Compound Detail
CHEMBL4455811
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Basic Information
| ChEMBL ID | CHEMBL4455811 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | UALMQFYDPGPLIO-VQHVLOKHSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
255.3
MW (Da)
2.75
ALogP
3
HBA
3
HBD
69.6
PSA (Ų)
0.74
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.59
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Tyrosinase CHEMBL3318 | IC50 | 7.59 | 7.59 | 25.6 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Tyrosinase | IC50 | = | 25.6 | nM | 7.59 | Inhibition of mushroom tyrosinase using L-tyrosine as substrate incubated for 30... | 30347330 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 30347330 | 10.1016/j.ejmech.2018.10.025 | Tyrosinase | 6 |
| 30347330 | 10.1016/j.ejmech.2018.10.025 | B16-F10 | 3 |
| 30347330 | 10.1016/j.ejmech.2018.10.025 | No relevant target | 1 |
| 31376564 | 10.1016/j.ejmech.2019.07.064 | Tyrosinase | 1 |
Data from ChEMBL 36 via Core Engine