Ligand id: 9581

Name: ARN-3236

Structure and Physico-chemical Properties

2D Structure
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Calculated Physico-chemical Properties
Hydrogen bond acceptors 1
Hydrogen bond donors 1
Rotatable bonds 4
Topological polar surface area 75.38
Molecular weight 336.09
XLogP 4.63
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

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

Bioactivity Comments
ARN-3236 is effective in vitro and in vivo in sensitizing cancer cells to the chemotherapeutic paclitaxel [3]. Kinase profile screening identified off-targets which include LCK, NUAK2, SRPK1 and VEGFR2, which are all inhibited by >80% in the presence of 500nM ARN-3236 [1].
Selectivity at enzymes
Key to terms and symbols Click column headers to sort
Target Sp. Type Action Value Parameter Concentration range (M) Reference
salt inducible kinase 2 Hs Inhibitor Inhibition >9.0 pIC50 - 1
pIC50 >9.0 (IC50 <1x10-9 M) [1]
Description: In an in vitro enzymatic assay.
SIK family kinase 3 Hs Inhibitor Inhibition 8.2 pIC50 - 1
pIC50 8.2 (IC50 6.6x10-9 M) [1]
Description: In an in vitro enzymatic assay.
salt inducible kinase 1 Hs Inhibitor Inhibition 7.7 pIC50 - 1
pIC50 7.7 (IC50 2.16x10-8 M) [1]
Description: In an in vitro enzymatic assay.