Reaction Details | |||
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Target | Histone deacetylase 1 | ||
Ligand | BDBM50396042 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_861542 (CHEMBL2174390) | ||
IC50 | 700±n/a nM | ||
Citation | Olsen, CA; Montero, A; Leman, LJ; Ghadiri, MR Macrocyclic peptoid-Peptide hybrids as inhibitors of class I histone deacetylases. ACS Med Chem Lett3:749-753 (2012) [PubMed] Article | ||
More Info.: | Get all data from this article, Assay Method | ||
Histone deacetylase 1 | |||
Name: | Histone deacetylase 1 | ||
Synonyms: | Cereblon/Histone deacetylase 1 | HD1 | HDAC1 | HDAC1_HUMAN | Histone deacetylase 1 (HDAC1) | Human HDAC1 | RPD3L1 | ||
Type: | Enzyme | ||
Mol. Mass.: | 55090.27 | ||
Organism: | Homo sapiens (Human) | ||
Description: | Q13547 | ||
Residue: | 482 | ||
Sequence: |
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BDBM50396042 | |||
n/a | |||
Name | BDBM50396042 | ||
Synonyms: | CHEMBL2170017 | ||
Type | Small organic molecule | ||
Emp. Form. | C36H54N8O5 | ||
Mol. Mass. | 678.8646 | ||
SMILES | CCC(=O)CCCCC[C@@H]1NC(=O)[C@H](CCCN=C(N)N)NC(=O)CCN(CC=C(C)C)C(=O)CN(CCc2c[nH]c3ccccc23)C1=O |r,wU:13.13,9.8,(56.09,-30.64,;54.73,-29.9,;53.42,-30.71,;53.46,-32.24,;52.07,-29.97,;50.75,-30.77,;49.4,-30.04,;48.09,-30.84,;46.73,-30.11,;45.52,-31.06,;44.06,-30.63,;43.65,-29.12,;44.6,-27.91,;41.81,-29.09,;40.95,-27.82,;39.42,-27.75,;38.63,-26.44,;37.11,-26.47,;36.31,-25.15,;37.06,-23.76,;34.83,-25.16,;41.35,-30.56,;39.92,-31.09,;38.65,-30.21,;39.92,-32.61,;41.35,-33.06,;41.36,-34.54,;40.03,-35.31,;38.69,-34.53,;37.36,-35.3,;36.03,-34.53,;37.36,-36.84,;42.79,-35.04,;42.82,-36.58,;44,-34.54,;43.97,-33.06,;44.73,-34.39,;44.72,-35.93,;46.05,-36.7,;47.45,-36.09,;48.48,-37.24,;47.7,-38.57,;48.16,-40.02,;47.14,-41.16,;45.63,-40.83,;45.17,-39.37,;46.2,-38.24,;45.59,-32.74,;46.92,-33.78,)| | ||
Structure |