Ligand name: 4-BROMO-3-(CARBOXYMETHOXY)-5-(4-HYDROXYPHENYL)THIOPHENE-2-CARBOXYLIC ACID
PDB ligand accession: 694
DrugBank: DB07197
PubChem: 9547958
ChEMBL: CHEMBL214502
InChI Key: QZWUMLLRAVGBHC-UHFFFAOYSA-N
SMILES: c1cc(ccc1c2c(c(c(s2)C(=O)O)OCC(=O)O)Br)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Thiophenes
      • Subclass: Thiophene carboxylic acids and derivatives

List of drug binding-associated PTMs

List of PDB structures and/or AlphaFold models with target protein P18031

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2H4G	Download	Experimental	e2h4gA1	Flavodoxin-like	LigPlot