Ligand name: N-phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide
PDB ligand accession: 7V7
DrugBank: DB00813
PubChem: 3345
ChEMBL: CHEMBL596
InChI Key: PJMPHNIQZUBGLI-UHFFFAOYSA-N
SMILES: CCC(=O)N(c1ccccc1)C2CCN(CC2)CCc3ccccc3

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Piperidines
      • Subclass: Fentanyls

List of proteins that are targets for DB00813

#	DrugDomain Data	UniProt Accession	Drug Action	Affinity data
1	P18429_7V7	P18429	n/a
2	P41143_7V7	P41143	agonist	Ki(nM) = 152.7 IC50(nM) = 187.0
3	P08183_7V7	P08183	n/a	IC50(nM) = 6500.0
4	P35372_7V7	P35372	agonist	Ki(nM) = 0.051 IC50(nM) = 1.3 EC50(nM) = 0.51
5	P41145_7V7	P41145	agonist	Ki(nM) = 84.8 IC50(nM) = 1580.0