Ligand name: 6-azanyl-2-(2-methoxyethoxy)-9-(pyridin-3-ylmethyl)-7H-purin-8-one
PDB ligand accession: EWX
DrugBank: n/a
PubChem: 22928870
ChEMBL: n/a
InChI Key: XWTNEKDECZWUJX-UHFFFAOYSA-N
SMILES: COCCOc1nc(c2c(n1)N(C(=O)N2)Cc3cccnc3)N
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 B3Y653

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6LVZ	Download	Experimental	e6lvzB1 e6lvzA2	Single-stranded right-handed beta-helix Single-stranded right-handed beta-helix	LigPlot