HOME LIGAND hPROTEOME OTHERS DOCUMENT

P21980 | TGM2_HUMAN | Protein-glutamine gamma-glutamyltransferase 2 (TGM2)

3D structures mapped by conservation among orthologs

[ Domain: "Immunoglobulin/Fibronectin type III/E set domains/PapD-like" // Transglut_N ]

download pymol session

[ Domain: "Immunoglobulin/Fibronectin type III/E set domains/PapD-like" // Transglut_C_1 ]

download pymol session

[ Domain: "Immunoglobulin/Fibronectin type III/E set domains/PapD-like" // Transglut_C ]

download pymol session

[ Domain: "Cysteine proteinases" // Transglut_core ]

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
CHEMBL4076082 OBDepict H 2 C NH O N O N S O O N CH 3 H 3 C IC50 = 6.0 nM 430.53 C=CC(=O)NCC(=O)N1CCN(S(=O)(=O)c2cccc3c(N(C)C)cccc23)CC1 Homo sapiens CHEMBL4024883 single protein format
CHEMBL3423198 OBDepict O N H H O H O NH 2 Cl Br IC50 = 9.6 nM 319.54 NC(=O)[C@@H]1O[C@@H]1C(=O)Nc1ccc(Br)c(Cl)c1 Homo sapiens CHEMBL3424618 single protein format
CHEMBL2086528 OBDepict CH 2 HN O S N O O N O IC50 = 10.0 nM 457.6 C=CC(=O)Nc1ccc(S(=O)(=O)N2CCN(C(=O)C34CC5CC(CC(C5)C3)C4)CC2)cc1 Homo sapiens CHEMBL2091156 single protein format
CHEMBL2086544 OBDepict CH 2 HN O N N S N O O N O IC50 = 14.0 nM 459.57 C=CC(=O)Nc1ncc(S(=O)(=O)N2CCN(C(=O)C34CC5CC(CC(C5)C3)C4)CC2)cn1 Homo sapiens CHEMBL2091156 single protein format
CHEMBL2203451 OBDepict CH 2 N H O N H H N O O N N CH 3 IC50 = 14.0 nM 477.61 C=CC(=O)NCCCC[C@H](NC(=O)Cc1ccccc1)C(=O)N1CCN(c2cccc(C)n2)CC1 Homo sapiens CHEMBL2214887 single protein format
CHEMBL3949090 OBDepict O N O N N O S O + N _ O IC50 = 14.0 nM 428.47 O=C(CCOc1ccccc1)N1CCN(C(=O)n2sc3c(ccc[n+]3[O-])c2=O)CC1 Homo sapiens CHEMBL3887909 single protein format
CHEMBL2086541 OBDepict CH 2 HN O N S N O O N O IC50 = 15.0 nM 458.58 C=CC(=O)Nc1ccc(S(=O)(=O)N2CCN(C(=O)C34CC5CC(CC(C5)C3)C4)CC2)cn1 Homo sapiens CHEMBL2091156 single protein format
CHEMBL2086523 OBDepict CH 2 HN O S N O O N N O IC50 = 20.0 nM 460.6 C=CC(=O)Nc1ccc(S(=O)(=O)N2CCN(C(=O)N3CCC4CCCCC4C3)CC2)cc1 Homo sapiens CHEMBL2091156 single protein format
CHEMBL2086530 OBDepict CH 2 HN O S N O O N N CH 3 IC50 = 25.0 nM 386.48 C=CC(=O)Nc1ccc(S(=O)(=O)N2CCN(c3ncccc3C)CC2)cc1 Homo sapiens CHEMBL2091156 single protein format
CHEMBL2086889 OBDepict CH 3 O N N N H 3 C N O N H 3 C O IC50 = 25.0 nM 313.32 CCn1nc(-c2ccc(OC)cc2)nc2c(=O)n(C)c(=O)nc1-2 Homo sapiens CHEMBL2091156 single protein format
CHEMBL2086524 OBDepict CH 2 HN O S N O O N N O IC50 = 26.0 nM 460.6 C=CC(=O)Nc1ccc(S(=O)(=O)N2CCN(C(=O)N3CCCC4CCCCC43)CC2)cc1 Homo sapiens CHEMBL2091156 single protein format
CHEMBL2086542 OBDepict CH 2 N H O N N S N O O N O O CH 3 CH 3 CH 3 IC50 = 26.0 nM 397.46 C=CC(=O)Nc1ncc(S(=O)(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cn1 Homo sapiens CHEMBL2091156 single protein format
CHEMBL2086480 OBDepict H 2 C NH O S N O O N O IC50 = 32.0 nM 391.49 C=CC(=O)Nc1ccc(S(=O)(=O)N2CCN(C(=O)C3CCCC3)CC2)cc1 Homo sapiens CHEMBL2091156 single protein format
CHEMBL2367730 OBDepict H 2 C NH O S N O O N O H H IC50 = 34.0 nM 439.54 C=CC(=O)Nc1ccc(S(=O)(=O)N2CCN(C(=O)[C@H]3C[C@@H]3c3ccccc3)CC2)cc1 Homo sapiens CHEMBL2091156 single protein format
CHEMBL2086531 OBDepict CH 2 HN O S N O O N N H 3 C IC50 = 35.0 nM 386.48 C=CC(=O)Nc1ccc(S(=O)(=O)N2CCN(c3cccc(C)n3)CC2)cc1 Homo sapiens CHEMBL2091156 single protein format
CHEMBL2086525 OBDepict CH 2 HN O S N O O N N O IC50 = 37.0 nM 406.51 C=CC(=O)Nc1ccc(S(=O)(=O)N2CCN(C(=O)N3CCCCC3)CC2)cc1 Homo sapiens CHEMBL2091156 single protein format
CHEMBL2086526 OBDepict CH 2 HN O S N O O N N O F F IC50 = 41.0 nM 442.49 C=CC(=O)Nc1ccc(S(=O)(=O)N2CCN(C(=O)N3CCC(F)(F)CC3)CC2)cc1 Homo sapiens CHEMBL2091156 single protein format
CHEMBL2086519 OBDepict H 2 C N H O S N O O N O O IC50 = 44.0 nM 407.49 C=CC(=O)Nc1ccc(S(=O)(=O)N2CCN(C(=O)OC3CCCC3)CC2)cc1 Homo sapiens CHEMBL2091156 single protein format
CHEMBL4081588 OBDepict CH 3 NH CH 3 O N O HN O N H H O N N H 3 C O O CH 3 IC50 = 45.0 nM 528.61 CCC(CC)CNC(=O)Cn1cccc(NC(=O)[C@H](CC/C=C/C(=O)OC)NC(=O)c2cncn2C)c1=O Homo sapiens CHEMBL4024878 single protein format
CHEMBL3968388 OBDepict O N N N O S O + N _ O IC50 = 45.0 nM 348.38 O=C(C1CC1)N1CCN(C(=O)n2sc3c(ccc[n+]3[O-])c2=O)CC1 Homo sapiens CHEMBL3887909 single protein format
CHEMBL3423193 OBDepict H O N H O H O H 2 N O IC50 = 46.0 nM 298.3 NC(=O)[C@H]1O[C@H]1C(=O)Nc1ccc(Oc2ccccc2)cc1 Homo sapiens CHEMBL3424618 single protein format
CHEMBL2086506 OBDepict CH 2 HN O S N O O N O O F F IC50 = 46.0 nM 465.48 C=CC(=O)Nc1ccc(S(=O)(=O)N2CCN(C(=O)OCc3cccc(F)c3F)CC2)cc1 Homo sapiens CHEMBL2091156 single protein format
CHEMBL3423202 OBDepict H 2 N O NH O H O H O NH 2 IC50 = 48.0 nM 313.31 NC(=O)[C@@H]1O[C@@H]1C(=O)Nc1ccc(Oc2ccc(N)cc2)cc1 Homo sapiens CHEMBL3424618 single protein format
CHEMBL3423194 OBDepict O N H H O H O NH 2 Cl IC50 = 48.0 nM 240.65 NC(=O)[C@H]1O[C@H]1C(=O)Nc1cccc(Cl)c1 Homo sapiens CHEMBL3424618 single protein format
CHEMBL3423195 OBDepict O N H H O H O NH 2 O IC50 = 50.0 nM 298.3 NC(=O)[C@H]1O[C@H]1C(=O)Nc1cccc(Oc2ccccc2)c1 Homo sapiens CHEMBL3424618 single protein format
CHEMBL2086532 OBDepict CH 2 HN O S N O O N N F F F IC50 = 52.0 nM 440.45 C=CC(=O)Nc1ccc(S(=O)(=O)N2CCN(c3ncccc3C(F)(F)F)CC2)cc1 Homo sapiens CHEMBL2091156 single protein format
CHEMBL2203467 OBDepict CH 2 N H O N H H N O O O IC50 = 54.0 nM 477.61 C=CC(=O)NCCCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC(c2ccccc2)CC1 Homo sapiens CHEMBL2214887 single protein format
CHEMBL2086507 OBDepict CH 2 HN O S N O O N O O F IC50 = 54.0 nM 447.49 C=CC(=O)Nc1ccc(S(=O)(=O)N2CCN(C(=O)OCc3ccc(F)cc3)CC2)cc1 Homo sapiens CHEMBL2091156 single protein format
CHEMBL2086515 OBDepict CH 2 N H O S N O O N O O O IC50 = 54.0 nM 521.6 C=CC(=O)Nc1ccc(S(=O)(=O)N2CCN(C(=O)OCc3cccc(Oc4ccccc4)c3)CC2)cc1 Homo sapiens CHEMBL2091156 single protein format
CHEMBL3932512 OBDepict CH 3 O O CH 3 N O N N O S O + N _ O IC50 = 54.0 nM 444.47 COc1ccc(C(=O)N2CCN(C(=O)n3sc4c(ccc[n+]4[O-])c3=O)CC2)cc1OC Homo sapiens CHEMBL3887909 single protein format
CHEMBL2086529 OBDepict CH 2 HN O S N O O N N IC50 = 55.0 nM 372.45 C=CC(=O)Nc1ccc(S(=O)(=O)N2CCN(c3ccccn3)CC2)cc1 Homo sapiens CHEMBL2091156 single protein format
CHEMBL2203473 OBDepict CH 2 N H O N H H N O O O N N CH 3 IC50 = 55.0 nM 493.61 C=CC(=O)NCCCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(c2cccc(C)n2)CC1 Homo sapiens CHEMBL2214887 single protein format
CHEMBL3423197 OBDepict H O N H O H O H 2 N Br IC50 = 57.0 nM 285.1 NC(=O)[C@@H]1O[C@@H]1C(=O)Nc1ccc(Br)cc1 Homo sapiens CHEMBL3424618 single protein format
CHEMBL2086527 OBDepict H 2 C NH O S N O O N N O IC50 = 57.0 nM 392.48 C=CC(=O)Nc1ccc(S(=O)(=O)N2CCN(C(=O)N3CCCC3)CC2)cc1 Homo sapiens CHEMBL2091156 single protein format
CHEMBL2086516 OBDepict CH 2 HN O S N O O N O O O IC50 = 60.0 nM 521.6 C=CC(=O)Nc1ccc(S(=O)(=O)N2CCN(C(=O)OCc3ccc(Oc4ccccc4)cc3)CC2)cc1 Homo sapiens CHEMBL2091156 single protein format
CHEMBL3891796 OBDepict CH 3 S N O O N N O S O + N _ O IC50 = 61.0 nM 372.43 CCS(=O)(=O)N1CCN(C(=O)n2sc3c(ccc[n+]3[O-])c2=O)CC1 Homo sapiens CHEMBL3887909 single protein format
CHEMBL3901025 OBDepict CH 3 N O N N O S O + N _ O IC50 = 62.0 nM 322.35 CC(=O)N1CCN(C(=O)n2sc3c(ccc[n+]3[O-])c2=O)CC1 Homo sapiens CHEMBL3887909 single protein format
CHEMBL2203469 OBDepict CH 2 N H O N H H N O O O N Cl IC50 = 62.0 nM 513.04 C=CC(=O)NCCCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(c2ccccc2Cl)CC1 Homo sapiens CHEMBL2214887 single protein format
CHEMBL3900780 OBDepict O N CH 3 CH 3 N N O S O + N _ O IC50 = 62.0 nM 350.4 CC(C)C(=O)N1CCN(C(=O)n2sc3c(ccc[n+]3[O-])c2=O)CC1 Homo sapiens CHEMBL3887909 single protein format
CHEMBL2086543 OBDepict CH 2 HN O N N S N O O N O O IC50 = 69.0 nM 431.47 C=CC(=O)Nc1ncc(S(=O)(=O)N2CCN(C(=O)OCc3ccccc3)CC2)cn1 Homo sapiens CHEMBL2091156 single protein format
CHEMBL2086512 OBDepict CH 2 HN O S N O O N O O CH 3 IC50 = 70.0 nM 443.53 C=CC(=O)Nc1ccc(S(=O)(=O)N2CCN(C(=O)OCc3ccccc3C)CC2)cc1 Homo sapiens CHEMBL2091156 single protein format
CHEMBL2086508 OBDepict CH 2 HN O S N O O N O O F F IC50 = 70.0 nM 465.48 C=CC(=O)Nc1ccc(S(=O)(=O)N2CCN(C(=O)OCc3cc(F)cc(F)c3)CC2)cc1 Homo sapiens CHEMBL2091156 single protein format
CHEMBL2086518 OBDepict CH 3 O N O N S O O N H O H 2 C IC50 = 72.0 nM 367.43 C=CC(=O)Nc1ccc(S(=O)(=O)N2CCN(C(=O)OCC)CC2)cc1 Homo sapiens CHEMBL2091156 single protein format
CHEMBL3923158 OBDepict O N N N N O S O + N _ O IC50 = 72.0 nM 385.41 O=C(c1ccccn1)N1CCN(C(=O)n2sc3c(ccc[n+]3[O-])c2=O)CC1 Homo sapiens CHEMBL3887909 single protein format
CHEMBL2086533 OBDepict CH 2 HN O S N O O N N F F F IC50 = 76.0 nM 440.45 C=CC(=O)Nc1ccc(S(=O)(=O)N2CCN(c3ccc(C(F)(F)F)cn3)CC2)cc1 Homo sapiens CHEMBL2091156 single protein format
CHEMBL2086539 OBDepict CH 2 HN O N S N O O N O O IC50 = 78.0 nM 430.49 C=CC(=O)Nc1ccc(S(=O)(=O)N2CCN(C(=O)OCc3ccccc3)CC2)cn1 Homo sapiens CHEMBL2091156 single protein format
CHEMBL2203470 OBDepict H 2 C N H O N H H N O O O N O Cl CH 3 IC50 = 78.0 nM 543.06 C=CC(=O)NCCCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(c2cc(Cl)ccc2OC)CC1 Homo sapiens CHEMBL2214887 single protein format
CHEMBL2086513 OBDepict CH 2 HN O S N O O N O O IC50 = 82.0 nM 479.56 C=CC(=O)Nc1ccc(S(=O)(=O)N2CCN(C(=O)OCc3cccc4ccccc34)CC2)cc1 Homo sapiens CHEMBL2091156 single protein format
CHEMBL3423200 OBDepict O N H H O H O NH 2 N H S O O + N O _ O IC50 = 88.0 nM 434.43 NC(=O)[C@@H]1O[C@@H]1C(=O)Nc1ccc(CCNS(=O)(=O)c2ccccc2[N+](=O)[O-])cc1 Homo sapiens CHEMBL3424618 single protein format
CHEMBL4228875 OBDepict H 2 C N H O N H H N O O N N + N O _ O IC50 = 90.0 nM 508.58 C=CC(=O)NCCCC[C@H](NC(=O)Cc1ccccc1)C(=O)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 Homo sapiens CHEMBL4223773 single protein format
CHEMBL2086509 OBDepict CH 2 HN O S N O O N O O Cl IC50 = 94.0 nM 463.94 C=CC(=O)Nc1ccc(S(=O)(=O)N2CCN(C(=O)OCc3ccccc3Cl)CC2)cc1 Homo sapiens CHEMBL2091156 single protein format
CHEMBL2089389 OBDepict H 2 C N H O S HN O O H N O O IC50 = 96.0 nM 429.5 C=CC(=O)Nc1ccc(S(=O)(=O)N[C@@H]2CCN(C(=O)OCc3ccccc3)C2)cc1 Homo sapiens CHEMBL2091156 single protein format
CHEMBL2086538 OBDepict CH 2 N H O N S N O O N O O CH 3 CH 3 CH 3 IC50 = 97.0 nM 396.47 C=CC(=O)Nc1ccc(S(=O)(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cn1 Homo sapiens CHEMBL2091156 single protein format
CHEMBL4227301 OBDepict H 2 C N H O N H H N O O N N + N O _ O IC50 = 100.0 nM 508.58 C=CC(=O)NCCCC[C@H](NC(=O)Cc1ccccc1)C(=O)N1CCN(c2cccc([N+](=O)[O-])n2)CC1 Homo sapiens CHEMBL4223773 single protein format
CHEMBL2203457 OBDepict CH 2 N H O N H H N O O O N N F F F IC50 = 110.0 nM 547.58 C=CC(=O)NCCCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(c2ccc(C(F)(F)F)cn2)CC1 Homo sapiens CHEMBL2214887 single protein format
CHEMBL3977367 OBDepict O N O N N O S O N IC50 = 110.0 nM 412.47 O=C(CCOc1ccccc1)N1CCN(C(=O)n2sc3ncccc3c2=O)CC1 Homo sapiens CHEMBL3887909 single protein format
CHEMBL2086510 OBDepict CH 2 HN O S N O O N O O F F F IC50 = 110.0 nM 497.5 C=CC(=O)Nc1ccc(S(=O)(=O)N2CCN(C(=O)OCc3ccccc3C(F)(F)F)CC2)cc1 Homo sapiens CHEMBL2091156 single protein format
CHEMBL2086517 OBDepict CH 2 N H O S N O O N O O CH 3 IC50 = 110.0 nM 353.4 C=CC(=O)Nc1ccc(S(=O)(=O)N2CCN(C(=O)OC)CC2)cc1 Homo sapiens CHEMBL2091156 single protein format
CHEMBL2086522 OBDepict H 2 C N H O S N O O N O IC50 = 110.0 nM 363.44 C=CC(=O)Nc1ccc(S(=O)(=O)N2CCN(C(=O)C3CC3)CC2)cc1 Homo sapiens CHEMBL2091156 single protein format
CHEMBL2086891 OBDepict H 2 C N H O Cl S N O O N O O H 3 C H 3 C CH 3 IC50 = 110.0 nM 429.93 C=CC(=O)Nc1ccc(S(=O)(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c(Cl)c1 Homo sapiens CHEMBL2091156 single protein format
CHEMBL4228168 OBDepict CH 2 N H O N H H N O O N N F IC50 = 110.0 nM 481.57 C=CC(=O)NCCCC[C@H](NC(=O)Cc1ccccc1)C(=O)N1CCN(c2cccc(F)n2)CC1 Homo sapiens CHEMBL4223773 single protein format
CHEMBL2152204 OBDepict H 3 C O N H O S N O O HN O CH 2 IC50 = 110.0 nM 471.58 C=CC(=O)NC1CCN(S(=O)(=O)c2ccc(C(=O)NCCc3ccc(OC)cc3)cc2)CC1 Homo sapiens CHEMBL2155208 single protein format
CHEMBL3966197 OBDepict H 2 N N O N N O S O + N _ O IC50 = 120.0 nM 337.36 NCC(=O)N1CCN(C(=O)n2sc3c(ccc[n+]3[O-])c2=O)CC1 Homo sapiens CHEMBL3887909 single protein format
CHEMBL2089386 OBDepict CH 2 N H O S N O O N O O CH 3 CH 3 CH 3 IC50 = 120.0 nM 395.48 C=CC(=O)Nc1ccc(S(=O)(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1 Homo sapiens CHEMBL2091156 single protein format
CHEMBL3969704 OBDepict CH 3 O N N O S O + N _ O IC50 = 120.0 nM 349.41 CCCC(=O)C1CCN(C(=O)n2sc3c(ccc[n+]3[O-])c2=O)CC1 Homo sapiens CHEMBL3887909 single protein format
CHEMBL2089388 OBDepict CH 2 HN O S N O O N O O IC50 = 120.0 nM 429.5 C=CC(=O)Nc1ccc(S(=O)(=O)N2CCN(C(=O)OCc3ccccc3)CC2)cc1 Homo sapiens CHEMBL2091156 single protein format
CHEMBL183659 OBDepict H 2 N NH O S N N S O Cl F F IC50 = 130.0 nM 478.93 NNC(=O)CSc1nc2sc(Cl)c(-c3ccccc3F)c2c(=O)n1-c1cccc(F)c1 Homo sapiens CHEMBL831130 single protein format
CHEMBL3895571 OBDepict O N N N N O S O + N _ O IC50 = 130.0 nM 385.41 O=C(c1ccncc1)N1CCN(C(=O)n2sc3c(ccc[n+]3[O-])c2=O)CC1 Homo sapiens CHEMBL3887909 single protein format
CHEMBL2086511 OBDepict CH 2 HN O S N O O N O O O IC50 = 130.0 nM 521.6 C=CC(=O)Nc1ccc(S(=O)(=O)N2CCN(C(=O)OCc3ccccc3Oc3ccccc3)CC2)cc1 Homo sapiens CHEMBL2091156 single protein format
CHEMBL3423199 OBDepict O N H H O H O H 2 N CH 3 CH 3 IC50 = 130.0 nM 234.25 Cc1ccc(NC(=O)[C@H]2O[C@H]2C(N)=O)cc1C Homo sapiens CHEMBL3424618 single protein format
CHEMBL4227835 OBDepict CH 2 N H O N H H N O O N N I IC50 = 140.0 nM 589.48 C=CC(=O)NCCCC[C@H](NC(=O)Cc1ccccc1)C(=O)N1CCN(c2cccc(I)n2)CC1 Homo sapiens CHEMBL4223773 single protein format
CHEMBL3977893 OBDepict _ O + N S N O N O N N N N IC50 = 140.0 nM 427.49 O=C(N1CCN(c2ccc(N3CCCC3)nn2)CC1)n1sc2c(ccc[n+]2[O-])c1=O Homo sapiens CHEMBL3887909 single protein format
CHEMBL2089393 OBDepict CH 2 HN O S N O O N O O IC50 = 140.0 nM 455.54 C=CC(=O)Nc1ccc(S(=O)(=O)N2CC3CN(C(=O)OCc4ccccc4)CC3C2)cc1 Homo sapiens CHEMBL2091156 single protein format
CHEMBL2086489 OBDepict Cl N H O S N O O N O O H 3 C H 3 C CH 3 IC50 = 140.0 nM 429.93 CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2ccc(NC(=O)/C=CCl)cc2)CC1 Homo sapiens CHEMBL2091156 single protein format
CHEMBL2152105 OBDepict CH 2 N H O N S O O N H O IC50 = 140.0 nM 447.6 C=CC(=O)NC1CCN(S(=O)(=O)c2ccc(C(=O)NCCC3CCCCC3)cc2)CC1 Homo sapiens CHEMBL2155208 single protein format
CHEMBL360314 OBDepict H 2 N NH O S N N S O F F IC50 = 140.0 nM 444.49 NNC(=O)CSc1nc2scc(-c3ccccc3F)c2c(=O)n1-c1cccc(F)c1 Homo sapiens CHEMBL831130 single protein format
CHEMBL360282 OBDepict NH 2 N H O S N N S O F O CH 3 IC50 = 140.0 nM 456.52 COc1ccccc1-c1csc2nc(SCC(=O)NN)n(-c3cccc(F)c3)c(=O)c12 Homo sapiens CHEMBL831130 single protein format
CHEMBL3894353 OBDepict O HN N N O S O + N _ O IC50 = 150.0 nM 294.29 O=C1CN(C(=O)n2sc3c(ccc[n+]3[O-])c2=O)CCN1 Homo sapiens CHEMBL3887909 single protein format
CHEMBL360924 OBDepict NH 2 HN O S N N S O CH 3 F F IC50 = 150.0 nM 458.52 Cc1sc2nc(SCC(=O)NN)n(-c3cccc(F)c3)c(=O)c2c1-c1ccccc1F Homo sapiens CHEMBL831130 single protein format
CHEMBL3423192 OBDepict CH 3 N H O H O H O NH 2 IC50 = 150.0 nM 262.31 CCCCc1ccc(NC(=O)[C@@H]2O[C@@H]2C(N)=O)cc1 Homo sapiens CHEMBL3424618 single protein format
CHEMBL3423203 OBDepict O N H H O H O NH 2 O N H O F IC50 = 150.0 nM 435.41 NC(=O)[C@@H]1O[C@@H]1C(=O)Nc1ccc(Oc2ccc(NC(=O)c3ccc(F)cc3)cc2)cc1 Homo sapiens CHEMBL3424618 single protein format
CHEMBL182890 OBDepict NH 2 HN O S N N S O CH 3 IC50 = 160.0 nM 422.54 Cc1sc2nc(SCC(=O)NN)n(-c3ccccc3)c(=O)c2c1-c1ccccc1 Homo sapiens CHEMBL831130 single protein format
CHEMBL2203475 OBDepict H 2 C N H O N H H N O O O N N F F F IC50 = 160.0 nM 547.58 C=CC(=O)NCCCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(c2ncccc2C(F)(F)F)CC1 Homo sapiens CHEMBL2214887 single protein format
CHEMBL2086520 OBDepict CH 2 HN O S N O O N O IC50 = 160.0 nM 427.53 C=CC(=O)Nc1ccc(S(=O)(=O)N2CCN(C(=O)CCc3ccccc3)CC2)cc1 Homo sapiens CHEMBL2091156 single protein format
CHEMBL2152199 OBDepict CH 2 HN O N S O O N H O IC50 = 170.0 nM 477.59 C=CC(=O)NC1CCN(S(=O)(=O)c2ccc(C(=O)NCc3cccc4ccccc34)cc2)CC1 Homo sapiens CHEMBL2155208 single protein format
CHEMBL2203474 OBDepict CH 2 N H O N H H N O O O N N CH 3 IC50 = 170.0 nM 493.61 C=CC(=O)NCCCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(c2ncccc2C)CC1 Homo sapiens CHEMBL2214887 single protein format
CHEMBL4228542 OBDepict CH 2 N H O N H H N O O N N CH 3 CH 3 H 3 C IC50 = 170.0 nM 519.69 C=CC(=O)NCCCC[C@H](NC(=O)Cc1ccccc1)C(=O)N1CCN(c2cccc(C(C)(C)C)n2)CC1 Homo sapiens CHEMBL4223773 single protein format
CHEMBL2152213 OBDepict CH 2 N H O N S O O N H O Cl IC50 = 170.0 nM 476.0 C=CC(=O)NC1CCN(S(=O)(=O)c2ccc(C(=O)NCCc3cccc(Cl)c3)cc2)CC1 Homo sapiens CHEMBL2155208 single protein format
CHEMBL2086505 OBDepict CH 2 NH O S F F F N O O N O O IC50 = 180.0 nM 497.5 C=CC(=O)Nc1ccc(S(=O)(=O)N2CCN(C(=O)OCc3ccccc3)CC2)c(C(F)(F)F)c1 Homo sapiens CHEMBL2091156 single protein format
CHEMBL2086540 OBDepict H 2 C N H O N S N O O N O IC50 = 180.0 nM 364.43 C=CC(=O)Nc1ccc(S(=O)(=O)N2CCN(C(=O)C3CC3)CC2)cn1 Homo sapiens CHEMBL2091156 single protein format
CHEMBL2152098 OBDepict CH 2 N H O N S O O N H O IC50 = 180.0 nM 441.55 C=CC(=O)NC1CCN(S(=O)(=O)c2ccc(C(=O)NCCc3ccccc3)cc2)CC1 Homo sapiens CHEMBL2155208 single protein format
CHEMBL4227328 OBDepict CH 2 N H O N H H N O O N N Cl IC50 = 180.0 nM 498.03 C=CC(=O)NCCCC[C@H](NC(=O)Cc1ccccc1)C(=O)N1CCN(c2cccc(Cl)n2)CC1 Homo sapiens CHEMBL4223773 single protein format
CHEMBL2086534 OBDepict CH 2 HN O S N O O N IC50 = 180.0 nM 371.46 C=CC(=O)Nc1ccc(S(=O)(=O)N2CCN(c3ccccc3)CC2)cc1 Homo sapiens CHEMBL2091156 single protein format
CHEMBL2152214 OBDepict CH 2 HN O N S O O N H O H 3 C H 3 C IC50 = 180.0 nM 469.61 C=CC(=O)NC1CCN(S(=O)(=O)c2ccc(C(=O)NCCc3ccc(C)c(C)c3)cc2)CC1 Homo sapiens CHEMBL2155208 single protein format
CHEMBL2203452 OBDepict CH 2 N H O N H H N O O CH 3 N N CH 3 IC50 = 190.0 nM 401.51 C=CC(=O)NCCCC[C@H](NC(C)=O)C(=O)N1CCN(c2cccc(C)n2)CC1 Homo sapiens CHEMBL2214887 single protein format
CHEMBL2086535 OBDepict CH 2 HN O S N O O N F F F IC50 = 190.0 nM 439.46 C=CC(=O)Nc1ccc(S(=O)(=O)N2CCN(c3ccccc3C(F)(F)F)CC2)cc1 Homo sapiens CHEMBL2091156 single protein format
CHEMBL2086890 OBDepict H 2 C N H O F S N O O N O O H 3 C H 3 C CH 3 IC50 = 190.0 nM 413.47 C=CC(=O)Nc1ccc(S(=O)(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c(F)c1 Homo sapiens CHEMBL2091156 single protein format
CHEMBL2203450 OBDepict H 2 C N H O N H H N O O N N H 3 C IC50 = 190.0 nM 463.58 C=CC(=O)NCCCC[C@H](NC(=O)c1ccccc1)C(=O)N1CCN(c2cccc(C)n2)CC1 Homo sapiens CHEMBL2214887 single protein format
CHEMBL361560 OBDepict H 2 N NH O S N N S O F CH 3 IC50 = 200.0 nM 418.52 CC1CCCc2sc3nc(SCC(=O)NN)n(-c4cccc(F)c4)c(=O)c3c21 Homo sapiens CHEMBL831130 single protein format
CHEMBL2152201 OBDepict CH 2 HN O N S O O N H O IC50 = 200.0 nM 453.56 C=CC(=O)NC1CCN(S(=O)(=O)c2ccc(C(=O)NC3Cc4ccccc4C3)cc2)CC1 Homo sapiens CHEMBL2155208 single protein format