Ligand name: (4aR,7aR)-7a-[(1R,2R)-2-(2-{[(1R,2R)-2-methylcyclopropyl]methoxy}propan-2-yl)cyclopropyl]-6-(pyrimidin-2-yl)-4,4a,5,6,7,7a-hexahydropyrrolo[3,4-d][1,3]thiazin-2-amine
PDB ligand accession: QK7
DrugBank: n/a
PubChem: 145704720
ChEMBL: CHEMBL4637426
InChI Key: BFGQEVKVRRYAQC-IFEDNLKFSA-N
SMILES: CC1CC1COC(C)(C)C2CC2C34CN(CC3CSC(=N4)N)c5ncccn5
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic nitrogen compounds
    • Class: Organonitrogen compounds
      • Subclass: Amines

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
6UWV	Download	Experimental	e6uwvA1 e6uwvA2 e6uwvB1 e6uwvB2	cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel	LigPlot