MKI-3 |
MKI-3 : Inhibitor of MASTL
Probe Summary
Selectivity
Potency
In Vivo
Control Compounds
Chemical Information
References
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Probe Summary
| Targets | Biochemical/Biophysical Potency | Cellular Potency |
|---|---|---|
| MASTL |
|
|
up to 1 uM
Selectivity
In Vitro Selectivity Assessment
Potency Assay Off-Target:
MKI-3 selectively inhibited MASTL over other AGC kinases, including large tumor suppressor kinase 1 ...
In Vitro Selectivity Assessment
Potency Assay Off-Target:
To further assess the kinase selectivity of MKI-3, we screened 82 kinases, including those with high ...
Selectivity Assessment Description:
Among the kinases tested, only five out of 82 exhibited over 80% inhibition, indicating a favorable ...
Potency Cellular
In Vitro
MASTL
Mode of Action: Inhibitor
Structure-Activity-Relationship data available? Yes
DOI Reference: 10.1021/acs.jmedchem.5c03599
Chemical Information
| Molecular Formula | C21H19N7O |
| SMILEs | NC(=O)c1ccc(Nc2nc(Nc3cc(C4CC4)[nH]n3)c3ccccc3n2)cc1 |
| InChI | InChI=1S/C21H19N7O/c22-19(29)13-7-9-14(10-8-13)23-21-24-16-4-2-1-3-15(16)20(26-21)25-18-11-17(27-28-18)12-5-6-12/h1-4,7-12H,5-6H2,(H2,22,29)(H3,23,24,25,26,27,28) |
| Molecular weight | 385.17 Da |
| AlogP | 3.8164000000000025 |
| HBond acceptors | 8 |
| HBond donors | 5 |
| Atoms | 48 |