Ligand name: 4-(4-tert-butylbenzyl)-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidin-4-aminium
PDB ligand accession: X37
DrugBank: n/a
PubChem: 44629418
ChEMBL: n/a
InChI Key: SNNUMARRAFQOGY-UHFFFAOYSA-O
SMILES: CC(C)(C)c1ccc(cc1)CC2(CCN(CC2)c3c4cc[nH]c4ncn3)[NH3+]
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Piperidines
      • Subclass: Benzylpiperidines

List of PDB structures and/or AlphaFold models with target protein P31751

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2XH5	Download	Experimental	e2xh5A1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot