDepict F N N H H NH N F F F H IC50 = 2.1 nM 476.48 Fc1ccc(-c2c[nH]c([C@H]3Cc4c([nH]c5ccccc45)C(c4ccccc4)(C(F)(F)F)N3)n2)cc1 Homo sapiens CHEMBL3583381 cell-based format
CHEMBL3582340 OBDepict CH 3 N N NH N O N H N H N N O H CH 3 CH 3 N F IC50 = 2.1 nM 553.6 CCn1cc([C@@]2(c3nn(C(C)C)c(=O)o3)N[C@@H](c3nc(-c4ccc(F)cn4)c[nH]3)Cc3c2[nH]c2ccccc32)cn1 Homo sapiens CHEMBL3583381 cell-based format
CHEMBL3774684 OBDepict H 3 C O N N N H H N H N N N H O N N H 3 C CH 3 IC50 = 2.1 nM 507.56 COc1cccc(-c2c[nH]c([C@H]3Cc4c([nH]c5ccccc45)[C@](c4cnn(C)c4)(c4noc(C)n4)N3)n2)n1 Homo sapiens CHEMBL3779603 single protein format
CHEMBL3323082 OBDepict F N N H H N H N N H N N CH 3 O OH IC50 = 2.13 nM 533.57 Cn1cc([C@@]2(c3cc(C(=O)O)ccn3)N[C@@H](c3nc(-c4ccc(F)cc4)c[nH]3)Cc3c2[nH]c2ccccc32)cn1 Homo sapiens CHEMBL3378639 cell-based format
CHEMBL3582326 OBDepict CH 3 N N NH N O N H N H N N CH 3 H N F IC50 = 2.2 nM 509.55 CCn1cc([C@@]2(c3nnc(C)o3)N[C@@H](c3nc(-c4ccc(F)cn4)c[nH]3)Cc3c2[nH]c2ccccc32)cn1 Homo sapiens CHEMBL3583381 cell-based format
CHEMBL3582319 OBDepict CH 3 N N NH N N N H O H N N CH 3 H N F IC50 = 2.2 nM 509.55 CCn1cc([C@@]2(c3noc(C)n3)N[C@@H](c3nc(-c4ccc(F)cn4)c[nH]3)Cc3c2[nH]c2ccccc32)cn1 Homo sapiens CHEMBL3583381 cell-based format
CHEMBL2204937 OBDepict F N N H H N H N N N H O N N CH 3 H 3 C IC50 = 2.3 nM 494.53 Cc1nc([C@@]2(c3cnn(C)c3)N[C@H](c3nc(-c4ccc(F)cc4)c[nH]3)Cc3c2[nH]c2ccccc32)no1 Homo sapiens CHEMBL2210526 cell-based format
CHEMBL3582336 OBDepict CH 3 N N NH N O N H N H N N CH 3 O H N F IC50 = 2.3 nM 525.55 CCn1cc([C@@]2(c3nn(C)c(=O)o3)N[C@@H](c3nc(-c4ccc(F)cn4)c[nH]3)Cc3c2[nH]c2ccccc32)cn1 Homo sapiens CHEMBL3583381 cell-based format
CHEMBL3582344 OBDepict CH 3 N N NH N O N H N H N N O H O NH 2 N F IC50 = 2.4 nM 568.57 CCn1cc([C@@]2(c3nn(CC(N)=O)c(=O)o3)N[C@@H](c3nc(-c4ccc(F)cn4)c[nH]3)Cc3c2[nH]c2ccccc32)cn1 Homo sapiens CHEMBL3583381 cell-based format
CHEMBL3680935 OBDepict CH 3 O NH N O N H N H N N CH 3 H N F IC50 = 2.6 nM 473.51 CCOC[C@@]1(c2nnc(C)o2)N[C@@H](c2nc(-c3ccc(F)cn3)c[nH]2)Cc2c1[nH]c1ccccc21 Homo sapiens CHEMBL3705198 cell-based format
CHEMBL3582316 OBDepict F N N N H H N H N H IC50 = 2.6 nM 415.52 Fc1ccc(-c2c[nH]c([C@H]3Cc4c([nH]c5ccccc45)C(C4CCCCC4)N3)n2)nc1 Homo sapiens CHEMBL3583381 cell-based format
CHEMBL3775630 OBDepict CH 3 O N N NH N H N N H N N CH 3 H IC50 = 2.6 nM 476.54 Cc1nc([C@@]2(c3cnn(C)c3)N[C@@H](c3nc(-c4ccccc4)c[nH]3)Cc3c2[nH]c2ccccc32)no1 Homo sapiens CHEMBL3779603 single protein format
CHEMBL2204941 OBDepict F N N H H NH H N H O IC50 = 2.8 nM 416.5 Fc1ccc(-c2c[nH]c([C@H]3Cc4c([nH]c5ccccc45)[C@@H](C4CCOCC4)N3)n2)cc1 Homo sapiens CHEMBL2210526 cell-based format
CHEMBL3775160 OBDepict H 3 C O N N N H H N H N N N H O N N H 3 C CH 3 IC50 = 2.9 nM 507.56 COc1cccc(-c2c[nH]c([C@H]3Cc4c([nH]c5ccccc45)[C@@](c4cnn(C)c4)(c4noc(C)n4)N3)n2)n1 Homo sapiens CHEMBL3779603 single protein format
CHEMBL3582320 OBDepict CH 3 O N N NH N H N N H N N CH 3 H N F IC50 = 2.9 nM 509.55 CCc1nc([C@]2(c3cnn(C)c3)N[C@@H](c3nc(-c4ccc(F)cn4)c[nH]3)Cc3c2[nH]c2ccccc32)no1 Homo sapiens CHEMBL3583381 cell-based format
CHEMBL3580681 OBDepict H 3 C N N O O HN N H N N H N N H 3 C H N F IC50 = 2.9 nM 525.55 CCn1nc([C@]2(c3cnn(C)c3)N[C@@H](c3nc(-c4ccc(F)cn4)c[nH]3)Cc3c2[nH]c2ccccc32)oc1=O Homo sapiens CHEMBL3583381 cell-based format
CHEMBL3323079 OBDepict H 3 C O O N NH N H N N H N N CH 3 H F IC50 = 2.91 nM 561.62 CCOC(=O)c1ccc([C@@]2(c3cnn(C)c3)N[C@@H](c3nc(-c4ccc(F)cc4)c[nH]3)Cc3c2[nH]c2ccccc32)nc1 Homo sapiens CHEMBL3378639 cell-based format
CHEMBL3582317 OBDepict F N N N H H N H N N N H O N N CH 3 H 3 C IC50 = 3.0 nM 495.52 Cc1nc([C@]2(c3cnn(C)c3)N[C@@H](c3nc(-c4ccc(F)cn4)c[nH]3)Cc3c2[nH]c2ccccc32)no1 Homo sapiens CHEMBL3583381 cell-based format
CHEMBL3582339 OBDepict H 3 C N N HN N O N H N H N N O H H 3 C N F IC50 = 3.0 nM 539.58 CCn1cc([C@@]2(c3nn(CC)c(=O)o3)N[C@@H](c3nc(-c4ccc(F)cn4)c[nH]3)Cc3c2[nH]c2ccccc32)cn1 Homo sapiens CHEMBL3583381 cell-based format
CHEMBL3287629 OBDepict F N H O H H HN Cl Cl Ki = 3.0 nM 445.37 O=C(N[C@@H]1CCCC[C@@H]1NCc1ccc(Cl)c(Cl)c1)c1ccc2cc(F)ccc2c1 Homo sapiens CHEMBL3296531 cell membrane format
CHEMBL3323077 OBDepict CH 3 O O N NH N H N N H N N CH 3 H F IC50 = 3.36 nM 561.62 CCOC(=O)c1cncc([C@@]2(c3cnn(C)c3)N[C@@H](c3nc(-c4ccc(F)cc4)c[nH]3)Cc3c2[nH]c2ccccc32)c1 Homo sapiens CHEMBL3378639 cell-based format
CHEMBL3605785 OBDepict CH 3 N N H N H N H Ki = 3.4 nM 370.5 Cc1ccc(-c2c[nH]c(C3(NCc4c[nH]c5ccccc45)CCCC3)n2)cc1 Homo sapiens CHEMBL3606126 cell-based format
CHEMBL1237140 OBDepict H 3 C N H N H H CH 3 N N H Ki = 3.4 nM 426.61 CCCCC1(CCCC)N[C@H](c2nc(-c3ccccc3)c[nH]2)Cc2c1[nH]c1ccccc21 Homo sapiens CHEMBL807040 cell-based format
CHEMBL321282 OBDepict H 3 C NH N H CH 3 N N H Cl Ki = 3.4 nM 461.05 CCCCC1(CCCC)NC(c2nc(-c3ccccc3)c[nH]2)Cc2c1[nH]c1ccc(Cl)cc21 Homo sapiens CHEMBL807040 cell-based format
CHEMBL3582331 OBDepict CH 3 N H N O N NH N H N N H N N H CH 3 N F IC50 = 3.5 nM 524.56 CCn1cc([C@@]2(c3nnc(NC)o3)N[C@@H](c3nc(-c4ccc(F)cn4)c[nH]3)Cc3c2[nH]c2ccccc32)cn1 Homo sapiens CHEMBL3583381 cell-based format
CHEMBL3287632 OBDepict F N H O H H NH N H Ki = 3.7 nM 365.45 O=C(N[C@@H]1CCCC[C@H]1NCc1c[nH]c2ccccc12)c1ccc(F)cc1 Homo sapiens CHEMBL3296531 cell membrane format
CHEMBL3287613 OBDepict F N H O H H NH N H Ki = 3.78 nM 365.45 O=C(N[C@@H]1CCCC[C@@H]1NCc1c[nH]c2ccccc12)c1ccc(F)cc1 Homo sapiens CHEMBL3296531 cell membrane format
CHEMBL2069512 OBDepict CH 3 O N O N H N H H N N H IC50 = 4.0 nM 455.56 COC(=O)N1CCC(C2N[C@@H](c3nc(-c4ccccc4)c[nH]3)Cc3c2[nH]c2ccccc32)CC1 Homo sapiens CHEMBL2072489 cell-based format
CHEMBL3287633 OBDepict F NH O H H N H N H Ki = 4.15 nM 351.43 O=C(N[C@@H]1CCC[C@@H]1NCc1c[nH]c2ccccc12)c1ccc(F)cc1 Homo sapiens CHEMBL3296531 cell membrane format
CHEMBL3582334 OBDepict F N N N H H N H N O N H N N N H 3 C O H 3 C IC50 = 4.3 nM 511.52 Cn1cc([C@@]2(c3nn(C)c(=O)o3)N[C@@H](c3nc(-c4ccc(F)cn4)c[nH]3)Cc3c2[nH]c2ccccc32)cn1 Homo sapiens CHEMBL3583381 cell-based format
CHEMBL3323080 OBDepict F N N H H N H N N H N N CH 3 O HO IC50 = 4.41 nM 533.57 Cn1cc([C@@]2(c3cccc(C(=O)O)n3)N[C@@H](c3nc(-c4ccc(F)cc4)c[nH]3)Cc3c2[nH]c2ccccc32)cn1 Homo sapiens CHEMBL3378639 cell-based format
CHEMBL3287627 OBDepict O N H H F H NH F Cl Cl Ki = 4.48 nM 413.3 O=C(N[C@@H]1CCCC[C@@H]1NCc1ccc(Cl)c(Cl)c1)c1ccc(F)c(F)c1 Homo sapiens CHEMBL3296531 cell membrane format
CHEMBL3680936 OBDepict H 3 C N O N NH O N H H N N H N CH 3 F IC50 = 4.6 nM 499.55 Cc1nnc(C2(C3CCCO3)N[C@@H](c3nc(-c4ccc(F)c(C)n4)c[nH]3)Cc3c2[nH]c2ccccc32)o1 Homo sapiens CHEMBL3705198 cell-based format
CHEMBL3582325 OBDepict CH 3 N O N NH N H N N H N N CH 3 H N F IC50 = 4.6 nM 509.55 CCc1nnc([C@]2(c3cnn(C)c3)N[C@@H](c3nc(-c4ccc(F)cn4)c[nH]3)Cc3c2[nH]c2ccccc32)o1 Homo sapiens CHEMBL3583381 cell-based format
CHEMBL3582310 OBDepict F N N H H N H H 3 C N H IC50 = 4.6 nM 422.51 CC1(c2ccccc2)N[C@@H](c2nc(-c3ccc(F)cc3)c[nH]2)Cc2c1[nH]c1ccccc21 Homo sapiens CHEMBL3583381 cell-based format
CHEMBL3582332 OBDepict H 3 C N N HN N O N H N H N N N H CH 3 H 3 C N F IC50 = 4.6 nM 538.59 CCn1cc([C@@]2(c3nnc(N(C)C)o3)N[C@@H](c3nc(-c4ccc(F)cn4)c[nH]3)Cc3c2[nH]c2ccccc32)cn1 Homo sapiens CHEMBL3583381 cell-based format
CHEMBL3775031 OBDepict H 3 C O N N H H N H H N H O IC50 = 4.6 nM 428.54 COc1cccc(-c2c[nH]c([C@H]3Cc4c([nH]c5ccccc45)[C@@H](C4CCOCC4)N3)n2)c1 Homo sapiens CHEMBL3779603 single protein format
CHEMBL3323075 OBDepict CH 3 O O N NH N H N N H N N CH 3 H F IC50 = 4.87 nM 561.62 CCOC(=O)c1ccnc([C@@]2(c3cnn(C)c3)N[C@@H](c3nc(-c4ccc(F)cc4)c[nH]3)Cc3c2[nH]c2ccccc32)c1 Homo sapiens CHEMBL3378639 cell-based format
CHEMBL3605795 OBDepict CH 3 N N H N H N H Ki = 4.9 nM 370.5 Cc1ccc(-c2c[nH]c(C3(NCc4cc5ccccc5[nH]4)CCCC3)n2)cc1 Homo sapiens CHEMBL3606126 cell-based format
CHEMBL3582324 OBDepict F N N N H H N H N N O H N N N CH 3 H 3 C IC50 = 4.9 nM 495.52 Cc1nnc([C@]2(c3cnn(C)c3)N[C@@H](c3nc(-c4ccc(F)cn4)c[nH]3)Cc3c2[nH]c2ccccc32)o1 Homo sapiens CHEMBL3583381 cell-based format
CHEMBL3582343 OBDepict CH 3 N N NH N O N H N H N N O H O OH N F IC50 = 4.9 nM 569.56 CCn1cc([C@@]2(c3nn(CC(=O)O)c(=O)o3)N[C@@H](c3nc(-c4ccc(F)cn4)c[nH]3)Cc3c2[nH]c2ccccc32)cn1 Homo sapiens CHEMBL3583381 cell-based format
CHEMBL3605786 OBDepict H 3 C N N H NH N H Ki = 5.3 nM 384.53 Cc1ccc(-c2c[nH]c(C3(NCc4c[nH]c5ccccc45)CCCCC3)n2)cc1 Homo sapiens CHEMBL3606126 cell-based format
CHEMBL3605788 OBDepict H N N N H N H Ki = 5.4 nM 356.47 c1ccc(-c2c[nH]c(C3(NCc4c[nH]c5ccccc45)CCCC3)n2)cc1 Homo sapiens CHEMBL3606126 cell-based format
CHEMBL3582327 OBDepict CH 3 N N NH N O N H N H N N OH H N F IC50 = 5.4 nM 511.52 CCn1cc([C@@]2(c3nnc(O)o3)N[C@@H](c3nc(-c4ccc(F)cn4)c[nH]3)Cc3c2[nH]c2ccccc32)cn1 Homo sapiens CHEMBL3583381 cell-based format
CHEMBL3582330 OBDepict F N N N H H N H N N O H N N N H 2 N CH 3 IC50 = 5.6 nM 496.51 Cn1cc([C@@]2(c3nnc(N)o3)N[C@@H](c3nc(-c4ccc(F)cn4)c[nH]3)Cc3c2[nH]c2ccccc32)cn1 Homo sapiens CHEMBL3583381 cell-based format
CHEMBL3287614 OBDepict F N H O H H N H Cl Cl Ki = 6.84 nM 395.31 O=C(N[C@@H]1CCCC[C@@H]1NCc1ccc(Cl)c(Cl)c1)c1ccc(F)cc1 Homo sapiens CHEMBL3296531 cell membrane format
CHEMBL173778 OBDepict H 3 C NH N H N N CH 3 H H 3 C Ki = 6.9 nM 468.69 CCCCCC1(CCCCC)NC(c2nc(-c3ccccc3)c[nH]2)Cc2c1[nH]c1ccc(C)cc21 Homo sapiens CHEMBL807040 cell-based format
CHEMBL2204942 OBDepict F N N H H N H H N H N N CH 3 IC50 = 6.9 nM 412.47 Cn1cc([C@H]2N[C@@H](c3nc(-c4ccc(F)cc4)c[nH]3)Cc3c2[nH]c2ccccc32)cn1 Homo sapiens CHEMBL2210526 cell-based format
CHEMBL3775061 OBDepict F N N N H H N H N N N H O N N CH 3 H 3 C IC50 = 6.9 nM 495.52 Cc1nc([C@@]2(c3cnn(C)c3)N[C@@H](c3nc(-c4ccc(F)cn4)c[nH]3)Cc3c2[nH]c2ccccc32)no1 Homo sapiens CHEMBL3779603 single protein format
CHEMBL2069508 OBDepict O N O CH 3 H 3 C CH 3 N H N H H N N H IC50 = 7.0 nM 497.64 CC(C)(C)OC(=O)N1CCC(C2N[C@@H](c3nc(-c4ccccc4)c[nH]3)Cc3c2[nH]c2ccccc32)CC1 Homo sapiens CHEMBL2072489 cell-based format
CHEMBL2204931 OBDepict F N N H H N H H N H N N CH 3 IC50 = 7.2 nM 412.47 Cn1cc([C@@H]2N[C@@H](c3nc(-c4ccc(F)cc4)c[nH]3)Cc3c2[nH]c2ccccc32)cn1 Homo sapiens CHEMBL2210526 cell-based format
CHEMBL3582328 OBDepict CH 3 N N NH N O N H N H N N SH H N F IC50 = 7.6 nM 527.59 CCn1cc([C@@]2(c3nnc(S)o3)N[C@@H](c3nc(-c4ccc(F)cn4)c[nH]3)Cc3c2[nH]c2ccccc32)cn1 Homo sapiens CHEMBL3583381 cell-based format
CHEMBL3775387 OBDepict H 3 C O N N N H H N H H N H O IC50 = 8.0 nM 429.52 COc1cccc(-c2c[nH]c([C@H]3Cc4c([nH]c5ccccc45)[C@@H](C4CCOCC4)N3)n2)n1 Homo sapiens CHEMBL3779603 single protein format
CHEMBL3774866 OBDepict Cl N N H H NH H N H O IC50 = 8.1 nM 432.96 Clc1ccc(-c2c[nH]c([C@H]3Cc4c([nH]c5ccccc45)[C@@H](C4CCOCC4)N3)n2)cc1 Homo sapiens CHEMBL3779603 single protein format
CHEMBL3774817 OBDepict F N N H H NH H N H O IC50 = 8.2 nM 416.5 Fc1cccc(-c2c[nH]c([C@H]3Cc4c([nH]c5ccccc45)[C@@H](C4CCOCC4)N3)n2)c1 Homo sapiens CHEMBL3779603 single protein format
CHEMBL3287647 OBDepict O NH N H H H N H F Cl Cl Ki = 9.0 nM 410.32 O=C(Nc1ccc(F)cc1)N[C@@H]1CCCC[C@@H]1NCc1ccc(Cl)c(Cl)c1 Homo sapiens CHEMBL3296531 cell membrane format
CHEMBL2204933 OBDepict F N N H H N H H N N N H O CH 3 IC50 = 9.2 nM 414.44 Cc1nc([C@@H]2N[C@@H](c3nc(-c4ccc(F)cc4)c[nH]3)Cc3c2[nH]c2ccccc32)no1 Homo sapiens CHEMBL2210526 cell-based format
CHEMBL3775760 OBDepict CH 3 O N N NH N H N N H N N CH 3 H N IC50 = 9.4 nM 477.53 Cc1nc([C@]2(c3cnn(C)c3)N[C@@H](c3nc(-c4ccccn4)c[nH]3)Cc3c2[nH]c2ccccc32)no1 Homo sapiens CHEMBL3779603 single protein format
CHEMBL3775284 OBDepict H N N H NH S H N H O IC50 = 10.0 nM 454.6 c1ccc2c3c([nH]c2c1)[C@@H](C1CCOCC1)N[C@@H](c1nc(-c2csc4ccccc24)c[nH]1)C3 Homo sapiens CHEMBL3779603 single protein format
CHEMBL3323085 OBDepict F N N H H N H N H N N N CH 3 O HO IC50 = 10.8 nM 533.57 Cn1cc([C@]2(c3cncc(C(=O)O)c3)N[C@@H](c3nc(-c4ccc(F)cc4)c[nH]3)Cc3c2[nH]c2ccccc32)cn1 Homo sapiens CHEMBL3378639 cell-based format
CHEMBL2367839 OBDepict H 3 C N H N H H N N H Ki = 11.0 nM 384.53 CCCCCC1N[C@H](c2nc(-c3ccccc3)c[nH]2)Cc2c1[nH]c1ccccc21 Homo sapiens CHEMBL807040 cell-based format
CHEMBL2367838 OBDepict H 3 C NH CH 3 N H H N N H Ki = 11.0 nM 370.5 CCC1(CC)N[C@H](c2nc(-c3ccccc3)c[nH]2)Cc2c1[nH]c1ccccc21 Homo sapiens CHEMBL807040 cell-based format
CHEMBL3582312 OBDepict H N N H HN N N H IC50 = 11.3 nM 397.53 c1ccc(-c2c[nH]c([C@H]3Cc4c([nH]c5ccccc45)C(C4CCCCC4)N3)n2)nc1 Homo sapiens CHEMBL3583381 cell-based format
CHEMBL3582307 OBDepict F N N H H N H N H IC50 = 11.4 nM 332.38 Fc1ccc(-c2c[nH]c([C@H]3Cc4c([nH]c5ccccc45)CN3)n2)cc1 Homo sapiens CHEMBL3583381 cell-based format
CHEMBL3582314 OBDepict H N N H NH N N H IC50 = 11.5 nM 397.53 c1ccc2c3c([nH]c2c1)C(C1CCCCC1)N[C@@H](c1nc(-c2ccncc2)c[nH]1)C3 Homo sapiens CHEMBL3583381 cell-based format
CHEMBL2367842 OBDepict H N N H NH N H Ki = 13.0 nM 416.53 c1ccc(-c2c[nH]c([C@@H]3Cc4c([nH]c5ccccc45)C4(Cc5ccccc5C4)N3)n2)cc1 Homo sapiens CHEMBL807040 cell-based format
CHEMBL3582323 OBDepict NH 2 O N N NH N H N N H N N CH 3 H N F IC50 = 13.7 nM 510.54 Cn1cc([C@@]2(c3noc(CN)n3)N[C@@H](c3nc(-c4ccc(F)cn4)c[nH]3)Cc3c2[nH]c2ccccc32)cn1 Homo sapiens CHEMBL3583381 cell-based format
CHEMBL2069502 OBDepict H N N H NH H N H O IC50 = 14.0 nM 398.51 c1ccc(-c2c[nH]c([C@H]3Cc4c([nH]c5ccccc45)[C@@H](C4CCOCC4)N3)n2)cc1 Homo sapiens CHEMBL2072489 cell-based format