Ligand name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-[(1S,2S,5S)-2,5-dimethoxycyclohexyl]acetamide
PDB ligand accession: 1KV
DrugBank: n/a
PubChem: n/a
ChEMBL: n/a
InChI Key: AOKPSAUXHJHABU-QYZOEREBSA-N
SMILES: COC1CCC(C(C1)NC(=O)CN2CCN(CC2)Cc3ccc4c(c3)OCO4)OC
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic acids and derivatives
    • Class: Carboxylic acids and derivatives
      • Subclass: Amino acids, peptides, and analogues

List of PDB structures and/or AlphaFold models with target protein P05804

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4JHZ	Download	Experimental	e4jhzA1 e4jhzA6 e4jhzB1 e4jhzB6	jelly-roll TIM beta/alpha-barrel jelly-roll TIM beta/alpha-barrel	LigPlot