Ligand name: 3-[3-[2-[(3,4,5-trimethoxyphenyl)amino]pyrrolo[2,3-d]pyrimidin-7-yl]phenyl]propanenitrile
PDB ligand accession: JL2
DrugBank: n/a
PubChem: 11453158
ChEMBL: CHEMBL206524
InChI Key: KKVZKYOBQGDKIB-UHFFFAOYSA-N
SMILES: COc1cc(cc(c1OC)OC)Nc2ncc3ccn(c3n2)c4cccc(c4)CCC#N
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Pyrroles
      • Subclass: Substituted pyrroles

List of PDB structures and/or AlphaFold models with target protein P19784

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6QY9	Download	Experimental	e6qy9A1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot