Ligand name: 3-(4-bromophenyl)propanal
PDB ligand accession: DIJ
DrugBank: n/a
PubChem: 11481288
ChEMBL: n/a
InChI Key: RXZJWVPNFPPSEM-UHFFFAOYSA-N
SMILES: c1cc(ccc1CCC=O)Br
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Benzene and substituted derivatives
      • Subclass: Halobenzenes

List of PDB structures and/or AlphaFold models with target protein Q8NB78

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
7XE1	Download	Experimental	e7xe1A2 e7xe1A5 e7xe1B2 e7xe1B5	FAD-linked reductases, C-terminal domain-like Rossmann-like Rossmann-like FAD-linked reductases, C-terminal domain-like	LigPlot
7XE2	Download	Experimental	e7xe2A2 e7xe2A5 e7xe2B2 e7xe2B4	FAD-linked reductases, C-terminal domain-like Rossmann-like Rossmann-like FAD-linked reductases, C-terminal domain-like	LigPlot