Compound Detail
CHEMBL5286788
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CCc1ccc(OC(F)(F)F)cc1CC(=O)N1CCc2cc(-c3nn(CC)c4ncnc(N)c34)ccc21
Basic Information
| ChEMBL ID | CHEMBL5286788 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SHOAXRUPDAXQRL-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
510.5
MW (Da)
4.69
ALogP
7
HBA
1
HBD
99.2
PSA (Ų)
0.40
QED
1
Ro5 Violations
6
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 7.02
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Interferon-induced, double-stranded RNA-activated protein kinase CHEMBL5785 | EC50 | 7.02 | 7.02 | 95.0 | 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 | EC50 | = | 95.0 | nM | 7.02 | 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