Ligand name: 1-METHYLOXY-4-SULFONE-BENZENE
PDB ligand accession: MSB
DrugBank: DB03033
PubChem: 5171961
ChEMBL: n/a
InChI Key: XUNSZADDFLWFOL-UHFFFAOYSA-N
SMILES: COc1ccc(cc1)S(=O)=O
Drug action: inhibitor

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein P45452

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
1EUB	Download	Experimental	e1eubA1	Zincin-like	LigPlot