Compound Detail
CHEMBL5271322
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Basic Information
| ChEMBL ID | CHEMBL5271322 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZZZVCVQOGZULAC-AATRIKPKSA-N |
2
Targets
4
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
259.2
MW (Da)
2.12
ALogP
3
HBA
2
HBD
70.2
PSA (Ų)
0.65
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 5.65
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Tyrosinase CHEMBL3318 | IC50 | 5.65 | 5.65 | 2250.0 | 1 |
| Mushroom tyrosinase CHEMBL6066154 | IC50 | 5.65 | 5.1667 | 2250.0 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Tyrosinase | IC50 | = | 2250.0 | nM | 5.65 | Inhibition of mushroom tyrosinase using L-tyrosine as substrate assessed as mono... | 34365131 |
| Mushroom tyrosinase | IC50 | = | 2250.0 | nM | 5.65 | Inhibition of mushroom monophenolase | 36325396 |
| Mushroom tyrosinase | IC50 | = | 11700.0 | nM | 4.93 | Inhibition of mushroom diphenolase | 36325396 |
| Mushroom tyrosinase | IC50 | = | 12000.0 | nM | 4.92 | Inhibition of mushroom Tyrosinase | 37487307 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 36325396 | 10.1039/d2md00175f | Mushroom tyrosinase | 2 |
| 34365131 | 10.1016/j.ejmech.2021.113744 | Tyrosinase | 1 |
| 37487307 | 10.1016/j.ejmech.2023.115672 | Mushroom tyrosinase | 1 |
Data from ChEMBL 36 via Core Engine