Target
Histone deacetylase 3
Ligand
BDBM50020913
Substrate
n/a
Meas. Tech.
ChEMBL_1364647 (CHEMBL3291780)
IC50
85±n/a nM
Citation
 Chen, FChai, HSu, MBZhang, YMLi, JXie, XNan, FJ Potent and orally efficacious bisthiazole-based histone deacetylase inhibitors. ACS Med Chem Lett 5:628-33 (2014) [PubMed]  Article 
Target
Name:
Histone deacetylase 3
Synonyms:
HD3 | HDAC3 | HDAC3_HUMAN | Histone deacetylase 3 (HDAC3) | Human HDAC3 | RPD3-2 | SMAP45
Type:
Enzyme
Mol. Mass.:
48829.55
Organism:
Homo sapiens (Human)
Description:
O15379
Residue:
428
Sequence:
MAKTVAYFYDPDVGNFHYGAGHPMKPHRLALTHSLVLHYGLYKKMIVFKPYQASQHDMCRFHSEDYIDFLQRVSPTNMQGFTKSLNAFNVGDDCPVFPGLFEFCSRYTGASLQGATQLNNKICDIAINWAGGLHHAKKFEASGFCYVNDIVIGILELLKYHPRVLYIDIDIHHGDGVQEAFYLTDRVMTVSFHKYGNYFFPGTGDMYEVGAESGRYYCLNVPLRDGIDDQSYKHLFQPVINQVVDFYQPTCIVLQCGADSLGCDRLGCFNLSIRGHGECVEYVKSFNIPLLVLGGGGYTVRNVARCWTYETSLLVEEAISEELPYSEYFEYFAPDFTLHPDVSTRIENQNSRQYLDQIRQTIFENLKMLNHAPSVQIHDVPADLLTYDRTDEADAEERGPEENYSRPEAPNEFYDGDHDNDKESDVEI
  
Inhibitor
Name:
BDBM50020913
Synonyms:
CHEMBL3287006
Type:
Small organic molecule
Emp. Form.:
C20H24N4O4S3
Mol. Mass.:
480.624
SMILES:
CC(C)[C@@H]1NC(=O)c2csc(n2)-c2csc(CNC(=O)C[C@H](OC1=O)\C=C\CCS)n2 |r|
Structure:
Search PDB for entries with ligand similarity: