Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetAldehyde dehydrogenase family 1 member A3
LigandBDBM50236899
Substrate/Competitorn/a
Meas. Tech.ChEMBL_1659729 (CHEMBL4009341)
IC50 400±n/a nM
Citation Buchman, CDHurley, TD Inhibition of the Aldehyde Dehydrogenase 1/2 Family by Psoralen and Coumarin Derivatives. J Med Chem60:2439-2455 (2017) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Aldehyde dehydrogenase family 1 member A3
Name:Aldehyde dehydrogenase family 1 member A3
Synonyms:AL1A3_HUMAN | ALDH1A3 | ALDH6 | Aldehyde dehydrogenase 6 | Aldehyde dehydrogenase family 1 member A3 | RALDH-3 | RalDH3 | Retinaldehyde dehydrogenase 3
Type:PROTEIN
Mol. Mass.:56110.85
Organism:Homo sapiens (Human)
Description:ChEMBL_109700
Residue:512
Sequence:
MATANGAVENGQPDRKPPALPRPIRNLEVKFTKIFINNEWHESKSGKKFATCNPSTREQI
CEVEEGDKPDVDKAVEAAQVAFQRGSPWRRLDALSRGRLLHQLADLVERDRATLAALETM
DTGKPFLHAFFIDLEGCIRTLRYFAGWADKIQGKTIPTDDNVVCFTRHEPIGVCGAITPW
NFPLLMLVWKLAPALCCGNTMVLKPAEQTPLTALYLGSLIKEAGFPPGVVNIVPGFGPTV
GAAISSHPQINKIAFTGSTEVGKLVKEAASRSNLKRVTLELGGKNPCIVCADADLDLAVE
CAHQGVFFNQGQCCTAASRVFVEEQVYSEFVRRSVEYAKKRPVGDPFDVKTEQGPQIDQK
QFDKILELIESGKKEGAKLECGGSAMEDKGLFIKPTVFSEVTDNMRIAKEEIFGPVQPIL
KFKSIEEVIKRANSTDYGLTAAVFTKNLDKALKLASALESGTVWINCYNALYAQAPFGGF
KMSGNGRELGEYALAEYTEVKTVTIKLGDKNP
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50236899
n/a
NameBDBM50236899
Synonyms:CHEMBL4099822
TypeSmall organic molecule
Emp. Form.C17H18O3
Mol. Mass.270.323
SMILESCCCc1c(C)c2cc3c(C)c(C)oc3cc2oc1=O
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: