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Q58F21 | BRDT_HUMAN | Bromodomain testis-specific protein (BRDT)

3D structures mapped by conservation among orthologs

[ Domain: "Bromodomain" // Bromodomain ]

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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
CHEMBL4208129 OBDepict H N O N N H 3 C N S O O CH 3 Ki = 0.69 nM 420.49 Cn1cc2c3c(c[nH]c3c1=O)CN(c1ccccn1)c1ccc(CS(C)(=O)=O)cc1-2 Homo sapiens CHEMBL4194908 single protein format
CHEMBL3987016 OBDepict CH 3 S N H O O O N H 3 C N F O H F Ki = 2.2 nM 459.47 CCS(=O)(=O)Nc1ccc(Oc2ccc(F)cc2F)c(-c2cn(C)c(=O)c3[nH]ccc23)c1 Homo sapiens CHEMBL4020259 single protein format
CHEMBL4780530 OBDepict Cl N H CH 3 N N N CH 3 N H 2 N IC50 = 3.0 nM 416.92 Cc1nnc2n1-c1ccc(-c3ccc(N)nc3)cc1N(c1ccc(Cl)cc1)C[C@H]2C Homo sapiens CHEMBL4716999 single protein format
CHEMBL4217457 OBDepict F F N N H N O S H 3 C O O CH 3 Ki = 4.2 nM 455.49 Cn1cc2c3c(c[nH]c3c1=O)CN(c1ccc(F)cc1F)c1ccc(CS(C)(=O)=O)cc1-2 Homo sapiens CHEMBL4194908 single protein format
CHEMBL4215988 OBDepict F N N CH 3 N O S H O O CH 3 Ki = 5.9 nM 437.5 Cn1cc2c3c(c[nH]c(=O)c31)-c1cc(CS(C)(=O)=O)ccc1N(c1ccc(F)cc1)C2 Homo sapiens CHEMBL4194908 single protein format
CHEMBL3895413 OBDepict CH 3 O N H 3 C N H N O H NH 2 IC50 = 14.0 nM 402.5 Cc1noc(C)c1-c1ccc2c(c1)C(c1ccccc1)(N1CCC[C@H](N)C1)C(=O)N2 Homo sapiens CHEMBL3888745 single protein format
CHEMBL3903717 OBDepict CH 3 O N H 3 C N H N O H OH IC50 = 23.0 nM 403.48 Cc1noc(C)c1-c1ccc2c(c1)C(c1ccccc1)(N1CCC[C@H](O)C1)C(=O)N2 Homo sapiens CHEMBL3888745 single protein format
CHEMBL3895277 OBDepict H 3 C O N CH 3 N H OH O S IC50 = 31.0 nM 326.38 Cc1noc(C)c1-c1ccc2c(c1)C(O)(c1ccsc1)C(=O)N2 Homo sapiens CHEMBL3888745 single protein format
CHEMBL3910409 OBDepict H 3 C O N CH 3 N H HN O HO CH 3 H IC50 = 42.0 nM 383.49 Cc1noc(C)c1-c1ccc2c(c1)C(NC[C@@H](C)O)(C1CCCCC1)C(=O)N2 Homo sapiens CHEMBL3888745 single protein format
CHEMBL3929288 OBDepict O OH O N H H 3 C N CH 3 O IC50 = 58.0 nM 340.38 Cc1noc(C)c1-c1ccc2c(c1)C(O)(C1CCCCC1=O)C(=O)N2 Homo sapiens CHEMBL3888745 single protein format
CHEMBL3910920 OBDepict HO NH CH 3 H O N H CH 3 N CH 3 O IC50 = 69.0 nM 377.44 Cc1noc(C)c1-c1ccc2c(c1)C(N[C@H](C)CO)(c1ccccc1)C(=O)N2 Homo sapiens CHEMBL3888745 single protein format
CHEMBL3955162 OBDepict H 3 C O N CH 3 N H NH 2 O IC50 = 95.0 nM 319.36 Cc1noc(C)c1-c1ccc2c(c1)C(N)(c1ccccc1)C(=O)N2 Homo sapiens CHEMBL3888745 single protein format
CHEMBL4207437 OBDepict CH 3 N NH O O HN N N N N CH 3 H H 3 C O IC50 = 102.0 nM 561.73 C[C@@H]1C(=O)N(C)c2cnc(Nc3ccc(C(=O)NC4CCN(C)CC4)cc3OC3CCCC3)nc2N1C1CCCC1 Homo sapiens CHEMBL4200426 single protein format
CHEMBL4063051 OBDepict O H 3 C N H O NH S O O H 3 C Ki = 110.0 nM 410.5 Cc1[nH]c(-c2cc(NS(C)(=O)=O)ccc2Oc2ccccc2)c2c1C(=O)CCC2 Homo sapiens CHEMBL4038426 single protein format
CHEMBL2132936 OBDepict O O CH 3 CH 3 H 3 C N N N N CH 3 S H 3 C CH 3 Cl IC50 = 110.0 nM 457.0 Cc1sc2c(c1C)C(c1ccc(Cl)cc1)=NC(CC(=O)OC(C)(C)C)c1nnc(C)n1-2 Homo sapiens CHEMBL3877182 assay format
CHEMBL3786012 OBDepict F F O N S H O O H 3 C H 3 C HN O Ki = 140.0 nM 432.45 Cc1[nH]c(-c2cc(S(C)(=O)=O)ccc2Oc2ccc(F)cc2F)c2c1C(=O)NCC2 Homo sapiens CHEMBL4038426 single protein format
CHEMBL1957266 OBDepict O O H N H 3 C CH 3 H 3 C N N N CH 3 S H 3 C CH 3 Cl IC50 = 183.0 nM 457.0 Cc1sc2c(c1C)C(c1ccc(Cl)cc1)=N[C@@H](CC(=O)OC(C)(C)C)c1nnc(C)n1-2 Homo sapiens CHEMBL4153124 single protein format
CHEMBL4103140 OBDepict CH 3 O N O N H N O N H 3 C O H CH 3 Ki = 200.0 nM 472.55 CCn1c2c(c(=O)[nH]c1=O)C(c1ccc(C)cc1)C1=C(CN(CCc3ccc(OC)cc3)C1=O)N2 Homo sapiens CHEMBL4016221 assay format
CHEMBL4085204 OBDepict H 3 C N N H O N H O N O CH 3 OH Ki = 200.0 nM 458.52 CCn1c2c(c(=O)[nH]c1=O)C(c1ccc(C)cc1)C1=C(CN(CCc3ccc(O)cc3)C1=O)N2 Homo sapiens CHEMBL4016221 assay format
CHEMBL4092949 OBDepict H 3 C N N H O N H O N O CH 3 Ki = 220.0 nM 442.52 CCn1c2c(c(=O)[nH]c1=O)C(c1ccc(C)cc1)C1=C(CN(CCc3ccccc3)C1=O)N2 Homo sapiens CHEMBL4016221 assay format
CHEMBL4216875 OBDepict CH 3 O N H HN O N N N N N H 3 C H H 3 C CH 3 O IC50 = 229.0 nM 507.64 COc1cc(C(=O)NC2CCN(C)CC2)ccc1Nc1ncc2c(n1)N(C1CCCC1)[C@@H](C)C(=O)N2C Homo sapiens CHEMBL4200426 single protein format
CHEMBL1995703 OBDepict CH 3 N N N H N N N H H 3 C S NH O O H 3 C CH 3 H 3 C IC50 = 230.0 nM 509.68 Cc1cnc(Nc2ccc(N3CCN(C)CC3)cc2)nc1Nc1cccc(S(=O)(=O)NC(C)(C)C)c1 Homo sapiens CHEMBL3877182 assay format
CHEMBL4065286 OBDepict CH 3 N NH O N H O N O H 3 C Ki = 230.0 nM 428.49 CCn1c2c(c(=O)[nH]c1=O)C(c1ccc(C)cc1)C1=C(CN(Cc3ccccc3)C1=O)N2 Homo sapiens CHEMBL4016221 assay format
CHEMBL4206381 OBDepict CH 3 N NH O O HN N N N N CH 3 H H 3 C O IC50 = 245.0 nM 561.73 C[C@H]1C(=O)N(C)c2cnc(Nc3ccc(C(=O)NC4CCN(C)CC4)cc3OC3CCCC3)nc2N1C1CCCC1 Homo sapiens CHEMBL4200426 single protein format
CHEMBL513909 OBDepict CH 3 H N O N N CH 3 N N H O H 3 C HN O N CH 3 IC50 = 260.0 nM 521.67 CC[C@@H]1C(=O)N(C)c2cnc(Nc3ccc(C(=O)NC4CCN(C)CC4)cc3OC)nc2N1C1CCCC1 Homo sapiens CHEMBL3877182 assay format
CHEMBL4216442 OBDepict CH 3 O N H HN O N N N N N H 3 C H H 3 C CH 3 O IC50 = 289.0 nM 503.61 COc1cc(C(=O)NC2=CCN(C)C=C2)ccc1Nc1ncc2c(n1)N(C1CCCC1)[C@H](C)C(=O)N2C Homo sapiens CHEMBL4200426 single protein format
CHEMBL1287853 OBDepict H 3 C N NH N N H S NH O O H 3 C H 3 C CH 3 O N IC50 = 340.0 nM 524.69 Cc1cnc(Nc2ccc(OCCN3CCCC3)cc2)nc1Nc1cccc(S(=O)(=O)NC(C)(C)C)c1 Homo sapiens CHEMBL3877182 assay format
CHEMBL4209902 OBDepict CH 3 O N H HN O N N N N N H 3 C H H 3 C CH 3 O IC50 = 342.0 nM 507.64 COc1cc(C(=O)NC2CCN(C)CC2)ccc1Nc1ncc2c(n1)N(C1CCCC1)[C@H](C)C(=O)N2C Homo sapiens CHEMBL4200426 single protein format
CHEMBL4446421 OBDepict CH 3 O S N H O O N N N H 3 C O N CH 3 IC50 = 357.1 nM 449.49 COc1ccccc1S(=O)(=O)Nc1ccc2c3c(cc(-n4cnc(C)c4)nc13)C(=O)N2C Homo sapiens CHEMBL4357131 single protein format
CHEMBL4202678 OBDepict H 3 C O N H N O N N N N CH 3 H CH 3 O IC50 = 369.0 nM 478.6 COc1cc(C(=O)N2CCCCC2)ccc1Nc1ncc2c(n1)N(C1CCCC1)[C@H](C)C(=O)N2C Homo sapiens CHEMBL4200426 single protein format
CHEMBL4210414 OBDepict H 3 C O N H NH O N N N N CH 3 H CH 3 O IC50 = 378.0 nM 492.62 COc1cc(C(=O)NC2CCCCC2)ccc1Nc1ncc2c(n1)N(C1CCCC1)[C@H](C)C(=O)N2C Homo sapiens CHEMBL4200426 single protein format
CHEMBL4210571 OBDepict CH 3 O N H HN O N N N N N CH 3 CH 3 H 3 C H H 3 C O IC50 = 392.0 nM 481.6 COc1cc(C(=O)NCCN(C)C)ccc1Nc1ncc2c(n1)N(C1CCCC1)[C@H](C)C(=O)N2C Homo sapiens CHEMBL4200426 single protein format
CHEMBL4088466 OBDepict F F O S N O O H 3 C H 3 C N O H Ki = 490.0 nM 430.43 Cn1cc(-c2cc(S(C)(=O)=O)ccc2Oc2ccc(F)cc2F)c2cc[nH]c(=O)c21 Homo sapiens CHEMBL4038426 single protein format
CHEMBL3963603 OBDepict H 3 C O N CH 3 N H OH O O IC50 = 510.0 nM 328.37 Cc1noc(C)c1-c1ccc2c(c1)C(O)(C1CCOCC1)C(=O)N2 Homo sapiens CHEMBL3888745 single protein format
CHEMBL4065286 OBDepict CH 3 N NH O N H O N O H 3 C IC50 = 550.0 nM 428.49 CCn1c2c(c(=O)[nH]c1=O)C(c1ccc(C)cc1)C1=C(CN(Cc3ccccc3)C1=O)N2 Homo sapiens CHEMBL4016221 assay format
CHEMBL4203571 OBDepict CH 3 O N H HN O N N N N H 3 C H H 3 C O IC50 = 558.0 nM 514.63 COc1cc(C(=O)NCCc2ccccc2)ccc1Nc1ncc2c(n1)N(C1CCCC1)[C@H](C)C(=O)N2C Homo sapiens CHEMBL4200426 single protein format
CHEMBL4213276 OBDepict H 3 C O N H NH O N N N N HN CH 3 H CH 3 O IC50 = 560.0 nM 493.61 COc1cc(C(=O)NC2CCNCC2)ccc1Nc1ncc2c(n1)N(C1CCCC1)[C@H](C)C(=O)N2C Homo sapiens CHEMBL4200426 single protein format
CHEMBL4104179 OBDepict H 3 C N HN O N H O O O CH 3 Ki = 690.0 nM 339.35 CCn1c2c(c(=O)[nH]c1=O)C(c1ccc(C)cc1)C1=C(COC1=O)N2 Homo sapiens CHEMBL4016221 assay format
CHEMBL2393130 OBDepict HO O H 3 C CH 3 N N H O O O CH 3 CH 3 IC50 = 708.0 nM 370.41 COc1cc(OC)c2c(=O)[nH]c(-c3cc(C)c(OCCO)c(C)c3)nc2c1 Homo sapiens CHEMBL4153125 single protein format
CHEMBL4202820 OBDepict CH 3 O NH N H O N N N N N H 3 C H CH 3 H 3 C O IC50 = 750.0 nM 521.67 COc1cc(C(=O)NC2CCN(C)CC2)ccc1Nc1ncc2c(n1)N(C1CCCCC1)[C@H](C)C(=O)N2C Homo sapiens CHEMBL4200426 single protein format
CHEMBL4085204 OBDepict H 3 C N N H O N H O N O CH 3 OH IC50 = 760.0 nM 458.52 CCn1c2c(c(=O)[nH]c1=O)C(c1ccc(C)cc1)C1=C(CN(CCc3ccc(O)cc3)C1=O)N2 Homo sapiens CHEMBL4016221 assay format
CHEMBL4072799 OBDepict CH 3 O O HN N O N H O F F F Ki = 850.0 nM 393.32 Cc1ccc(C2C3=C(COC3=O)Nc3c2c(=O)[nH]c(=O)n3CC(F)(F)F)cc1 Homo sapiens CHEMBL4016221 assay format
CHEMBL4297454 OBDepict CH 3 N H O N H O N CH 3 O HO CH 3 CH 3 CH 3 CH 3 F Ki = 917.0 nM 491.56 CCNC(=O)c1cc2c(-c3cc(C(C)(C)O)ccc3Oc3c(C)cc(F)cc3C)cn(C)c(=O)c2[nH]1 Homo sapiens CHEMBL4346374 single protein format
CHEMBL4212346 OBDepict CH 3 O O O HN N N N N CH 3 H CH 3 O IC50 = 933.0 nM 479.58 COC(=O)c1ccc(Nc2ncc3c(n2)N(C2CCCC2)[C@H](C)C(=O)N3C)c(OC2CCCC2)c1 Homo sapiens CHEMBL4200426 single protein format
CHEMBL4206052 OBDepict H 3 C O N H NH O N N N N N CH 3 H 3 C CH 3 H CH 3 H 3 C O IC50 = 978.0 nM 481.6 COc1cc(C(=O)NC2CCN(C)CC2)ccc1Nc1ncc2c(n1)N(C(C)C)[C@H](C)C(=O)N2C Homo sapiens CHEMBL4200426 single protein format
CHEMBL4103140 OBDepict CH 3 O N O N H N O N H 3 C O H CH 3 IC50 = 1000.0 nM 472.55 CCn1c2c(c(=O)[nH]c1=O)C(c1ccc(C)cc1)C1=C(CN(CCc3ccc(OC)cc3)C1=O)N2 Homo sapiens CHEMBL4016221 assay format
CHEMBL4092949 OBDepict H 3 C N N H O N H O N O CH 3 IC50 = 1000.0 nM 442.52 CCn1c2c(c(=O)[nH]c1=O)C(c1ccc(C)cc1)C1=C(CN(CCc3ccccc3)C1=O)N2 Homo sapiens CHEMBL4016221 assay format