Ligand name: (3~{a}~{S})-2-[(3~{S})-1-azabicyclo[2.2.2]octan-3-yl]-3~{a},4,5,6-tetrahydro-3~{H}-benzo[de]isoquinolin-1-one
PDB ligand accession: O7B
DrugBank: DB00377
PubChem: 6337614
ChEMBL: CHEMBL1189679
InChI Key: CPZBLNMUGSZIPR-NVXWUHKLSA-N
SMILES: c1cc2c3c(c1)C(=O)N(CC3CCC2)C4CN5CCC4CC5
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Isoquinolines and derivatives
      • Subclass: Isoquinolones and derivatives

List of PDB structures and/or AlphaFold models with target protein Q8K1F4

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6W1Y	Download	Experimental	e6w1yA1 e6w1yA2 e6w1yE1 e6w1yA1 e6w1yB1 e6w1yB2 e6w1yB2 e6w1yC1 e6w1yC2 e6w1yC2 e6w1yD1 e6w1yD2 e6w1yD1 e6w1yE1 e6w1yE2	Immunoglobulin-like beta-sandwich Neurotransmitter-gated ion-channel transmembrane pore Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Neurotransmitter-gated ion-channel transmembrane pore Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Neurotransmitter-gated ion-channel transmembrane pore Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Neurotransmitter-gated ion-channel transmembrane pore Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Neurotransmitter-gated ion-channel transmembrane pore	LigPlot