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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Bromodomain-containing protein 4 [353-454] | ||
| Ligand | BDBM318618 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | BRD4 AlphaScreen Assay | ||
| IC50 | <100±n/a nM | ||
| Citation |  Combs, AP; Sparks, RB; Maduskuie, Jr., TP; Rodgers, JD Tricyclic heterocycles as BET protein inhibitors US Patent US11498926 Publication Date 11/15/2022 | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Bromodomain-containing protein 4 [353-454] | |||
| Name: | Bromodomain-containing protein 4 [353-454] | ||
| Synonyms: | BRD4 | BRD4-2 | BRD4_HUMAN | Bromodomain-containing protein 4 (BD2, aa 353-454) | HUNK1 | ||
| Type: | Enzyme Catalytic Domain | ||
| Mol. Mass.: | 11972.81 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | O60885[353-454] | ||
| Residue: | 102 | ||
| Sequence: |
| ||
| BDBM318618 | |||
| n/a | |||
| Name | BDBM318618 | ||
| Synonyms: | (3R)-1-[7-(3,5-Dimethylisoxazol-4-yl)-4-pyridin-3-yl-4,5-dihydroimidazo[1,5,4-de][1,4]benzoxazin-2-yl]pyrrolidin-3-ol | US11498926, Example 159E | US9624241, Example 159A | ||
| Type | Small organic molecule | ||
| Emp. Form. | C23H23N5O3 | ||
| Mol. Mass. | 417.4604 | ||
| SMILES | Cc1noc(C)c1-c1ccc2nc(N3CC[C@@H](O)C3)n3C(COc1c23)c1cccnc1 |r,wU:16.17,(-1.8,-6.16,;-3.14,-5.39,;-4.6,-5.87,;-5.51,-4.62,;-4.6,-3.37,;-5.37,-2.04,;-3.14,-3.85,;-1.8,-3.08,;-.47,-3.85,;.86,-3.08,;.86,-1.54,;2.2,-.77,;1.39,.87,;2.16,2.21,;1.68,3.67,;2.93,4.58,;4.17,3.67,;5.51,4.44,;3.7,2.21,;-.47,.77,;-1.8,1.54,;-3.14,.77,;-3.14,-.77,;-1.8,-1.54,;-.47,-.77,;-1.8,3.08,;-3.14,3.85,;-3.14,5.39,;-1.8,6.16,;-.47,5.39,;-.47,3.85,)| | ||
| Structure | 
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