HOME LIGAND hPROTEOME OTHERS DOCUMENT

P31644 | GBRA5_HUMAN | Gamma-aminobutyric acid receptor subunit alpha-5 (GABRA5)

3D structures mapped by conservation among orthologs

[ Domain: "Nicotinic receptor ligand binding domain-like" // Neur_chan_LBD ]

download pymol session

[ Domain: "Neurotransmitter-gated ion-channel transmembrane pore" // Neur_chan_memb ]

download pymol session

[ Domain: pdbs with more than 2 multi-domains ]

download pymol session



[ 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
CHEMBL3681588 OBDepict OH O N CH 3 O N N O NH 2 Cl Ki = 0.1 nM 388.81 Cc1onc(-c2ccc(Cl)cn2)c1COC(O)Cc1ccc(C(N)=O)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681586 OBDepict Cl N N O O CH 3 F F F N O NH 2 Ki = 0.2 nM 426.78 Cc1onc(-c2ccc(Cl)cn2)c1COC(c1ccc(C(N)=O)cn1)C(F)(F)F Homo sapiens CHEMBL3705480 single protein format
CHEMBL3676421 OBDepict F N N O O CH 3 N HN O F F F Ki = 0.3 nM 410.33 Cc1onc(-c2ccc(F)cn2)c1COc1ccc(C(=O)NCC(F)(F)F)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3676426 OBDepict Cl N N O O H 3 C N N H O Ki = 0.3 nM 384.82 Cc1onc(-c2ccc(Cl)cn2)c1COc1ccc(C(=O)NC2CC2)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3676425 OBDepict CH 3 HN CH 3 O N O H 3 C O N N Cl Ki = 0.3 nM 386.84 Cc1onc(-c2ccc(Cl)cn2)c1COc1ccc(C(=O)NC(C)C)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3676424 OBDepict Cl N N O O H 3 C N NH O O Ki = 0.3 nM 428.88 Cc1onc(-c2ccc(Cl)cn2)c1COc1ccc(C(=O)NC2CCOCC2)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681585 OBDepict Cl N N O O CH 3 N O NH 2 Ki = 0.3 nM 398.85 Cc1onc(-c2ccc(Cl)cn2)c1COC(c1ccc(C(N)=O)cn1)C1CC1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3676436 OBDepict F NH N O O CH 3 N HN O CH 3 CH 3 Ki = 0.3 nM 376.43 Cc1onc(C2CCC(F)CN2)c1COc1ccc(C(=O)NC(C)C)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681587 OBDepict Cl N N O O CH 3 N N O S Ki = 0.4 nM 430.92 Cc1onc(-c2ccc(Cl)cn2)c1COc1ccc(C(=O)N2CCSCC2)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3676435 OBDepict F HN N O O H 3 C N NH O O Ki = 0.4 nM 418.47 Cc1onc(C2CCC(F)CN2)c1COc1ccc(C(=O)NC2CCOCC2)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3676422 OBDepict HO HN O N O H 3 C O N N F Ki = 0.4 nM 372.36 Cc1onc(-c2ccc(F)cn2)c1COc1ccc(C(=O)NCCO)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681567 OBDepict CH 3 HN CH 3 O N O H 3 C O N F Cl Ki = 0.4 nM 403.84 Cc1onc(-c2ccc(Cl)cc2F)c1COc1ccc(C(=O)NC(C)C)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3639753 OBDepict F N H N O O H 3 C N N H O Ki = 0.4 nM 388.44 Cc1onc(C2CCC(F)CN2)c1COc1ccc(C(=O)NCC2CC2)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL52030 OBDepict CH 3 O O N N H N O O CH 3 Ki = 0.45 nM 341.37 CCOC(=O)c1ncn2c1[C@@H]1CCCN1C(=O)c1cc(OC)ccc1-2 Homo sapiens CHEMBL2327954 single protein format
CHEMBL3676433 OBDepict HO HN O N O H 3 C O N HN Ki = 0.5 nM 360.41 Cc1onc(C2CCCCN2)c1COc1ccc(C(=O)NCCO)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681583 OBDepict F N N O O CH 3 N HN O CH 3 H F F F Ki = 0.5 nM 424.35 Cc1onc(-c2ccc(F)cn2)c1COc1ccc(C(=O)N[C@@H](C)C(F)(F)F)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681554 OBDepict OH N H CH 3 H O N O H 3 C O N Cl Ki = 0.5 nM 401.85 Cc1onc(-c2ccc(Cl)cc2)c1COc1ccc(C(=O)N[C@@H](C)CO)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681557 OBDepict Cl N O O H 3 C N NH O H H OH Ki = 0.5 nM 427.89 Cc1onc(-c2ccc(Cl)cc2)c1COc1ccc(C(=O)N[C@H]2CCC[C@@H]2O)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3676423 OBDepict CH 3 N H O N O CH 3 O N N F Ki = 0.5 nM 356.36 CCNC(=O)c1ccc(OCc2c(-c3ccc(F)cn3)noc2C)nc1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3676448 OBDepict Cl HN N O O H 3 C N N O S O O Ki = 0.6 nM 468.96 Cc1onc(C2CNCC(Cl)C2)c1COc1ccc(C(=O)N2CCS(=O)(=O)CC2)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3639804 OBDepict Cl N N O O CH 3 N N O O Ki = 0.6 nM 414.85 Cc1onc(-c2ccc(Cl)cn2)c1COc1ccc(C(=O)N2CCOCC2)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681584 OBDepict F N N O O H 3 C N O NH 2 Ki = 0.6 nM 342.33 Cc1onc(-c2ccc(F)cn2)c1COCc1ccc(C(N)=O)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681570 OBDepict CH 3 HN CH 3 O N O H 3 C O N N Ki = 0.6 nM 352.39 Cc1onc(-c2ccccn2)c1COc1ccc(C(=O)NC(C)C)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681531 OBDepict CH 3 N H F F F O N O H 3 C O N Ki = 0.6 nM 405.38 Cc1onc(-c2ccccc2)c1COc1ccc(C(=O)NC(C)C(F)(F)F)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681582 OBDepict Cl N N O O CH 3 HO CH 3 H 3 C N O NH 2 Ki = 0.6 nM 416.87 Cc1onc(-c2ccc(Cl)cn2)c1COC(O)C(C)(C)c1ccc(C(N)=O)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3676437 OBDepict F N H N O O H 3 C N N H O Ki = 0.6 nM 374.42 Cc1onc(C2CCC(F)CN2)c1COc1ccc(C(=O)NC2CC2)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL458147 OBDepict Cl N O N CH 3 N O O H 3 C H 3 C CH 3 Ki = 0.65 nM 333.78 Cn1c(=O)c2cc(Cl)ccc2n2cnc(C(=O)OC(C)(C)C)c12 Homo sapiens CHEMBL991887 single protein format
CHEMBL306422 OBDepict CH 3 N N N O N N N N N O H 3 C Ki = 0.66 nM 362.35 Cc1cc(-c2nnc3c4ccccc4c(OCc4cn(C)nn4)nn23)no1 Homo sapiens CHEMBL4403720 single protein format
CHEMBL3681425 OBDepict CH 3 HN CH 3 O N O H 3 C O N Cl Ki = 0.7 nM 385.85 Cc1onc(-c2ccc(Cl)cc2)c1COc1ccc(C(=O)NC(C)C)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681508 OBDepict CH 3 N H H OH O N O CH 3 O N Ki = 0.7 nM 381.43 CC[C@@H](CO)NC(=O)c1ccc(OCc2c(-c3ccccc3)noc2C)nc1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3676556 OBDepict CH 3 HN CH 3 O N O H 3 C O N F Ki = 0.7 nM 369.4 Cc1onc(-c2ccc(F)cc2)c1COc1ccc(C(=O)NC(C)C)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681498 OBDepict OH N H CH 3 H O N O H 3 C O N Ki = 0.7 nM 367.4 Cc1onc(-c2ccccc2)c1COc1ccc(C(=O)N[C@@H](C)CO)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681556 OBDepict Cl N O O H 3 C N NH O H H OH Ki = 0.7 nM 427.89 Cc1onc(-c2ccc(Cl)cc2)c1COc1ccc(C(=O)N[C@@H]2CCC[C@H]2O)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681416 OBDepict F N O O H 3 C N NH O O Ki = 0.8 nM 411.43 Cc1onc(-c2ccc(F)cc2)c1COc1ccc(C(=O)NC2CCOCC2)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681550 OBDepict CH 3 N H CH 3 O N O CH 3 O N F H 3 C Ki = 0.8 nM 383.42 Cc1ccc(-c2noc(C)c2COc2ccc(C(=O)NC(C)C)cn2)c(F)c1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681552 OBDepict Cl N O O H 3 C N N H O N N H 3 C Ki = 0.8 nM 423.86 Cc1onc(-c2ccc(Cl)cc2)c1COc1ccc(C(=O)Nc2cnn(C)c2)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681553 OBDepict OH N H CH 3 H O N O H 3 C O N Cl Ki = 0.8 nM 401.85 Cc1onc(-c2ccc(Cl)cc2)c1COc1ccc(C(=O)N[C@H](C)CO)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681427 OBDepict Cl N O O H 3 C N NH O O Ki = 0.8 nM 427.89 Cc1onc(-c2ccc(Cl)cc2)c1COc1ccc(C(=O)NC2CCOCC2)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL415290 OBDepict H 3 C O O N N N H 3 C O Cl Ki = 0.85 nM 319.75 CCOC(=O)c1ncn2c1CN(C)C(=O)c1cc(Cl)ccc1-2 Homo sapiens CHEMBL991887 single protein format
CHEMBL3681548 OBDepict CH 3 N O O H 3 C N N H O O Ki = 0.9 nM 407.47 Cc1ccc(-c2noc(C)c2COc2ccc(C(=O)NC3CCOCC3)cn2)cc1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681549 OBDepict H 3 C N H CH 3 O N O H 3 C O N CH 3 Ki = 1.0 nM 365.43 Cc1ccc(-c2noc(C)c2COc2ccc(C(=O)NC(C)C)cn2)cc1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681492 OBDepict HO N H CH 3 O N O CH 3 O N Ki = 1.0 nM 367.4 Cc1onc(-c2ccccc2)c1COc1ccc(C(=O)NC(C)CO)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681543 OBDepict CH 3 O N O N N N N H CH 3 Ki = 1.1 nM 347.38 Cc1nnc(-c2ccc(OCc3c(-c4ccccc4)noc3C)nc2)[nH]1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681534 OBDepict H 3 C N N N H O N O H 3 C O N Ki = 1.1 nM 389.42 Cc1onc(-c2ccccc2)c1COc1ccc(C(=O)Nc2cnn(C)c2)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681415 OBDepict F N O O H 3 C N N H O Ki = 1.1 nM 367.38 Cc1onc(-c2ccc(F)cc2)c1COc1ccc(C(=O)NC2CC2)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681569 OBDepict O N H N O O CH 3 O N N Ki = 1.1 nM 394.43 Cc1onc(-c2ccccn2)c1COc1ccc(C(=O)NC2CCOCC2)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681572 OBDepict O NH N F F F O CH 3 O N N Ki = 1.1 nM 392.34 Cc1onc(-c2ccccn2)c1COc1ccc(C(=O)NCC(F)(F)F)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681426 OBDepict Cl N O O H 3 C N N H O Ki = 1.1 nM 383.84 Cc1onc(-c2ccc(Cl)cc2)c1COc1ccc(C(=O)NC2CC2)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL204696 OBDepict N F F N N N N HO CH 3 CH 3 Ki = 1.1 nM 391.38 CC(C)(O)c1cnn2c(-c3ccc(F)c(-c4c(F)cccc4C#N)c3)cnc2n1 Homo sapiens CHEMBL4403720 single protein format
CHEMBL3676431 OBDepict CH 3 N H O N O CH 3 O N HN Ki = 1.1 nM 344.42 CCNC(=O)c1ccc(OCc2c(C3CCCCN3)noc2C)nc1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3676434 OBDepict CH 3 O N H O N O CH 3 O N HN Ki = 1.1 nM 374.44 COCCNC(=O)c1ccc(OCc2c(C3CCCCN3)noc2C)nc1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3676554 OBDepict F N O O CH 3 N HN O F F F Ki = 1.2 nM 409.34 Cc1onc(-c2ccc(F)cc2)c1COc1ccc(C(=O)NCC(F)(F)F)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3676447 OBDepict F HN N O O H 3 C N N O S O O Ki = 1.2 nM 452.51 Cc1onc(C2CNCC(F)C2)c1COc1ccc(C(=O)N2CCS(=O)(=O)CC2)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3676438 OBDepict OH N H H 3 C CH 3 O N O H 3 C O N N H F Ki = 1.2 nM 406.46 Cc1onc(C2CCC(F)CN2)c1COc1ccc(C(=O)NC(C)(C)CO)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681555 OBDepict Cl N O O CH 3 N HN O CH 3 H F F F Ki = 1.3 nM 439.82 Cc1onc(-c2ccc(Cl)cc2)c1COc1ccc(C(=O)N[C@@H](C)C(F)(F)F)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3676430 OBDepict CH 3 N H O N O CH 3 O N HN Ki = 1.3 nM 330.39 CNC(=O)c1ccc(OCc2c(C3CCCCN3)noc2C)nc1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3676478 OBDepict CH 3 HN CH 3 O N O H 3 C O N Ki = 1.3 nM 351.41 Cc1onc(-c2ccccc2)c1COc1ccc(C(=O)NC(C)C)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681424 OBDepict Cl N O O H 3 C N N H O Ki = 1.3 nM 397.86 Cc1onc(-c2ccc(Cl)cc2)c1COc1ccc(C(=O)NCC2CC2)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681529 OBDepict O N H N H 3 C O O CH 3 O N Ki = 1.4 nM 379.42 Cc1onc(-c2ccccc2)c1COc1ccc(C(=O)NC2(C)COC2)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3676516 OBDepict CH 3 N O NH O H 3 C O N O Ki = 1.4 nM 407.47 Cc1cc(C(=O)NC2CCOCC2)cnc1OCc1c(-c2ccccc2)noc1C Homo sapiens CHEMBL3705480 single protein format
CHEMBL363211 OBDepict H 3 C O N N N N N O H 3 C H 3 C CH 3 N N H 3 C N Ki = 1.4 nM 368.4 Cc1cc(-c2nncc3c(C(C)(C)C)c(OCc4ncnn4C)nn23)no1 Homo sapiens CHEMBL2327954 single protein format
CHEMBL3676555 OBDepict F N O O H 3 C N N H O Ki = 1.5 nM 381.41 Cc1onc(-c2ccc(F)cc2)c1COc1ccc(C(=O)NCC2CC2)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681573 OBDepict O NH N O CH 3 O N N Ki = 1.5 nM 364.41 Cc1onc(-c2ccccn2)c1COc1ccc(C(=O)NCC2CC2)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681574 OBDepict CH 3 O N O N N HN O Ki = 1.6 nM 350.38 Cc1onc(-c2ccccn2)c1COc1ccc(C(=O)NC2CC2)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681580 OBDepict CH 3 O O N O CH 3 O N N Cl Ki = 1.6 nM 359.77 COC(=O)c1ccc(OCc2c(-c3ccc(Cl)cn3)noc2C)nc1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681502 OBDepict O N H N H O O CH 3 O N Ki = 1.6 nM 379.42 Cc1onc(-c2ccccc2)c1COc1ccc(C(=O)N[C@H]2CCOC2)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681513 OBDepict O N H N H H OH O H 3 C O N Ki = 1.6 nM 393.44 Cc1onc(-c2ccccc2)c1COc1ccc(C(=O)N[C@@H]2CCC[C@H]2O)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681497 OBDepict OH N H CH 3 H O N O H 3 C O N Ki = 1.7 nM 367.4 Cc1onc(-c2ccccc2)c1COc1ccc(C(=O)N[C@H](C)CO)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681501 OBDepict HO N H OH O N O CH 3 O N Ki = 1.7 nM 383.4 Cc1onc(-c2ccccc2)c1COc1ccc(C(=O)NC(CO)CO)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3676542 OBDepict F N O O CH 3 N N H O O Ki = 1.7 nM 411.43 Cc1onc(-c2cccc(F)c2)c1COc1ccc(C(=O)NC2CCOCC2)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681506 OBDepict OH N H H H 3 C CH 3 O N O CH 3 O N Ki = 1.8 nM 395.46 Cc1onc(-c2ccccc2)c1COc1ccc(C(=O)N[C@H](CO)C(C)C)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681532 OBDepict O NH N H 3 C H F F F O CH 3 O N Ki = 1.9 nM 405.38 Cc1onc(-c2ccccc2)c1COc1ccc(C(=O)N[C@@H](C)C(F)(F)F)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL1077391 OBDepict Cl N N N N N Cl Ki = 2.0 nM 292.13 Clc1ccc2c(c1)-c1ncnn1Cc1c(Cl)ncn1-2 Homo sapiens CHEMBL4403720 single protein format
CHEMBL3681577 OBDepict CH 3 O O N O CH 3 O N N F Ki = 2.0 nM 343.31 COC(=O)c1ccc(OCc2c(-c3ccc(F)cn3)noc2C)nc1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681512 OBDepict O N H N H H OH O H 3 C O N Ki = 2.0 nM 393.44 Cc1onc(-c2ccccc2)c1COc1ccc(C(=O)N[C@H]2CCC[C@@H]2O)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681518 OBDepict OH OH N H O N O CH 3 O N Ki = 2.0 nM 383.4 Cc1onc(-c2ccccc2)c1COc1ccc(C(=O)NCC(O)CO)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3676463 OBDepict F F NH O N O H 3 C O N Ki = 2.0 nM 373.36 Cc1onc(-c2ccccc2)c1COc1ccc(C(=O)NCC(F)F)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681423 OBDepict Cl N O O CH 3 N HN O F F F Ki = 2.1 nM 425.79 Cc1onc(-c2ccc(Cl)cc2)c1COc1ccc(C(=O)NCC(F)(F)F)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681496 OBDepict O NH N OH O CH 3 O N Ki = 2.1 nM 379.42 Cc1onc(-c2ccccc2)c1COc1ccc(C(=O)NCC2(O)CC2)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3676483 OBDepict O N H N O O CH 3 O N Ki = 2.1 nM 393.44 Cc1onc(-c2ccccc2)c1COc1ccc(C(=O)NC2CCOCC2)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681519 OBDepict OH N H O N O CH 3 O N Ki = 2.2 nM 367.41 Cc1onc(-c2ccccc2)c1COc1ccc(C(=O)NCCCO)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3676464 OBDepict O NH N F F F O CH 3 O N Ki = 2.2 nM 391.35 Cc1onc(-c2ccccc2)c1COc1ccc(C(=O)NCC(F)(F)F)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681509 OBDepict CH 3 N H H OH O N O CH 3 O N Ki = 2.3 nM 381.43 CC[C@H](CO)NC(=O)c1ccc(OCc2c(-c3ccccc3)noc2C)nc1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681515 OBDepict CH 3 OH HN O N O H 3 C O N Ki = 2.3 nM 381.43 Cc1onc(-c2ccccc2)c1COc1ccc(C(=O)NCCC(C)O)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3676540 OBDepict CH 3 HN CH 3 O N O H 3 C O N F Ki = 2.3 nM 369.4 Cc1onc(-c2cccc(F)c2)c1COc1ccc(C(=O)NC(C)C)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681561 OBDepict F F N O O H 3 C N NH O O Ki = 2.3 nM 429.42 Cc1onc(-c2ccc(F)cc2F)c1COc1ccc(C(=O)NC2CCOCC2)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681495 OBDepict O NH N OH H 3 C H 3 C O CH 3 O N Ki = 2.3 nM 381.43 Cc1onc(-c2ccccc2)c1COc1ccc(C(=O)NCC(C)(C)O)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681488 OBDepict HO F F F HN O N O H 3 C O N Ki = 2.3 nM 421.38 Cc1onc(-c2ccccc2)c1COc1ccc(C(=O)NCC(O)C(F)(F)F)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL373250 OBDepict F F N N N N O H 3 C H 3 C CH 3 N N CH 3 N Ki = 2.3 nM 399.41 Cn1ncnc1COc1nn2c(-c3cc(F)ccc3F)nnc2cc1C(C)(C)C Homo sapiens CHEMBL2327954 single protein format
CHEMBL3681560 OBDepict CH 3 HN CH 3 O N O H 3 C O N F F Ki = 2.4 nM 387.39 Cc1onc(-c2ccc(F)cc2F)c1COc1ccc(C(=O)NC(C)C)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681432 OBDepict O N H N O O H 3 C O N F F Ki = 2.4 nM 429.42 Cc1onc(-c2ccc(F)c(F)c2)c1COc1ccc(C(=O)NC2CCOCC2)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3676466 OBDepict H 3 C OH NH O N O H 3 C O N Ki = 2.5 nM 367.4 Cc1onc(-c2ccccc2)c1COc1ccc(C(=O)NCC(C)O)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681520 OBDepict HO HN O N O H 3 C O N Ki = 2.6 nM 381.43 Cc1onc(-c2ccccc2)c1COc1ccc(C(=O)NCCCCO)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3676465 OBDepict HO HN O N O H 3 C O N Ki = 2.6 nM 353.38 Cc1onc(-c2ccccc2)c1COc1ccc(C(=O)NCCO)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681524 OBDepict O N H N O O H 3 C O N Ki = 2.6 nM 469.54 Cc1onc(-c2ccccc2)c1COc1ccc(C(=O)NC2CC(OCc3ccccc3)C2)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3675681 OBDepict F N N N H 3 C N S CH 3 NH O O Ki = 2.6 nM 427.51 Cc1nc(/C=C/c2c(C)nnn2-c2ccc(F)cc2)sc1C(=O)NC1CCOCC1 Homo sapiens CHEMBL3705192 assay format
CHEMBL73416 OBDepict CH 3 N O H 3 C N N Cl IC50 = 2.7 nM 341.84 CCCC(=O)N(C)Cc1c(-c2ccc(Cl)cc2)nc2ccccn12 Homo sapiens CHEMBL677202 tissue-based format
CHEMBL3676479 OBDepict CH 3 O N O N HN O Ki = 2.7 nM 349.39 Cc1onc(-c2ccccc2)c1COc1ccc(C(=O)NC2CC2)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681511 OBDepict O N H N H H OH O H 3 C O N Ki = 2.7 nM 393.44 Cc1onc(-c2ccccc2)c1COc1ccc(C(=O)N[C@H]2CCC[C@H]2O)cn1 Homo sapiens CHEMBL3705480 single protein format
CHEMBL3681430 OBDepict H 3 C O N O N F F NH O F F F Ki = 2.7 nM 427.33 Cc1onc(-c2ccc(F)c(F)c2)c1COc1ccc(C(=O)NCC(F)(F)F)cn1 Homo sapiens CHEMBL3705480 single protein format