Ligand name: 5-(4-fluorophenyl)-4-[1-(methanesulfonyl)azetidin-3-yl]pyrimidin-2-amine
PDB ligand accession: L7I
DrugBank: n/a
PubChem: 95805022
ChEMBL: CHEMBL3448046
InChI Key: TXIPIRKCLIOFPK-UHFFFAOYSA-N
SMILES: CS(=O)(=O)N1CC(C1)c2c(cnc(n2)N)c3ccc(cc3)F
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Diazines
      • Subclass: Pyrimidines and pyrimidine derivatives

List of PDB structures and/or AlphaFold models with target protein P49841

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
7U31	Download	Experimental	e7u31A1 e7u31B1	Protein kinase/SAICAR synthase/ATP-grasp Protein kinase/SAICAR synthase/ATP-grasp	LigPlot