Ligand name: 2-(3-chlorophenoxy)-4-{(1R)-3-methyl-1-[(3S)-3-(5-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)piperidin-1-yl]butyl}benzoic acid
PDB ligand accession: 13Y
DrugBank: n/a
PubChem: 66545764;72200988;
ChEMBL: CHEMBL2179275
InChI Key: DUMBOKZAFBZKLT-XUZZJYLKSA-N
SMILES: CC1=CN(C(=O)NC1=O)C2CCCN(C2)C(CC(C)C)c3ccc(c(c3)Oc4cccc(c4)Cl)C(=O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Benzene and substituted derivatives
      • Subclass: Diphenylethers

List of PDB structures and/or AlphaFold models with target protein P65249

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4HDC	Download	Experimental	e4hdcA1 e4hdcB1	P-loop domains-like P-loop domains-like	LigPlot