Compound Detail
CHEMBL4790396
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Basic Information
| ChEMBL ID | CHEMBL4790396 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XFMZPAXBRSRGGU-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
426.6
MW (Da)
4.42
ALogP
7
HBA
0
HBD
49.6
PSA (Ų)
0.43
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 9.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Activin receptor type-1 CHEMBL5903 | IC50 | 9.0 | 9.0 | 1.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Activin receptor type-1 | IC50 | = | 1.0 | nM | 9.0 | Inhibition of human ALK2 using casein as substrate by [gamma-33P]-ATP assay | 32750526 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 32750526 | 10.1016/j.bmcl.2020.127418 | Activin receptor type-1 | 1 |
Data from ChEMBL 36 via Core Engine