Attributes
UniProt ID
Protein Name
Beta-secretase 1
Ligand Name
4-(4-{1-[(6-aminopyridin-2-yl)methyl]-5-(2-chlorophenyl)-1H-pyrrol-2-yl}phenoxy)butanenitrile
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
CERJQPWNRISSQS-UHFFFAOYSA-N
SMILES
c1ccc(c(c1)c2ccc(n2Cc3cccc(n3)N)c4ccc(cc4)OCCCC#N)Cl
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 3L3A
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Color Legend
Unassigned regionsLigand / hetero atomse3l3aA2e3l3aA3