Ligand name: 4-(hydroxymethyl)-7-[[4-[[methyl-(phenylmethyl)amino]methyl]phenyl]methoxy]chromen-2-one
PDB ligand accession: 5IK
DrugBank: n/a
PubChem: 122180463
ChEMBL: CHEMBL3586771
InChI Key: RTJRBYKZQSYWCM-UHFFFAOYSA-N
SMILES: CN(Cc1ccccc1)Cc2ccc(cc2)COc3ccc4c(c3)OC(=O)C=C4CO
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Phenylpropanoids and polyketides
    • Class: Coumarins and derivatives
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein P21836

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
7QAK	Download	Experimental	e7qakA1 e7qakB1	alpha/beta-Hydrolases alpha/beta-Hydrolases	LigPlot