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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Bromodomain testis-specific protein [21-137] | ||
| Ligand | BDBM205438 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | AlphaScreen BRD Binding Assay | ||
| pH | 7.5±n/a | ||
| Temperature | 298.15±n/a K | ||
| IC50 | 10±0.0 nM | ||
| Comments | extracted | ||
| Citation |  Tanaka, M; Roberts, JM; Seo, HS; Souza, A; Paulk, J; Scott, TG; DeAngelo, SL; Dhe-Paganon, S; Bradner, JE Design and characterization of bivalent BET inhibitors. Nat Chem Biol12:1089-1096 (2016) [PubMed] Article | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Bromodomain testis-specific protein [21-137] | |||
| Name: | Bromodomain testis-specific protein [21-137] | ||
| Synonyms: | BRDT | BRDT_HUMAN | Bromodomain testis 1 (BRDT(1)) | ||
| Type: | n/a | ||
| Mol. Mass.: | 13934.55 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | Q58F21 (BRDT, 21-137) | ||
| Residue: | 117 | ||
| Sequence: |
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| BDBM205438 | |||
| n/a | |||
| Name | BDBM205438 | ||
| Synonyms: | 6S+IBET-PEG2 (19) | ||
| Type | Small organic molecule | ||
| Emp. Form. | C50H52ClN11O7S | ||
| Mol. Mass. | 986.535 | ||
| SMILES | COc1cc2c3n([C@H](C)c4ccccn4)c(=O)n(CC(=O)NCCOCCOCCNC(=O)C[C@@H]4N=C(c5c(C)c(C)sc5-n5c(C)nnc45)c4ccc(Cl)cc4)c3cnc2cc1-c1c(C)noc1C |r,wD:34.34,7.7,c:36,(31.86,-.67,;30.53,.1,;29.2,.87,;27.86,.1,;26.53,.87,;25.19,.1,;24.72,-1.37,;25.72,-2.3,;27.26,-1.92,;25.28,-3.47,;23.74,-3.47,;22.97,-4.81,;23.74,-6.14,;25.28,-6.14,;26.05,-4.81,;23.18,-1.37,;22.41,-2.7,;22.7,.1,;21.37,.87,;20.28,-.22,;20.72,-2.31,;18.4,-.66,;17.02,.51,;15.69,-.26,;14.6,.83,;13.26,.06,;11.93,.83,;10.6,.06,;9.26,.83,;7.93,.06,;6.84,1.15,;5.75,.06,;5.75,-1.48,;4.66,1.15,;3.33,.38,;2.37,-.83,;.83,-.83,;-.13,.38,;-1.67,.38,;-2.76,-.71,;-2.15,1.84,;-3.48,2.61,;-.9,2.74,;.21,1.88,;1.6,2.54,;1.86,4.1,;.77,5.19,;3.38,4.34,;4.08,2.97,;2.99,1.88,;.06,-2.16,;-1.48,-2.16,;-2.25,-3.5,;-1.48,-4.83,;-2.25,-6.16,;.06,-4.83,;.83,-3.5,;23.86,.87,;23.86,2.41,;25.19,3.18,;26.53,2.41,;27.86,3.18,;29.2,2.41,;30.53,3.18,;31.86,2.41,;31.86,.87,;32.95,3.5,;32.25,4.87,;30.73,4.63,;29.64,5.72,)| | ||
| Structure | 
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