DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Beta-secretase 1
Ligand Name
3-[2-amino-6-(2-methylphenyl)quinolin-3-yl]-N-(3,3-dimethylbutyl)propanamide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
XKCSLMBNFSFIEK-UHFFFAOYSA-N
SMILES
Cc1ccccc1c2ccc3c(c2)cc(c(n3)N)CCC(=O)NCCC(C)(C)C
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 5IE1
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Color Legend
Unassigned regionsLigand / hetero atomse5ie1A1e5ie1A2
ECOD domains from experimental PDB structures interacting with ligand 6BS
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P56817n/a6BS5ie1e5ie1A1A:184-385
P56817n/a6BS5ie1e5ie1A2A:-1-183