PDB ligand accession: BI9
DrugBank: DB07460
PubChem:
ChEMBL:
InChI Key: UYJNQQDJUOUFQJ-UHFFFAOYSA-N
SMILES: CNC(=O)c1ccccc1Nc2c(cnc(n2)Nc3ccc(cc3OC)N4CCOCC4)Cl
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Oxazinanes
- Subclass: Morpholines
- Class: Oxazinanes
- Superclass: Organoheterocyclic compounds
# | DrugDomain Data | UniProt Accession | Protein name | Drug Action | Affinity data |
---|---|---|---|---|---|
1 | Q96RR4_BI9 | Q96RR4 | Calcium/calmodulin-dependent protein kinase | n/a | |
2 | Q00944_BI9 | Q00944 | Focal adhesion kinase | n/a | |
3 | Q05397_BI9 | Q05397 | Focal adhesion kinase | n/a | IC50(nM) = 4.5 |