Ligand name: 4-BROMO-3-(CARBOXYMETHOXY)-5-[3-(CYCLOHEXYLAMINO)PHENYL]THIOPHENE-2-CARBOXYLIC ACID
PDB ligand accession: 024
DrugBank: DB06829
PubChem: 17759780
ChEMBL: CHEMBL243940
InChI Key: RXDVFLTWXCTCEX-UHFFFAOYSA-N
SMILES: c1cc(cc(c1)NC2CCCCC2)c3c(c(c(s3)C(=O)O)OCC(=O)O)Br
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
2QBS	Download	Experimental	e2qbsA1	Flavodoxin-like	LigPlot