Ligand name: N-{3-[(4aR,7aS)-2-amino-6-(5-fluoropyrimidin-2-yl)-4a,5,6,7-tetrahydropyrrolo[3,4-d][1,3]thiazin-7a(4H)-yl]-4-fluorophenyl}-5-methoxypyrazine-2-carboxamide
PDB ligand accession: ZR7
DrugBank: n/a
PubChem: 78210254
ChEMBL: CHEMBL4452566
InChI Key: VQSRKMNBWMHJKY-YTEVENLXSA-N
SMILES: COc1cnc(cn1)C(=O)Nc2ccc(c(c2)C34CN(CC3CSC(=N4)N)c5ncc(cn5)F)F
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Benzene and substituted derivatives
      • Subclass: Anilides

List of PDB structures and/or AlphaFold models with target protein P56817

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
7MYU	Download	Experimental	e7myuA1 e7myuA2 e7myuB1 e7myuB2	cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel	LigPlot