Compound Detail
CHEMBL129553
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL129553 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CIAZILKRKUMNLQ-UHFFFAOYSA-N |
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
235.3
MW (Da)
3.45
ALogP
2
HBA
1
HBD
41.6
PSA (Ų)
0.74
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 6.26
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| TGF-beta receptor type-1 CHEMBL4439 | IC50 | 6.26 | 5.8 | 543.0 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| TGF-beta receptor type-1 | IC50 | = | 543.0 | nM | 6.26 | In vitro inhibitory activity against human Transforming growth factor beta-1 rec... | 12954047 |
| TGF-beta receptor type-1 | IC50 | = | 2160.0 | nM | 5.67 | In vitro inhibition of transforming growth factor- beta dependent luciferase gro... | 12954047 |
| TGF-beta receptor type-1 | IC50 | = | 3370.0 | nM | 5.47 | In vitro inhibition of transforming growth factor- beta dependent luciferase pro... | 12954047 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 12954047 | 10.1021/jm0205705 | TGF-beta receptor type-1 | 3 |
| 12954047 | 10.1021/jm0205705 | Mitogen-activated protein kinase 14 | 1 |
Data from ChEMBL 36 via Core Engine