Ligand name: 6-(1,9-DIAZASPIRO[5.5]UNDECAN-9-YL)-9H-PURINE
PDB ligand accession: SIJ
DrugBank: n/a
PubChem: 70789254
ChEMBL: CHEMBL2420909
InChI Key: SLPPJSSITOXUMX-UHFFFAOYSA-N
SMILES: c1[nH]c2c(n1)c(ncn2)N3CCC4(CCCCN4)CC3
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 P00517

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3ZO1	Download	Experimental	e3zo1A2	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot