Ligand name: 5-[5-chloranyl-4-[1-(2-methoxyethyl)-1,8-diazaspiro[4.5]decan-8-yl]pyridin-3-yl]-1-methyl-3~{H}-2,1-benzothiazole 2,2-dioxide
PDB ligand accession: 5Y7
DrugBank: n/a
PubChem: 117072462
ChEMBL: CHEMBL3798778
InChI Key: GRKOQLWARQVTPO-UHFFFAOYSA-N
SMILES: CN1c2ccc(cc2CS1(=O)=O)c3cncc(c3N4CCC5(CCCN5CCOC)CC4)Cl
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Azaspirodecane derivatives
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein P49336

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5HBH	Download	Experimental	e5hbhA1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot