Compound Detail
CHEMBL5661889
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Basic Information
| ChEMBL ID | CHEMBL5661889 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KSILOMXBNCLOSE-UHFFFAOYSA-N |
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
470.6
MW (Da)
3.76
ALogP
6
HBA
1
HBD
68.5
PSA (Ų)
0.38
QED
0
Ro5 Violations
9
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 7.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 7.0 | 6.375 | 100.0 | 2 |
| cAMP-dependent protein kinase (PKA) CHEMBL2094138 | IC50 | 5.22 | 5.22 | 6000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 100.0 | nM | 7.0 | Inhibition of bovine brain PKC in presence of [p32-gamma]-ATP measured after 10 ... | 1874734 |
| Unchecked | IC50 | = | 1800.0 | nM | 5.75 | Inhibition of Phosphorylase kinase in rabbit muscle tissue in presence of [p32-g... | 1874734 |
| cAMP-dependent protein kinase (PKA) | IC50 | = | 6000.0 | nM | 5.22 | Inhibition of PKA (unknown origin) | 1874734 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 1874734 | 10.1016/s0021-9258(18)98476-0 | Unchecked | 2 |
| 1874734 | 10.1016/s0021-9258(18)98476-0 | cAMP-dependent protein kinase (PKA) | 1 |
Data from ChEMBL 36 via Core Engine