Ligand name: 7-(2-chlorobenzyl)-1,3-dimethyl-8-piperazin-1-yl-3,7-dihydro-1H-purine-2,6-dione
PDB ligand accession: RUF
DrugBank: n/a
PubChem: 979136
ChEMBL: CHEMBL1235760
InChI Key: PDZWWGBRZISNRL-UHFFFAOYSA-N
SMILES: CN1c2c(n(c(n2)N3CCNCC3)Cc4ccccc4Cl)C(=O)N(C1=O)C
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Diazinanes
      • Subclass: Piperazines

List of PDB structures and/or AlphaFold models with target protein P27487

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3G0C	Download	Experimental	e3g0cA1 e3g0cA2 e3g0cB1 e3g0cB2 e3g0cC1 e3g0cC2 e3g0cD1 e3g0cD2	beta-propeller-like alpha/beta-Hydrolases beta-propeller-like alpha/beta-Hydrolases beta-propeller-like alpha/beta-Hydrolases beta-propeller-like alpha/beta-Hydrolases	LigPlot