Ligand name: 1-(5-cyanopyrazin-2-yl)-3-isoquinolin-3-ylurea
PDB ligand accession: H4K
DrugBank: n/a
PubChem: 45266971
ChEMBL: CHEMBL540497
InChI Key: GFPBJOCJVKFSBK-UHFFFAOYSA-N
SMILES: c1ccc2cnc(cc2c1)NC(=O)Nc3cnc(cn3)C#N
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Isoquinolines and derivatives
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein O14757

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4FT9	Download	Experimental	e4ft9A1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot