Ligand name: 2,8-dithioxo-1,2,3,7,8,9-hexahydro-6H-purin-6-one
PDB ligand accession: 5JL
DrugBank: n/a
PubChem: 85223;2366465;
ChEMBL: CHEMBL1416049
InChI Key: NDSUZZIWNBVBKW-UHFFFAOYSA-N
SMILES: C12=C(NC(=S)N1)NC(=S)NC2=O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Imidazopyrimidines
      • Subclass: Purines and purine derivatives

List of PDB structures and/or AlphaFold models with target protein A0A165FVI1

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6ROK	Download	Experimental	e6rokA1 e6rokA2 e6rokA3	HhH/H2TH MutM N-terminal domain-like Glucocorticoid receptor-like	LigPlot
6RP0	Download	Experimental	e6rp0A1 e6rp0A2 e6rp0A3	MutM N-terminal domain-like Glucocorticoid receptor-like HhH/H2TH	LigPlot