Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetAldehyde dehydrogenase 1A1
LigandBDBM50466622
Substrate/Competitorn/a
Meas. Tech.ChEMBL_1793467 (CHEMBL4265386)
Ki 194±n/a nM
Citation Harper, ARLe, ATMather, TBurgett, ABerry, WSummers, JA Design, synthesis, and ex vivo evaluation of a selective inhibitor for retinaldehyde dehydrogenase enzymes. Bioorg Med Chem26:5766-5779 (2018) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Aldehyde dehydrogenase 1A1
Name:Aldehyde dehydrogenase 1A1
Synonyms:1.2.1.- | 1.2.1.36 | AL1A1_CHICK | ALDH1A1 | Aldehyde dehydrogenase, cytosolic | RALDH 1 | RalDH1 | Retinal dehydrogenase 1
Type:PROTEIN
Mol. Mass.:55813.22
Organism:Gallus gallus
Description:ChEMBL_117982
Residue:509
Sequence:
MKKQGSPSNPAPVLPALPEPLKDLKIKYTKIFINNEWHDSVSGKKFEVFNPANEEKICEV
AEGDKADIDKAVKAARKAFELGSPWRTMDASERGRLLNKLADLVERDRLTLATMEAIDGG
KLFSTAYLMDLGACIKTIRYCAGWADKIHGRTVPMDGNFFTFTRHEPVGVCGQIIPWNFP
LVMFIWKIAPALCCGNTVVVKPAEQTPLSALYMGSLIKEAGFPPGVVNIVPGFGPTAGAA
ISHHMDIDKVSFTGSTEVGKLIKEAAGKTNLKRVTLELGGKSPNIIFADADLDEAAEFAH
IGLFYHQGQCCIAGSRIFVEEPIYDEFVRRSIERAKKYTLGDPLLPGVQQGPQIDKEQFQ
KILDLIESGKKEGAKLECGGGPWGNKGYFIQPTVFSNVTDDMRIAKEEIFGPVQQIMKFK
TIDEVIKRANNTTYGLAAAVFTKDIDKALTFASALQAGTVWVNCYSAFSAQCPFGGFKMS
GNGRELGEYGLQEYTEVKTVTIKIPQKNS
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50466622
n/a
NameBDBM50466622
Synonyms:CHEMBL4286209
TypeSmall organic molecule
Emp. Form.C21H28Cl2O
Mol. Mass.367.352
SMILESC\C(\C=C\C1=C(C)CCCC1(C)C)=C/C=C/C(/C)=C/C(=O)C(Cl)Cl |c:4|
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: