Ligand name: 1-methyl-4-[(5~{S})-3-methylsulfanyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl]piperazine
PDB ligand accession: 89F
DrugBank: n/a
PubChem: 7059581
ChEMBL: CHEMBL428892
InChI Key: RLJFTICUTYVZDG-SFHVURJKSA-N
SMILES: CN1CCN(CC1)C2Cc3ccccc3Sc4c2cc(cc4)SC
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Benzothiepins
      • Subclass: Dibenzothiepins

List of PDB structures and/or AlphaFold models with target protein P28222

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5V54	Download	Experimental	e5v54A2 e5v54B1	Family A G protein-coupled receptor-like Family A G protein-coupled receptor-like	LigPlot