Ligand name: ALRESTATIN
PDB ligand accession: ALR
DrugBank: DB02020
PubChem: 2120
ChEMBL: CHEMBL63055
InChI Key: GCUCIFQCGJIRNT-UHFFFAOYSA-N
SMILES: c1cc2cccc3c2c(c1)C(=O)N(C3=O)CC(=O)O

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Isoquinolines and derivatives
      • Subclass: Isoquinolones and derivatives

List of proteins that are targets for ALR

#	DrugDomain Data	UniProt Accession	Drug Action	Affinity data
1	P15121_ALR	P15121	inhibitor	Ki(nM) = 2000.0 IC50(nM) = 6500.0