Compound Detail
CHEMBL1269426
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Basic Information
| ChEMBL ID | CHEMBL1269426 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QOQLSVLZCVJKQA-UHFFFAOYSA-N |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
240.3
MW (Da)
2.91
ALogP
4
HBA
1
HBD
50.4
PSA (Ų)
0.88
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 7.06
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Tyrosinase CHEMBL3318 | IC50 | 7.06 | 7.06 | 87.0 | 1 |
| Mushroom tyrosinase CHEMBL6066154 | IC50 | 7.06 | 7.06 | 87.0 | 1 |
| RAW264.7 CHEMBL612557 | IC50 | 4.25 | 4.25 | 56870.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Tyrosinase | IC50 | = | 87.0 | nM | 7.06 | Inhibition of mushroom tyrosinase after 20 mins by microplate reader analysis | 20934336 |
| Mushroom tyrosinase | IC50 | = | 87.0 | nM | 7.06 | Inhibition of mushroom Tyrosinase | 37487307 |
| RAW264.7 | IC50 | = | 56870.0 | nM | 4.25 | Antiinflammatory activity in mouse RAW264.7 cells assessed as inhibition of LPS-... | 20934336 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 20934336 | 10.1016/j.bmcl.2010.09.042 | RAW264.7 | 2 |
| 20934336 | 10.1016/j.bmcl.2010.09.042 | Tyrosinase | 1 |
| 37487307 | 10.1016/j.ejmech.2023.115672 | Mushroom tyrosinase | 1 |
Data from ChEMBL 36 via Core Engine