Ligand name: N-[2-(4-methoxypiperidin-1-yl)pyrimidin-4-yl]-1-(propan-2-yl)-2-(1H-pyrazol-4-yl)-1H-pyrrolo[3,2-c]pyridin-6-amine
PDB ligand accession: 3QW
DrugBank: n/a
PubChem: 86278566
ChEMBL: CHEMBL3354187
InChI Key: GZCREURYZWXRHS-UHFFFAOYSA-N
SMILES: CC(C)n1c2cc(ncc2cc1c3c[nH]nc3)Nc4ccnc(n4)N5CCC(CC5)OC
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 P00533

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4RJ4	Download	Experimental	e4rj4A1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot