Ligand name: 5-azanyl-~{N}-[[4-[[(2~{S})-4-cyclohexyl-1-[[(3~{R})-1-methylsulfonylpiperidin-3-yl]amino]-1-oxidanylidene-butan-2-yl]carbamoyl]phenyl]methyl]-1-methyl-pyrazole-4-carboxamide
PDB ligand accession: TKB
DrugBank: n/a
PubChem: 155803662
ChEMBL: n/a
InChI Key: MPUYKAMJRIAPDD-NOZRDPDXSA-N
SMILES: Cn1c(c(cn1)C(=O)NCc2ccc(cc2)C(=O)NC(CCC3CCCCC3)C(=O)NC4CCCN(C4)S(=O)(=O)C)N
Drug action: n/a

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 P47811

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
7BE5	Download	Experimental	e7be5A1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot