PDB ligand accession: ASW
DrugBank: DB00276
PubChem:
ChEMBL:
InChI Key: XCPGHVQEEXUHNC-UHFFFAOYSA-N
SMILES: COc1cc(ccc1Nc2c3ccccc3nc4c2cccc4)NS(=O)(=O)C
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Quinolines and derivatives
- Subclass: Benzoquinolines
- Class: Quinolines and derivatives
- Superclass: Organoheterocyclic compounds
# | DrugDomain Data | UniProt Accession | Protein name | Drug Action | Affinity data |
---|---|---|---|---|---|
1 | Q12809_ASW | Q12809 | Voltage-gated inwardly rectifying | inhibitor | IC50(nM) = 208.93 |
2 | P02768_ASW | P02768 | Albumin | n/a | |
3 | P02763_ASW | P02763 | Alpha-1-acid glycoprotein 1 | n/a | |
4 | Q02880_ASW | Q02880 | DNA topoisomerase 2-beta | inhibitor | IC50(nM) = 2760.0 EC50(nM) = 11000.0 |
5 | P11388_ASW | P11388 | DNA topoisomerase 2-alpha | inhibitor | IC50(nM) = 1000.0 EC50(nM) = 720.0 |