CAMONSERTIB |
CAMONSERTIB : Inhibitor of ATR
Probe Summary
Selectivity
Potency
In Vivo
Control Compounds
Chemical Information
References
Vendors
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Probe Summary
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| Targets | Biochemical/Biophysical Potency | Cellular Potency |
|---|---|---|
| ATR |
|
|
Inhibitor
up to 100 nM
Selectivity
In Vitro Selectivity Assessment
Potency Assay Off-Target:
RP-3500 is highly selective for ATR with 30-fold selectivity over mammalian target of rapamycin (mTO ...
In Cell Selectivity Assessment
Potency Assay Off-Target:
Specific cell-based kinase assays were developed to determine the intracellular inhibitory activity ...
Potency Cellular
In Vitro
ATR
Mode of Action: Inhibitor
Structure-Activity-Relationship data available? No
DOI Reference: 10.1158/1535-7163.MCT-21-0615
In Vivo Validations
Mouse
Dose: 3 mg/Kg
Route of delivery:
Oral
Target engagement assay:
Estimated tumor target engagement IC80 of 18.6 nmol/L
DOI Reference: 10.1158/1535-7163.MCT-21-0615
Chemical Information
| Molecular Formula | C21H26N6O3 |
| SMILEs | C[C@@H]1COCCN1c1cc([C@]2(O)C[C@H]3CC[C@@H](C2)O3)c2cnn(-c3cc[nH]n3)c2n1 |
| InChI | InChI=1S/C21H26N6O3/c1-13-12-29-7-6-26(13)19-8-17(21(28)9-14-2-3-15(10-21)30-14)16-11-23-27(20(16)24-19)18-4-5-22-25-18/h4-5,8,11,13-15,28H,2-3,6-7,9-10,12H2,1H3,(H,22,25)/t13-,14-,15+,21+/m1/s1 |
| Molecular weight | 410.21 Da |
| AlogP | 1.8976999999999997 |
| HBond acceptors | 9 |
| HBond donors | 2 |
| Atoms | 56 |