Ligand name: (1~{S},3~{R})-3-acetamido-~{N}-[5-chloranyl-4-(5,5-dimethyl-4,6-dihydropyrrolo[1,2-b]pyrazol-3-yl)pyridin-2-yl]cyclohexane-1-carboxamide
PDB ligand accession: Q6E
DrugBank: DB18823
PubChem: 124155204
ChEMBL: CHEMBL4462530
InChI Key: AVIWDYSJSPOOAR-LSDHHAIUSA-N
SMILES: CC(=O)NC1CCCC(C1)C(=O)Nc2cc(c(cn2)Cl)c3cnn4c3CC(C4)(C)C
Drug action: inhibitor

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic acids and derivatives
    • Class: Carboxylic acids and derivatives
      • Subclass: Amino acids, peptides, and analogues

List of PDB structures and/or AlphaFold models with target protein P50750

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6Z45	Download	Experimental	e6z45A1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot