Ligand name: Gedatolisib
PDB ligand accession: VL1
DrugBank: DB11896
PubChem: 44516953
ChEMBL: CHEMBL592445
InChI Key: DWZAEMINVBZMHQ-UHFFFAOYSA-N
SMILES: CN(C)C1CCN(CC1)C(=O)c2ccc(cc2)NC(=O)Nc3ccc(cc3)c4nc(nc(n4)N5CCOCC5)N6CCOCC6
Drug action: modulator

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein P48736

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
7JWE	Download	Experimental	e7jweA4	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot