DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Beta-secretase 1
Ligand Name
(5R,7S)-1-(3-fluorophenyl)-3,7-dimethyl-8-[3-(propan-2-yloxy)benzyl]-2-thia-1,3,8-triazaspiro[4.5]decane 2,2-dioxide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
CVPXZTQJPHYLAQ-YADARESESA-N
SMILES
CC1CC2(CCN1Cc3cccc(c3)OC(C)C)CN(S(=O)(=O)N2c4cccc(c4)F)C
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 4FM8
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Color Legend
Unassigned regionsLigand / hetero atomse4fm8A2e4fm8A3
ECOD domains from experimental PDB structures interacting with ligand 0UQ
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P56817n/a0UQ4fm8e4fm8A2A:184-398
P56817n/a0UQ4fm8e4fm8A3A:-1-183