Ligand name: (1R,2R,4aS,8S,8aR)-2,8-dimethyl-5'-phenyl-4a,5,6,7,8,8a-hexahydro-2H,2'H-spiro[naphthalene-1,3'-pyridine]-2',4'(1'H)-dione
PDB ligand accession: B3O
DrugBank: n/a
PubChem: 138753135
ChEMBL: n/a
InChI Key: BELTVPCRHYWOEN-HPLJPIIASA-N
SMILES: CC1CCCC2C1C3(C(C=C2)C)C(=O)C(=CNC3=O)c4ccccc4
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Pyridines and derivatives
      • Subclass: Hydropyridines

List of PDB structures and/or AlphaFold models with target protein B8NJH3

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6IX8	Download	Experimental	e6ix8A2 e6ix8B2 e6ix8A1 e6ix8A2 e6ix8B1	Rossmann-like HTH HTH Rossmann-like Rossmann-like	LigPlot