Ligand id: 8395

Name: DS-437

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 11
Hydrogen bond donors 5
Rotatable bonds 9
Topological polar surface area 185.74
Molecular weight 397.15
XLogP -0.99
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

View interactive charts of activity data from GtoPdb and ChEMBL (where available) across species

Bioactivity Comments
DS-437 is inactive against 29 other human protein-, DNA-, and RNA-methyltransferases [3]. Biochemical studies and analysis of the effect of geneitc deletion of PRMT5 and PRMT7 indicate that these enzymes derepress cell proliferation and migration in cancer [1-2,4-5] so may therefore represent a novel target for therapeutic intervention.
Selectivity at enzymes
Key to terms and symbols Click column headers to sort
Target Sp. Type Action Affinity Units Concentration range (M) Reference
protein arginine methyltransferase 5 Hs Inhibitor Inhibition 5.2 pIC50 - 3
pIC50 5.2 (IC50 5.9x10-6 M) [3]
protein arginine methyltransferase 7 Hs Inhibitor Inhibition 5.2 pIC50 - 3
pIC50 5.2 (IC50 6x10-6 M) [3]