DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Genome polyprotein
Ligand Name
N-(4-bromo-2-{[(3R,5S)-3,5-dimethylpiperidin-1-yl]carbonyl}phenyl)-4-morpholin-4-yl-4-oxobutanamide
DrugBank ID
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
DELARNBPJXTDBD-IYBDPMFKSA-N
SMILES
CC1CC(CN(C1)C(=O)c2cc(ccc2NC(=O)CCC(=O)N3CCOCC3)Br)C
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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

Structure: 3CJ5
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 atomse3cj5A1e3cj5A2e3cj5B1e3cj5B2
ECOD domains from experimental PDB structures interacting with ligand DB08582
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P26663DB08582SX63cj5e3cj5A1A:353-563
P26663DB08582SX63cj5e3cj5B1B:353-564