Reaction Details Report a problem with these data
Target
Histone deacetylase 3
Ligand
BDBM50581290
Substrate
n/a
Meas. Tech.
ChEMBL_2150397 (CHEMBL5034859)
IC50
70±n/a nM
Citation
 Nardella, F; Halby, L; Dobrescu, I; Viluma, J; Bon, C; Claes, A; Cadet-Daniel, V; Tafit, A; Roesch, C; Hammam, E; Erdmann, D; Mairet-Khedim, M; Peronet, R; Mecheri, S; Witkowski, B; Scherf, A; Arimondo, PB Procainamide-SAHA Fused Inhibitors of hHDAC6 Tackle Multidrug-Resistant Malaria Parasites. J Med Chem 64:10403-10417 (2021) [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:
BDBM50581290
Synonyms:
CHEMBL5093179
Type:
Small organic molecule
Emp. Form.:
C21H34N4O4
Mol. Mass.:
406.5191
SMILES:
CCN(CC)CCNC(=O)c1ccc(NC(=O)CCCCCCC(=O)NO)cc1
Structure:
Search PDB for entries with ligand similarity: