Ligand name: 4-({(4-carboxybutyl)[2-(5-fluoro-2-{[4'-(trifluoromethyl)biphenyl-4-yl]methoxy}phenyl)ethyl]amino}methyl)benzoic acid
PDB ligand accession: 1DX
DrugBank: n/a
PubChem: 23546312
ChEMBL: CHEMBL5303375
InChI Key: CRQMDXFUKDWARU-UHFFFAOYSA-N
SMILES: c1cc(ccc1CN(CCCCC(=O)O)CCc2cc(ccc2OCc3ccc(cc3)c4ccc(cc4)C(F)(F)F)F)C(=O)O
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein Q8YUQ7

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4IAH	Download	Experimental	e4iahA1 e4iahB1	H-NOX domain H-NOX domain	LigPlot
4IAE	Download	Experimental	e4iaeA1 e4iaeB1	H-NOX domain H-NOX domain	LigPlot