Search and Browse
Download
Enter Data
| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Bromodomain-containing protein 3 | ||
| Ligand | BDBM50380680 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_873615 (CHEMBL2187904) | ||
| IC50 | 200±n/a nM | ||
| Citation |  Seal, J; Lamotte, Y; Donche, F; Bouillot, A; Mirguet, O; Gellibert, F; Nicodeme, E; Krysa, G; Kirilovsky, J; Beinke, S; McCleary, S; Rioja, I; Bamborough, P; Chung, CW; Gordon, L; Lewis, T; Walker, AL; Cutler, L; Lugo, D; Wilson, DM; Witherington, J; Lee, K; Prinjha, RK Identification of a novel series of BET family bromodomain inhibitors: binding mode and profile of I-BET151 (GSK1210151A). Bioorg Med Chem Lett22:2968-72 (2012) [PubMed] Article | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Bromodomain-containing protein 3 | |||
| Name: | Bromodomain-containing protein 3 | ||
| Synonyms: | BRD3 | BRD3_HUMAN | Bromodomain and extra-terminal motif (BET) | Bromodomain-containing protein 3 | Bromodomain-containing protein 3 (BRD3) | KIAA0043 | RING3-like protein | RING3L | ||
| Type: | Protein | ||
| Mol. Mass.: | 79571.81 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | Q15059 | ||
| Residue: | 726 | ||
| Sequence: |
| ||
| BDBM50380680 | |||
| n/a | |||
| Name | BDBM50380680 | ||
| Synonyms: | CHEMBL2017288 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C24H22N4O3 | ||
| Mol. Mass. | 414.4565 | ||
| SMILES | COc1cc2c3n([C@H](C)c4ccccc4)c(=O)[nH]c3cnc2cc1-c1c(C)noc1C |r,wD:7.7,(3.4,-41.04,;3.4,-42.58,;4.73,-43.35,;6.06,-42.58,;7.4,-43.35,;8.72,-42.57,;9.03,-41.07,;8.26,-39.74,;6.72,-39.74,;9.03,-38.41,;10.56,-38.41,;11.34,-37.08,;10.57,-35.74,;9.02,-35.75,;8.25,-37.08,;10.55,-40.9,;11.31,-39.56,;11.19,-42.29,;10.06,-43.33,;10.07,-44.88,;8.73,-45.66,;7.4,-44.89,;6.07,-45.67,;4.73,-44.9,;3.4,-45.67,;3.36,-47.21,;4.59,-48.14,;1.89,-47.65,;1.01,-46.39,;1.94,-45.16,;1.49,-43.69,)| | ||
| Structure | 
| ||