Ligand name: (1R,2R)-2-(2-{[5-chloro-3-(trifluoromethyl)-1H-pyrazol-1-yl]methyl}-7-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-6-yl)cyclopropane-1-carbonitrile
PDB ligand accession: 7H2
DrugBank: n/a
PubChem: 134157459
ChEMBL: CHEMBL3983039
InChI Key: PXLJMGCNGCDJTO-CMPLNLGQSA-N
SMILES: CC1=C(N2C(=NC(=CC2=O)Cn3c(cc(n3)C(F)(F)F)Cl)C=C1)C4CC4C#N
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Pyridopyrimidines
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein Q05586

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5TPA	Download	Experimental	e5tpaA1 e5tpaA2 e5tpaB1 e5tpaB2	Periplasmic binding protein-like II Periplasmic binding protein-like II Periplasmic binding protein-like II Periplasmic binding protein-like II	LigPlot