DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Cytochrome P450 3A4
Ligand Name
tert-butyl [(2S)-1-{[(2R)-1-oxo-3-phenyl-1-{[2-(pyridin-4-yl)ethyl]amino}propan-2-yl]sulfanyl}-3-phenylpropan-2-yl]carbamate
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
JGGRDZOOKJGTKG-RRPNLBNLSA-N
SMILES
CC(C)(C)OC(=O)NC(Cc1ccccc1)CSC(Cc2ccccc2)C(=O)NCCc3ccncc3
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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

Structure: 7UF9
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Color Legend
Unassigned regionsLigand / hetero atomse7uf9A1
ECOD domains from experimental PDB structures interacting with ligand NH0
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P08684n/aNH07uf9e7uf9A1A:27-496