Compound Detail
CHEMBL5597386
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Basic Information
| ChEMBL ID | CHEMBL5597386 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZBNZDAFYCKBXCS-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
294.3
MW (Da)
1.81
ALogP
4
HBA
0
HBD
59.5
PSA (Ų)
0.59
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.22
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Serine-protein kinase ATM CHEMBL3797 | IC50 | 6.22 | 6.22 | 600.0 | 1 |
| Serine/threonine-protein kinase mTOR CHEMBL2842 | IC50 | 5.16 | 5.16 | 7000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Serine-protein kinase ATM | IC50 | = | 600.0 | nM | 6.22 | Inhibition of ATM (unknown origin) | 39149790 |
| Serine/threonine-protein kinase mTOR | IC50 | = | 7000.0 | nM | 5.16 | Inhibition of mTOR (unknown origin) | 39149790 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 39149790 | 10.1021/acs.jmedchem.4c01064 | Serine-protein kinase ATM | 1 |
| 39149790 | 10.1021/acs.jmedchem.4c01064 | Serine/threonine-protein kinase mTOR | 1 |
Data from ChEMBL 36 via Core Engine