Ligand name: ~{N}-[[2-methyl-4-[2-[(1-methylpyrazol-4-yl)amino]pyrimidin-4-yl]phenyl]methyl]-3-propan-2-yloxy-azetidine-1-carboxamide
PDB ligand accession: S9A
DrugBank: n/a
PubChem: 118139356
ChEMBL: CHEMBL4744041
InChI Key: BMWMKGNVAMXXCH-UHFFFAOYSA-N
SMILES: Cc1cc(ccc1CNC(=O)N2CC(C2)OC(C)C)c3ccnc(n3)Nc4cnn(c4)C
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 Q06187

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6W07	Download	Experimental	e6w07A1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot