Reaction Details Report a problem with these data
Target
Histone deacetylase 1
Ligand
BDBM50248807
Substrate
n/a
Meas. Tech.
ChEMBL_1679367 (CHEMBL4029644)
IC50
870±n/a nM
Citation
 Abdizadeh, T; Kalani, MR; Abnous, K; Tayarani-Najaran, Z; Khashyarmanesh, BZ; Abdizadeh, R; Ghodsi, R; Hadizadeh, F Design, synthesis and biological evaluation of novel coumarin-based benzamides as potent histone deacetylase inhibitors and anticancer agents. Eur J Med Chem 132:42-62 (2017) [PubMed]  Article 
Target
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:
MAQTQGTRRKVCYYYDGDVGNYYYGQGHPMKPHRIRMTHNLLLNYGLYRKMEIYRPHKANAEEMTKYHSDDYIKFLRSIRPDNMSEYSKQMQRFNVGEDCPVFDGLFEFCQLSTGGSVASAVKLNKQQTDIAVNWAGGLHHAKKSEASGFCYVNDIVLAILELLKYHQRVLYIDIDIHHGDGVEEAFYTTDRVMTVSFHKYGEYFPGTGDLRDIGAGKGKYYAVNYPLRDGIDDESYEAIFKPVMSKVMEMFQPSAVVLQCGSDSLSGDRLGCFNLTIKGHAKCVEFVKSFNLPMLMLGGGGYTIRNVARCWTYETAVALDTEIPNELPYNDYFEYFGPDFKLHISPSNMTNQNTNEYLEKIKQRLFENLRMLPHAPGVQMQAIPEDAIPEESGDEDEDDPDKRISICSSDKRIACEEEFSDSEEEGEGGRKNSSNFKKAKRVKTEDEKEKDPEEKKEVTEEEKTKEEKPEAKGVKEEVKLA
  
Inhibitor
Name:
BDBM50248807
Synonyms:
CHEMBL4087376
Type:
Small organic molecule
Emp. Form.:
C27H25N3O5
Mol. Mass.:
471.5045
SMILES:
CCCOc1ccc2cc(C(=O)NCc3ccc(cc3)C(=O)Nc3ccccc3N)c(=O)oc2c1
Structure:
Search PDB for entries with ligand similarity: