Ligand name: N-({4-[4-amino-3-(3,5-dimethyl-1-benzofuran-2-yl)-7-oxo-6,7-dihydro-2H-pyrazolo[3,4-d]pyridazin-2-yl]phenyl}methyl)prop-2-enamide
PDB ligand accession: AWX
DrugBank: n/a
PubChem: 145945978
ChEMBL: CHEMBL4541330
InChI Key: GXIHBWCRCZNSHX-UHFFFAOYSA-N
SMILES: Cc1ccc2c(c1)c(c(o2)c3c4c(nn3c5ccc(cc5)CNC(=O)C=C)C(=O)NN=C4N)C
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Azoles
      • Subclass: Pyrazoles

List of PDB structures and/or AlphaFold models with target protein P22455

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6IUO	Download	Experimental	e6iuoA1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot