Ligand name: N-{6-[4-(6-BROMO-1,2-BENZISOTHIAZOL-3-YL)PHENOXY]HEXYL}-N-METHYL-2-PROPEN-1-AMINE
PDB ligand accession: R46
DrugBank: n/a
PubChem: 445991
ChEMBL: CHEMBL294809
InChI Key: ZHDHSBKTLRLUCQ-UHFFFAOYSA-N
SMILES: CN(CCCCCCOc1ccc(cc1)c2c3ccc(cc3sn2)Br)CC=C
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Benzothiazoles
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein P33247

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
1H3B	Download	Experimental	e1h3bA1 e1h3bA2 e1h3bB1 e1h3bB2 e1h3bC1 e1h3bC2	Repetitive alpha hairpins Repetitive alpha hairpins Repetitive alpha hairpins Repetitive alpha hairpins Repetitive alpha hairpins Repetitive alpha hairpins	LigPlot