Ligand name: ethyl 2-[4-(6-azanyl-5-cyano-pyrimidin-4-yl)pyrazol-1-yl]ethanoate
PDB ligand accession: Q0T
DrugBank: n/a
PubChem: 155907503
ChEMBL: n/a
InChI Key: PNBCCOMJHGKSBL-UHFFFAOYSA-N
SMILES: CCOC(=O)Cn1cc(cn1)c2c(c(ncn2)N)C#N
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic acids and derivatives
    • Class: Carboxylic acids and derivatives
      • Subclass: Amino acids, peptides, and analogues

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
6YY7	Download	Experimental	e6yy7A1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot