Attributes
UniProt ID
Protein Name
Aldehyde dehydrogenase 1A1
Ligand Name
2,3,5-trimethyl-6-[3-oxo-3-(piperidin-1-yl)propyl]-7H-furo[3,2-g][1]benzopyran-7-one
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
SHGFQSFSJDFZLK-UHFFFAOYSA-N
SMILES
Cc1c(oc2c1cc3c(c2)OC(=O)C(=C3C)CCC(=O)N4CCCCC4)C
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 5L2M
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Color Legend
Unassigned regionsLigand / hetero atomse5l2mA1e5l2mA2