Ligand name: 2-(3,4-dichlorophenyl)ethanamine
PDB ligand accession: 42J
DrugBank: n/a
PubChem: 217958
ChEMBL: CHEMBL147230
InChI Key: MQPUAVYKVIHUJP-UHFFFAOYSA-N
SMILES: c1cc(c(cc1CCN)Cl)Cl
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein P68400

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
7AT5	Download	Experimental	e7at5A1 e7at5B1	Protein kinase/SAICAR synthase/ATP-grasp Protein kinase/SAICAR synthase/ATP-grasp	LigPlot
5CLP	Download	Experimental	e5clpA1 e5clpB1	Protein kinase/SAICAR synthase/ATP-grasp Protein kinase/SAICAR synthase/ATP-grasp	LigPlot