Compound Detail
CHEMBL269341
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Basic Information
| ChEMBL ID | CHEMBL269341 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ULAVWFANALBEHR-UHFFFAOYSA-N |
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
366.4
MW (Da)
4.41
ALogP
5
HBA
1
HBD
83.8
PSA (Ų)
0.58
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 5.53
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| TGF-beta receptor type-1 CHEMBL4439 | IC50 | 5.53 | 5.53 | 2950.0 | 2 |
| MAP kinase p38 CHEMBL2094115 | IC50 | 4.82 | 4.82 | 15000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| TGF-beta receptor type-1 | IC50 | = | 2950.0 | nM | 5.53 | Inhibition of Activin like receptor kinase 5, TGF beta type I receptor | 11855979 |
| TGF-beta receptor type-1 | IC50 | = | 2950.0 | nM | 5.53 | Antagonistic activity at TGFBR1 | 20176484 |
| MAP kinase p38 | IC50 | = | 15000.0 | nM | 4.82 | Inhibition of Mitogen-activated protein kinase p38 | 11855979 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 20176484 | 10.1016/j.bmcl.2010.01.140 | TGF-beta receptor type-1 | 2 |
| 11855979 | 10.1021/jm010493y | TGF-beta receptor type-1 | 1 |
| 11855979 | 10.1021/jm010493y | MAP kinase p38 | 1 |
Data from ChEMBL 36 via Core Engine