Ligand name: 1-[4-(benzenecarbonyl)piperazin-1-yl]-2-(4-bromo-7-fluoro-1H-indol-3-yl)ethane-1,2-dione
PDB ligand accession: JYS
DrugBank: n/a
PubChem: 506250
ChEMBL: CHEMBL524048
InChI Key: FHPUNKHJTFLQMK-UHFFFAOYSA-N
SMILES: c1ccc(cc1)C(=O)N2CCN(CC2)C(=O)C(=O)c3c[nH]c4c3c(ccc4F)Br
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Indoles and derivatives
      • Subclass: Indoles

List of PDB structures and/or AlphaFold models with target protein B3UES2

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6MUG	Download	Experimental	e6mugG1 e6mugG3	Ribosomal protein L31e-like gp120 inner domain	LigPlot