Ligand name: (2E)-1-(2,4-dihydroxyphenyl)-3-(3,4-dihydroxyphenyl)prop-2-en-1-one
PDB ligand accession: BUN
DrugBank: n/a
PubChem: 5281222
ChEMBL: CHEMBL128000
InChI Key: AYMYWHCQALZEGT-ORCRQEGFSA-N
SMILES: c1cc(c(cc1C=CC(=O)c2ccc(cc2O)O)O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Phenylpropanoids and polyketides
    • Class: Linear 1,3-diarylpropanoids
      • Subclass: Chalcones and dihydrochalcones

List of PDB structures and/or AlphaFold models with target protein I6WYY7

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4RLW	Download	Experimental	e4rlwA1 e4rlwB1	Thioesterase/thiol ester dehydrase-isomerase-like Thioesterase/thiol ester dehydrase-isomerase-like	LigPlot