Ligand name: 3-oxo-3-[(3R)-3-(pyrrolo[2,3-b][1,2,3]triazolo[4,5-d]pyridin-1(6H)-yl)piperidin-1-yl]propanenitrile
PDB ligand accession: C5I
DrugBank: n/a
PubChem: n/a
ChEMBL: CHEMBL2392500
InChI Key: COGIAVJREKAVDL-SNVBAGLBSA-N
SMILES: c1c[nH]c2c1c3c(cn2)nnn3C4CCCN(C4)C(=O)CC#N
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Pyrrolopyridines
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein P23458

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4I5C	Download	Experimental	e4i5cA2 e4i5cB1	Protein kinase/SAICAR synthase/ATP-grasp Protein kinase/SAICAR synthase/ATP-grasp	LigPlot