Ligand name: 6-(2,9-DIAZASPIRO[5.5]UNDECAN-2-YL)-9H-PURINE
PDB ligand accession: QNI
DrugBank: n/a
PubChem: 70789256
ChEMBL: CHEMBL2420913
InChI Key: NQWBGODZSPAAMM-UHFFFAOYSA-N
SMILES: c1[nH]c2c(n1)c(ncn2)N3CCCC4(C3)CCNCC4
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
3ZO3	Download	Experimental	e3zo3A2	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot