Compound Detail
CHEMBL490084
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Basic Information
| ChEMBL ID | CHEMBL490084 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | AMGGIBWEIGCKRZ-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
245.3
MW (Da)
3.81
ALogP
3
HBA
1
HBD
33.1
PSA (Ų)
0.71
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 7.65
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Amyloid-beta precursor protein CHEMBL2487 | Ki | 7.65 | 7.65 | 22.5 | 1 |
| Sulfotransferase 1A1 CHEMBL1743291 | Ki | 6.85 | 6.85 | 140.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Amyloid-beta precursor protein | Ki | = | 22.5 | nM | 7.65 | Displacement of [125I]IMPY from beta-amyloid plaques in Alzheimer's disease pati... | 19216563 |
| Sulfotransferase 1A1 | Ki | = | 140.0 | nM | 6.85 | Inhibition of SULT1A1 (unknown origin) expressed in baculovirus infected Sf9 cel... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 19216563 | 10.1021/jm8013376 | Amyloid-beta precursor protein | 1 |
| 19216563 | 10.1021/jm8013376 | No relevant target | 1 |
Data from ChEMBL 36 via Core Engine