Ligand name: N-{cis-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]cyclobutyl}propane-1-sulfonamide
PDB ligand accession: D7D
DrugBank: DB14973
PubChem: n/a
ChEMBL: CHEMBL3655081
InChI Key: IUEWXNHSKRWHDY-PHIMTYICSA-N
SMILES: CCCS(=O)(=O)NC1CC(C1)N(C)c2c3cc[nH]c3ncn2
Drug action: inhibitor

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Pyrrolopyrimidines
      • Subclass: Pyrrolo[2,3-d]pyrimidines

List of drug binding-associated PTMs

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
6BBU	Download	Experimental	e6bbuA1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot