Attributes
UniProt ID
Protein Name
Beta-secretase 1
Ligand Name
5-{(1R)-3-amino-4-fluoro-1-[3-(5-prop-1-yn-1-ylpyridin-3-yl)phenyl]-1H-isoindol-1-yl}-1-ethyl-3-methylpyridin-2(1H)-one
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
TUGLMYZSOPKJOA-PMERELPUSA-N
SMILES
CCN1C=C(C=C(C1=O)C)C2(c3cccc(c3C(=N2)N)F)c4cccc(c4)c5cc(cnc5)C#CC
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 4B00
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Color Legend
Unassigned regionsLigand / hetero atomse4b00A2e4b00A3