Ligand name: 3-({3-[(2-amino-6-fluoropyridin-4-yl)methyl]-5-(1-methylethyl)-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl}carbonyl)-5-methylbenzonitrile
PDB ligand accession: KR1
DrugBank: n/a
PubChem: 46880493
ChEMBL: CHEMBL1081651
InChI Key: SORPAQIMHXALKW-UHFFFAOYSA-N
SMILES: Cc1cc(cc(c1)C(=O)C2=C(C(=O)NC(=O)N2Cc3cc(nc(c3)F)N)C(C)C)C#N
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic oxygen compounds
    • Class: Organooxygen compounds
      • Subclass: Carbonyl compounds

List of PDB structures and/or AlphaFold models with target protein P04585

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3LAK	Download	Experimental	e3lakA5 e3lakA8	Ribonuclease H-like Alpha-beta plaits	LigPlot