Compound Detail
CHEMBL5266620
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COCCO[C@H]1CC[C@H](n2nc(-c3ccc(Nc4nc5cc(Cl)cc(F)c5o4)cc3)c3c(N)ncnc32)CC1
Basic Information
| ChEMBL ID | CHEMBL5266620 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SPPDBTPNBIGBJJ-WGSAOQKQSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
552.0
MW (Da)
5.90
ALogP
10
HBA
2
HBD
126.1
PSA (Ų)
0.23
QED
2
Ro5 Violations
8
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.44
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Interferon-induced, double-stranded RNA-activated protein kinase CHEMBL5785 | IC50 | 6.44 | 6.44 | 364.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Interferon-induced, double-stranded RNA-activated protein kinase | IC50 | = | 364.0 | nM | 6.44 | Inhibition of PKR (unknown origin) | 36400288 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 36400288 | 10.1016/j.bmcl.2022.129047 | Interferon-induced, double-stranded RNA-activated protein kinase | 1 |
Data from ChEMBL 36 via Core Engine