CDK11-In-37 |
CDK11-In-37 : Inhibitor of CDK11A, CDK11B
Probe Summary
Selectivity
Potency
In Vivo
Control Compounds
Chemical Information
References
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Probe Summary
| Targets | Biochemical/Biophysical Potency | Cellular Potency |
|---|---|---|
| CDK11A |
| |
| CDK11B |
|
up to 1 uM
Selectivity
In Vitro Selectivity Assessment
Potency Assay Off-Target:
KinomeSCAN
Selectivity Assessment Description:
Highly selective CDK11 inhibitor against other kinases in an extended kinase panel profiling (>100 k ...
In Cell Selectivity Assessment
Potency Assay Off-Target:
NanoBRET
Selectivity Assessment Description:
Selective against CDK7 (50x) and CDK9 (IC50 >10 uM)
Potency Cellular
In Vitro
CDK11A
Mode of Action: Inhibitor
Structure-Activity-Relationship data available? Yes
DOI Reference: 10.1002/cmdc.202500882
CDK11B
Mode of Action: Inhibitor
Structure-Activity-Relationship data available? Yes
DOI Reference: 10.1002/cmdc.202500882
In Vivo Validations
Mouse
Dose: 15 mg/Kg
Route of delivery:
Oral
Plasma half life:
1.09 h
Cmax:
489 ng/mL
Tmax:
0.5 h
Area Under the Curve::
833 h*ng/mL
DOI Reference: 10.1002/cmdc.202500882
Chemical Information
| Molecular Formula | C19H21ClFN5 |
| SMILEs | Cl.F[C@@H]1CNC[C@@H](Nc2nccc(-c3ccn(-c4ccccc4)c3)n2)C1 |
| InChI | InChI=1S/C19H20FN5.ClH/c20-15-10-16(12-21-11-15)23-19-22-8-6-18(24-19)14-7-9-25(13-14)17-4-2-1-3-5-17;/h1-9,13,15-16,21H,10-12H2,(H,22,23,24);1H/t15-,16-;/m0./s1 |
| Molecular weight | 373.15 Da |
| AlogP | 3.4680000000000017 |
| HBond acceptors | 5 |
| HBond donors | 2 |
| Atoms | 47 |