Ligand name: 2-(3-chlorophenoxy)-3-fluoro-4-{[(3S)-3-(5-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)piperidin-1-yl]methyl}benzoic acid
PDB ligand accession: 31Z
DrugBank: n/a
PubChem: 74331718
ChEMBL: CHEMBL3297962
InChI Key: CFELMOUQZGRYTG-KRWDZBQOSA-N
SMILES: CC1=CN(C(=O)NC1=O)C2CCCN(C2)Cc3ccc(c(c3F)Oc4cccc(c4)Cl)C(=O)O
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein Q6GJI9

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4QGA	Download	Experimental	e4qgaA1 e4qgaB1	P-loop domains-like P-loop domains-like	LigPlot