Ligand name: 4-(4-HYDROXY-3-ISOPROPYLPHENYLTHIO)-2-ISOPROPYLPHENOL
PDB ligand accession: 178
DrugBank: DB02881
PubChem: 448797
ChEMBL: n/a
InChI Key: NEMLLZAROZVCCE-UHFFFAOYSA-N
SMILES: CC(C)c1cc(ccc1O)Sc2ccc(c(c2)C(C)C)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organosulfur compounds
    • Class: Thioethers
      • Subclass: Aryl thioethers

List of PDB structures and/or AlphaFold models with target protein P31116

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
1TVE	Download	Experimental	e1tveA1 e1tveA2 e1tveB1 e1tveB2	FwdE/GAPDH domain-like Rossmann-like FwdE/GAPDH domain-like Rossmann-like	LigPlot