Compound Detail
CHEMBL6252
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Basic Information
| ChEMBL ID | CHEMBL6252 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | LPNSUJMINOXWJC-UHFFFAOYSA-N |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
359.4
MW (Da)
4.64
ALogP
3
HBA
2
HBD
78.9
PSA (Ų)
0.56
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 6.4
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| TGF-beta receptor type-1 CHEMBL4439 | IC50 | 6.4 | 6.4 | 400.0 | 1 |
| MAP kinase p38 CHEMBL2094115 | IC50 | 6.31 | 6.31 | 490.0 | 1 |
| Polyunsaturated fatty acid 5-lipoxygenase CHEMBL215 | IC50 | 6.3 | 6.3 | 500.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| TGF-beta receptor type-1 | IC50 | = | 400.0 | nM | 6.4 | Inhibition of Activin like receptor kinase 5, TGF beta type I receptor | 11855979 |
| MAP kinase p38 | IC50 | = | 490.0 | nM | 6.31 | Inhibition of Mitogen-activated protein kinase p38 | 11855979 |
| Polyunsaturated fatty acid 5-lipoxygenase | IC50 | = | 500.0 | nM | 6.3 | Inhibitory activity against interleukin-1 (IL-1) synthesis, using intact human m... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/0960-894X(95)00189-Z | Polyunsaturated fatty acid 5-lipoxygenase | 2 |
| 11855979 | 10.1021/jm010493y | TGF-beta receptor type-1 | 1 |
| 11855979 | 10.1021/jm010493y | MAP kinase p38 | 1 |
| - | 10.6019/CHEMBL3988181 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine