Ligand name: 2-(2-methylphenoxy)-5-[(4-phenyl-1H-1,2,3-triazol-1-yl)methyl]phenol
PDB ligand accession: 53K
DrugBank: n/a
PubChem: 91826693
ChEMBL: CHEMBL4168222
InChI Key: RXXUNJCEEGMOQJ-UHFFFAOYSA-N
SMILES: Cc1ccccc1Oc2ccc(cc2O)Cn3cc(nn3)c4ccccc4
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 P9WGR0

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5MTP	Download	Experimental	e5mtpA1 e5mtpE1 e5mtpB1 e5mtpG1 e5mtpG1 e5mtpC1 e5mtpD1 e5mtpH1 e5mtpC1 e5mtpF1	Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like	LigPlot
5CPF	Download	Experimental	e5cpfA1 e5cpfB1 e5cpfC1 e5cpfD1	Rossmann-like Rossmann-like Rossmann-like Rossmann-like	LigPlot