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TargetAldehyde dehydrogenase, dimeric NADP-preferring
LigandBDBM109210
Substrate/Competitorn/a
Meas. Tech.IC50 Determination
Ki 4.7e+3± 3e+2 nM
IC50 1.6e+4± 5e+2 nM
Citation Parajuli, BGeorgiadis, TMFishel, MLHurley, TD Development of Selective Inhibitors for Human Aldehyde Dehydrogenase 3A1 (ALDH3A1) for the Enhancement of Cyclophosphamide Cytotoxicity. Chembiochem15:701-712 (2014) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Aldehyde dehydrogenase, dimeric NADP-preferring
Name:Aldehyde dehydrogenase, dimeric NADP-preferring
Synonyms:AL3A1_HUMAN | ALDH3 | ALDH3A1 | Aldehyde dehydrogenase 3A1 (ALDH3A1) | Aldehyde dehydrogenase family 3 member A1 (ALDH3A1) | Aldehyde dehydrogenase family 3 member A1 (ALDH3A1) (Q122A)
Type:Protein
Mol. Mass.:50394.38
Organism:Homo sapiens (Human)
Description:n/a
Residue:453
Sequence:
MSKISEAVKRARAAFSSGRTRPLQFRIQQLEALQRLIQEQEQELVGALAADLHKNEWNAY
YEEVVYVLEEIEYMIQKLPEWAADEPVEKTPQTQQDELYIHSEPLGVVLVIGTWNYPFNL
TIQPMVGAIAAGNSVVLKPSELSENMASLLATIIPQYLDKDLYPVINGGVPETTELLKER
FDHILYTGSTGVGKIIMTAAAKHLTPVTLELGGKSPCYVDKNCDLDVACRRIAWGKFMNS
GQTCVAPDYILCDPSIQNQIVEKLKKSLKEFYGEDAKKSRDYGRIISARHFQRVMGLIEG
QKVAYGGTGDAATRYIAPTILTDVDPQSPVMQEEIFGPVLPIVCVRSLEEAIQFINQREK
PLALYMFSSNDKVIKKMIAETSSGGVAANDVIVHITLHSLPFGGVGNSGMGSYHGKKSFE
TFSHRRSCLVRPLMNDEGLKVRYPPSPAKMTQH
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM109210
n/a
NameBDBM109210
Synonyms:CB29
TypeSmall organic molecule
Emp. Form.C15H15N3O5S
Mol. Mass.349.362
SMILESCC(=O)Nc1ccc(Nc2ccc(cc2[N+]([O-])=O)S(C)(=O)=O)cc1
Structure
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