AZ3246 |
AZ3246 : Inhibitor of MAP4K1
Probe Summary
Selectivity
Potency
In Vivo
Control Compounds
Chemical Information
References
Vendors
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Probe Summary
| Targets | Biochemical/Biophysical Potency | Cellular Potency |
|---|---|---|
| MAP4K1 |
|
|
Inhibitor
200-500 nM
up to 100 nM
Selectivity
In Vitro Selectivity Assessment
Potency Assay Off-Target:
AZ3246 exhibits exquisite kinome selectivity: in a Thermo-Fisher kinase panel of 357 kinases, 100 nM ...
In Cell Selectivity Assessment
Potency Assay Off-Target:
Chemoproteomics data from physiologically relevant cell lysates also demonstrated that AZ3246 is hig ...
In Vitro Selectivity Assessment
Potency Assay Off-Target:
The compound is neither a Cyp inhibitor nor an inducer and is also clean in hERG and other cardiac i ...
Potency Cellular
In Vitro
MAP4K1
Mode of Action: Inhibitor
Structure-Activity-Relationship data available? Yes
DOI Reference: 10.1021/acs.jmedchem.4c02631
In Vivo Validations
Mouse
Dose:
Route of delivery:
Oral
Plasma half life:
2.7 h
Systemic clearance:
12 mL/min/Kg
Bioavailability:
29%
Volume of Distribution at Steady-State:
0.8 L/Kg
DOI Reference: 10.1021/acs.jmedchem.4c02631
Rat
Dose:
Route of delivery:
Oral
Plasma half life:
2.0 h
Systemic clearance:
18.7 mL/min/Kg
Bioavailability:
84%
Volume of Distribution at Steady-State:
1.4 L/Kg
DOI Reference: 10.1021/acs.jmedchem.4c02631
Dog
Dose:
Route of delivery:
Oral
Plasma half life:
3.2 h
Systemic clearance:
4.5 mL/miin/Kg
Bioavailability:
49%
Volume of Distribution at Steady-State:
0.87 L/Kg
DOI Reference: 10.1021/acs.jmedchem.4c02631
Monkey (Cynomolgus)
Dose:
Route of delivery:
Oral
Plasma half life:
1.9 h
Systemic clearance:
15 mL/min/Kg
Bioavailability:
68%
Volume of Distribution at Steady-State:
0.87 L/Kg
DOI Reference: 10.1021/acs.jmedchem.4c02631
Chemical Information
| Molecular Formula | C21H20F3N9O |
| SMILEs | Cc1nn(CC(F)(F)F)cc1Nc1nc(C2CC2)c(-c2cncc3c2ncn3C)nc1C(N)=O |
| InChI | InChI=1S/C21H20F3N9O/c1-10-13(7-33(31-10)8-21(22,23)24)28-20-18(19(25)34)29-17(15(30-20)11-3-4-11)12-5-26-6-14-16(12)27-9-32(14)2/h5-7,9,11H,3-4,8H2,1-2H3,(H2,25,34)(H,28,30) |
| Molecular weight | 471.17 Da |
| AlogP | 3.2124200000000007 |
| HBond acceptors | 10 |
| HBond donors | 3 |
| Atoms | 54 |