Ligand name: KB2115
PDB ligand accession: 64L
DrugBank: DB05035
PubChem: 10299876
ChEMBL: CHEMBL2035874
InChI Key: VPCSYAVXDAUHLT-UHFFFAOYSA-N
SMILES: CC(C)c1cc(ccc1O)Oc2c(cc(cc2Br)NC(=O)CC(=O)O)Br
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein A0A0M3KL26

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5HKB	Download	Experimental	e5hkbA1 e5hkbB1 e5hkbC1 e5hkbD1	alpha/beta-Hydrolases alpha/beta-Hydrolases alpha/beta-Hydrolases alpha/beta-Hydrolases	LigPlot