Ligand name: 17-DESMETHOXY-17-N,N-DIMETHYLAMINOETHYLAMINO-GELDANAMYCIN
PDB ligand accession: KOS
DrugBank: DB12442
PubChem: 5288674
ChEMBL: CHEMBL383824
InChI Key: KUFRQPKVAWMTJO-LMZWQJSESA-N
SMILES: CC1CC(C(C(C=C(C(C(C=CC=C(C(=O)NC2=CC(=O)C(=C(C1)C2=O)NCCN(C)C)C)OC)OC(=O)N)C)C)O)OC

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Phenylpropanoids and polyketides
    • Class: Macrolactams
      • Subclass: None

List of proteins that are targets for DB12442

#	DrugDomain Data	UniProt Accession	Drug Action	Affinity data
1	P07900_KOS	P07900	inhibitor