Ligand name: 4-({4-[(2-methylquinolin-6-yl)methyl]piperidin-1-yl}carbonyl)-2-phenylquinoline
PDB ligand accession: B37
DrugBank: n/a
PubChem: 45114302
ChEMBL: n/a
InChI Key: OZINPIJMBCNUEN-UHFFFAOYSA-N
SMILES: Cc1ccc2cc(ccc2n1)CC3CCN(CC3)C(=O)c4cc(nc5c4cccc5)c6ccccc6
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Quinolines and derivatives
      • Subclass: Phenylquinolines

List of PDB structures and/or AlphaFold models with target protein Q00955

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3TVU	Download	Experimental	e3tvuA3 e3tvuB4 e3tvuC2 e3tvuB3 e3tvuC1	ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase	LigPlot
3H0Q	Download	Experimental	e3h0qA4 e3h0qC3 e3h0qB4 e3h0qC4 e3h0qB3	ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase	LigPlot