Ligand name: [2-(phenylamino)-1,4-phenylene]bis({4-[2-(pyrrolidin-1-yl)ethyl]piperidin-1-yl}methanone)
PDB ligand accession: 6P9
DrugBank: n/a
PubChem: 126480585
ChEMBL: n/a
InChI Key: MJSAAVJPPGYWEY-UHFFFAOYSA-N
SMILES: c1ccc(cc1)Nc2cc(ccc2C(=O)N3CCC(CC3)CCN4CCCC4)C(=O)N5CCC(CC5)CCN6CCCC6
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein Q9Y657

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5JSG	Download	Experimental	e5jsgA1 e5jsgA2 e5jsgA3 e5jsgB1 e5jsgB2 e5jsgB3	SH3 SH3 SH3 SH3 SH3 SH3	LigPlot