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Attributes

UniProt ID
Protein Name
Beta-secretase 1
Ligand Name
(2R)-2-cyclopropyl-5-methyl-2-[3-(5-prop-1-yn-1-ylpyridin-3-yl)phenyl]-2H-imidazol-4-amine
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
TWHSRVVFCICXII-OAQYLSRUSA-N
SMILES
CC#Cc1cc(cnc1)c2cccc(c2)C3(N=C(C(=N3)N)C)C4CC4
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 4B1C
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Color Legend
Unassigned regionsLigand / hetero atomse4b1cA2e4b1cA3
ECOD domains from experimental PDB structures interacting with ligand 1B1
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P56817n/a1B14b1ce4b1cA2A:184-385