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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Bromodomain-containing protein 4 [342-460] | ||
| Ligand | BDBM362671 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | BRD4 AlphaScreen Assay | ||
| IC50 | <25±n/a nM | ||
| Citation |  Combs, AP; Sparks, RB Tricyclic heterocycles as BET protein inhibitors US Patent US10618910 Publication Date 4/14/2020 | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Bromodomain-containing protein 4 [342-460] | |||
| Name: | Bromodomain-containing protein 4 [342-460] | ||
| Synonyms: | BRD4 | BRD4-BD2 (aa 342-460) | BRD4_HUMAN | Bromodomain containing 4 (aa 342-460) | Bromodomain-containing protein 4 (BRD4)(BD2) | HUNK1 | ||
| Type: | Enzyme Catalytic Domain | ||
| Mol. Mass.: | 13783.81 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | a.a. 342-460 (BRD4-BD2) | ||
| Residue: | 119 | ||
| Sequence: |
| ||
| BDBM362671 | |||
| n/a | |||
| Name | BDBM362671 | ||
| Synonyms: | (4S)-7-(3,5-dimethylisoxazol-4-yl)-2-[4- (2,2-dimethylpropanoyl)piperazin-1-yl]-4- pyridin-2-yl-4,5-dihydroimidazo[1,5,4- de][1,4]benzoxazine | US10227359, Example 26 | US10618910, Example 26 | US9834565, Example 26 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C28H32N6O3 | ||
| Mol. Mass. | 500.5921 | ||
| SMILES | Cc1noc(C)c1-c1ccc2nc(N3CCN(CC3)C(=O)C(C)(C)C)n3[C@H](COc1c23)c1ccccn1 |wD:26.35,(.07,-5.61,;1.53,-6.08,;2.01,-7.55,;3.55,-7.55,;4.02,-6.08,;5.49,-5.61,;2.78,-5.18,;2.78,-3.64,;4.11,-2.87,;4.11,-1.33,;2.78,-.56,;2.21,.88,;.67,.88,;-.1,2.21,;-1.64,2.21,;-2.41,3.55,;-1.64,4.88,;-.1,4.88,;.67,3.55,;-2.41,6.21,;-1.64,7.55,;-3.95,6.21,;-4.72,4.88,;-5.49,6.21,;-4.72,7.55,;.11,-.56,;-1.22,-1.33,;-1.22,-2.87,;.11,-3.64,;1.44,-2.87,;1.44,-1.33,;-2.56,-.56,;-3.89,-1.33,;-5.22,-.56,;-5.22,.98,;-3.89,1.75,;-2.56,.98,)| | ||
| Structure | 
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