Ligand name: ~{N}-[3-[methyl(7~{H}-pyrrolo[2,3-d]pyrimidin-4-yl)amino]cyclobutyl]methanesulfonamide
PDB ligand accession: 6TE
DrugBank: n/a
PubChem: n/a
ChEMBL: CHEMBL4100431
InChI Key: QZOGHNDWZHFIJP-DTORHVGOSA-N
SMILES: CN(c1c2cc[nH]c2ncn1)C3CC(C3)NS(=O)(=O)C
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Pyrrolopyrimidines
      • 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
5KHX	Download	Experimental	e5khxA1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot