DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Steroid C26-monooxygenase
Ligand Name
ethyl 1-(2-piperidin-4-ylethyl)-5-pyridin-4-yl-indole-2-carboxylate
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
WFSAKSOITHNEMN-UHFFFAOYSA-N
SMILES
CCOC(=O)c1cc2cc(ccc2n1CCC3CCNCC3)c4ccncc4
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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

Structure: 7R1I
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 atomse7r1iA1e7r1iB1e7r1iC1
ECOD domains from experimental PDB structures interacting with ligand HIH
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P9WPP1n/aHIH7r1ie7r1iA1A:18-428
P9WPP1n/aHIH7r1ie7r1iB1B:19-427
P9WPP1n/aHIH7r1ie7r1iC1C:19-427