Attributes
UniProt ID
Protein Name
Beta-secretase 1
Ligand Name
N-{3-[(5R)-3-amino-2,5-dimethyl-1,1-dioxido-5,6-dihydro-2H-1,2,4-thiadiazin-5-yl]-4-fluorophenyl}-5-fluoropyridine-2-carboxamide
DrugBank ID
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
YHYKUSGACIYRML-KRWDZBQOSA-N
SMILES
CC1(CS(=O)(=O)N(C(=N1)N)C)c2cc(ccc2F)NC(=O)c3ccc(cn3)F
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 5HU1
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Color Legend
Unassigned regionsLigand / hetero atomse5hu1A1e5hu1A2e5hu1B1e5hu1B2
ECOD domains from experimental PDB structures interacting with ligand DB12285