Ligand name: pirtobrutinib
PDB ligand accession: Y7W
DrugBank: DB17472
PubChem: 129269915
ChEMBL: CHEMBL4650485
InChI Key: FWZAWAUZXYCBKZ-NSHDSACASA-N
SMILES: CC(C(F)(F)F)n1c(c(c(n1)c2ccc(cc2)CNC(=O)c3cc(ccc3OC)F)C(=O)N)N
Drug action: inhibitor

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein Q06187

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
8FLL	Download	Experimental	e8fllA1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot
8FLN	Download	Experimental	e8flnA1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot