ER-27319

Ligand id: 9611

Name: ER-27319

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 3
Topological polar surface area 46.33
Molecular weight 280.16
XLogP 3.98
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
10-(3-aminopropyl)-3,4-dimethylacridin-9-one
Comments
The structure shown here is ER-27319 free base, when in fact the biological activity has been evaluated using the ethanedioate as represented by PubChem CID 9799508 [1]. ER-27319 is an inhibitor of spleen tyrosine kinase (Syk) [2] however, given the high concentration of compound ER-27319 required to cause half-maximal inhibition of mast cells degranulation, targets other than Syk may also be inhibited. In addition ER-27319 targets the activation of SYK mediated through FcεR1γ ITAM, suggesting there is no direct interaction with the Syk ATP pocket. Whatever the mechanism ER-27319 action is specific to mast cells.
Database Links
BindingDB Ligand 50396076
ChEMBL Ligand CHEMBL1375018
GtoPdb PubChem SID 340590241
PubChem CID 9799509
Search Google for chemical match using the InChIKey CFPDEQBPNROZDC-UHFFFAOYSA-N
Search Google for chemicals with the same backbone CFPDEQBPNROZDC
Search UniChem for chemical match using the InChIKey CFPDEQBPNROZDC-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone CFPDEQBPNROZDC