PDB ligand accession: 0WM
DrugBank: DB08916
PubChem:
ChEMBL:
InChI Key: ULXXDDBFHOBEHA-CWDCEQMOSA-N
SMILES: CN(C)CC=CC(=O)Nc1cc2c(cc1OC3CCOC3)ncnc2Nc4ccc(c(c4)Cl)F
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Diazanaphthalenes
- Subclass: Benzodiazines
- Class: Diazanaphthalenes
- Superclass: Organoheterocyclic compounds
# | DrugDomain Data | UniProt Accession | Drug Action | Affinity data |
---|---|---|---|---|
1 | P04626_0WM | P04626 | inhibitor | IC50(nM) = 0.57 Kd(nM) = 5.0 EC50(nM) = 3.0 |
2 | Q15303_0WM | Q15303 | inhibitor | IC50(nM) = 1.0 Kd(nM) = 6.3 |
3 | P00533_0WM | P00533 | inhibitor | IC50(nM) = 0.01 Kd(nM) = 0.1 EC50(nM) = 7.5 |