Ligand name: 4-azanyl-6-[1-(pyridin-3-ylmethyl)pyrazol-4-yl]pyrimidine-5-carbonitrile
PDB ligand accession: Q0E
DrugBank: n/a
PubChem: 155907505
ChEMBL: n/a
InChI Key: CXHWYZDXLJBAJA-UHFFFAOYSA-N
SMILES: c1cc(cnc1)Cn2cc(cn2)c3c(c(ncn3)N)C#N
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 B1MHW4

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6YY9	Download	Experimental	e6yy9A1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot