Ligand name: 1-(4-ethylphenyl)propan-1-one
PDB ligand accession: I3E
DrugBank: n/a
PubChem: 583750
ChEMBL: n/a
InChI Key: VGQRIILEZYZAOE-UHFFFAOYSA-N
SMILES: CCc1ccc(cc1)C(=O)CC
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic oxygen compounds
    • Class: Organooxygen compounds
      • Subclass: Carbonyl compounds

List of PDB structures and/or AlphaFold models with target protein P05091

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3SZ9	Download	Experimental	e3sz9A1 e3sz9A2 e3sz9B1 e3sz9B2 e3sz9C1 e3sz9C2 e3sz9D1 e3sz9D2 e3sz9E1 e3sz9E2 e3sz9F1 e3sz9F2 e3sz9G1 e3sz9G2 e3sz9H1 e3sz9H2	ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like	LigPlot