DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Cathepsin S
Ligand Name
(3R,4S)-4-[(4-fluorobenzoyl)amino]-6-[4-(oxetan-3-yl)piperazin-1-yl]-3,4-dihydro-2H-chromen-3-yl methylcarbamate
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
NDEBZCZEAVMSQF-GOTSBHOMSA-N
SMILES
CNC(=O)OC1COc2ccc(cc2C1NC(=O)c3ccc(cc3)F)N4CCN(CC4)C5COC5
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

Interactive Mol* view for the current protein-molecule pair.

Structure: 4P6G
Hover over the Mol* viewer to rotate or zoom with the mouse. Move the cursor out of the viewer to go back to normal page scrolling and one-click navigation.
Hover inside the viewer to rotate or zoom. Move out to scroll the page or click links normally.
Color Legend
Unassigned regionsLigand / hetero atomse4p6gA1e4p6gB1e4p6gC1e4p6gD1
ECOD domains from experimental PDB structures interacting with ligand 2FZ
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P25774n/a2FZ4p6ge4p6gA1A:0-218
P25774n/a2FZ4p6ge4p6gB1B:0-218
P25774n/a2FZ4p6ge4p6gC1C:1-218
P25774n/a2FZ4p6ge4p6gD1D:0-218