DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Cathepsin S
Ligand Name
(E)-1-(6-{4-[3-(4-methylpiperazin-1-yl)propoxy]-3-(trifluoromethyl)phenyl}pyridin-2-yl)methanimine
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
BNDJQLLXZUKTHM-MFKUBSTISA-N
SMILES
CN1CCN(CC1)CCCOc2ccc(cc2C(F)(F)F)c3cccc(n3)C=N
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 3N3G
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Color Legend
Unassigned regionsLigand / hetero atomse3n3gA1e3n3gB1
ECOD domains from experimental PDB structures interacting with ligand 935
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P25774n/a9353n3ge3n3gA1A:1-217
P25774n/a9353n3ge3n3gB1B:1-217