MRK-A |
MRK-A : Inhibitor of TEAD1
Probe Summary
Selectivity
Potency
In Vivo
Control Compounds
Chemical Information
References
Vendors
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Probe Summary
| Targets | Biochemical/Biophysical Potency | Cellular Potency |
|---|---|---|
| TEAD1 |
|
|
up to 100 nM
Selectivity
In Vitro Selectivity Assessment
Potency Assay Off-Target:
The activity of MRK-A was profiled in Eurofins Cerep PanLab panel (Total number of assays: 108) usin ...
In Vitro Selectivity Assessment
Potency Assay Off-Target:
MRK-A was assessed against a panel of 247 Kinases @ 10 uM
Potency Cellular
In Vitro
TEAD1
Mode of Action: Inhibitor
Structure-Activity-Relationship data available? No
DOI Reference: 10.1021/acs.jmedchem.5c02997
In Vivo Validations
Rat
Dose:
Route of delivery:
Oral
Systemic clearance:
8 mL/min/Kg
Bioavailability:
96%
Volume of Distribution at Steady-State:
3.0 L/Kg
DOI Reference: 10.1021/acs.jmedchem.5c02997
Dog
Dose:
Route of delivery:
Oral
Systemic clearance:
12 mL/min/Kg
Bioavailability:
44%
Volume of Distribution at Steady-State:
5.7 L/Kg
DOI Reference: 10.1021/acs.jmedchem.5c02997
Chemical Information
| Molecular Formula | C19H17F3N4O3S |
| SMILEs | CNS(=O)(=O)c1cnc(Oc2ccc(C(F)(F)F)cc2)c(-c2cn3c(n2)CCC3)c1 |
| InChI | InChI=1S/C19H17F3N4O3S/c1-23-30(27,28)14-9-15(16-11-26-8-2-3-17(26)25-16)18(24-10-14)29-13-6-4-12(5-7-13)19(20,21)22/h4-7,9-11,23H,2-3,8H2,1H3 |
| Molecular weight | 438.10 Da |
| AlogP | 3.610500000000002 |
| HBond acceptors | 7 |
| HBond donors | 1 |
| Atoms | 47 |