Reaction Details Report a problem with these data
Target
Histone deacetylase 3
Ligand
BDBM414893
Substrate
n/a
Meas. Tech.
Enzyme Inhibition
IC50
<1000±n/a nM
Citation
 Jacques, V; Rusche, JR HDAC inhibitors US Patent  US10428028 Publication Date 10/1/2019 
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:
BDBM414893
Synonyms:
US10428028, Coding A9
Type:
Small organic molecule
Emp. Form.:
C21H16F2N4O
Mol. Mass.:
378.3747
SMILES:
Nc1ccccc1NC(=O)c1ccc2n(Cc3ccc(F)c(F)c3)ncc2c1
Structure:
Search PDB for entries with ligand similarity: