Ligand name: AHA001
PDB ligand accession: AH1
DrugBank: DB01732
PubChem: 444290
ChEMBL: CHEMBL171148
InChI Key: SQBOSZXDOHQFAA-ZRTHHSRSSA-N
SMILES: c1ccc(cc1)CN2C(C(C(C(N(C2=O)Cc3ccccc3)COc4ccccc4)O)O)COc5ccccc5
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Phenol ethers
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein P03366

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
1AJX	Download	Experimental	e1ajxA1 e1ajxB1	cradle loop barrel cradle loop barrel	LigPlot