Ligand name: (3R)-3-[[(3S)-3-ethylpiperidin-1-yl]methyl]-6,8-bis(oxidanyl)-3,4-dihydroisochromen-1-one
PDB ligand accession: E5C
DrugBank: n/a
PubChem: 155908651
ChEMBL: n/a
InChI Key: PVQQYHLNENIZDV-SMDDNHRTSA-N
SMILES: CCC1CCCN(C1)CC2Cc3cc(cc(c3C(=O)O2)O)O
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein Q8IDJ8

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6L3Y	Download	Experimental	e6l3yB1 e6l3yA1	Class II aaRS and biotin synthetases Class II aaRS and biotin synthetases	LigPlot