Ligand name: N-(3-fluoropyridin-4-yl)-2-[6-(trifluoromethyl)pyridin-2-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine
PDB ligand accession: D0A
DrugBank: n/a
PubChem: 126537450
ChEMBL: CHEMBL4217699
InChI Key: KNTWBIUWHSYQJE-UHFFFAOYSA-N
SMILES: c1cc(nc(c1)C(F)(F)F)c2nc3c(cc[nH]3)c(n2)Nc4ccncc4F
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 P36897

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6B8Y	Download	Experimental	e6b8yA1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot