Ligand name: N-cyclopropyl-4-methyl-3-(2'-oxo-1',2'-dihydrospiro[cyclopentane-1,3'-indol]-6'-yl)benzamide
PDB ligand accession: I2O
DrugBank: n/a
PubChem: 44251218
ChEMBL: CHEMBL1800911
InChI Key: WMXJYEDCJIDCNY-UHFFFAOYSA-N
SMILES: Cc1ccc(cc1c2ccc3c(c2)NC(=O)C34CCCC4)C(=O)NC5CC5
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Indoles and derivatives
      • Subclass: Indolines

List of PDB structures and/or AlphaFold models with target protein Q16539

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3RIN	Download	Experimental	e3rinA2	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot