Compound Detail
CHEMBL350966
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Basic Information
| ChEMBL ID | CHEMBL350966 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WZUODJNEIXSNEU-UHFFFAOYSA-N |
3
Targets
5
Activities
1
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
152.2
MW (Da)
1.21
ALogP
3
HBA
1
HBD
46.5
PSA (Ų)
0.65
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 5 meas. best 6.66
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Transcription intermediary factor 1-alpha CHEMBL3108638 | IC50 | 6.66 | 6.66 | 219.7 | 1 |
| E3 ubiquitin-protein ligase TRIM33 CHEMBL2176772 | IC50 | 6.52 | 6.52 | 300.6 | 1 |
| Tyrosinase CHEMBL1973 | IC50 | 4.52 | 4.52 | 30000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Transcription intermediary factor 1-alpha | IC50 | = | 219.7 | nM | 6.66 | Inhibition of recombinant TRIM24 (unknown origin) using biotinylated H3 peptide ... | - |
| E3 ubiquitin-protein ligase TRIM33 | IC50 | = | 300.6 | nM | 6.52 | Inhibition of recombinant TRIM33 PHD bromodomain (unknown origin) using biotinyl... | - |
| Tyrosinase | IC50 | = | 30000.0 | nM | 4.52 | Inhibitory activity was evaluated against the oxidation of L-3,4-dihydroxyphenyl... | 14741268 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 26986086 | 10.1016/j.ejmech.2016.03.008 | Unchecked | 21 |
| 17258462 | 10.1016/j.bmc.2006.12.038 | Unchecked | 2 |
| 14741268 | 10.1016/j.bmcl.2003.11.033 | Tyrosinase | 1 |
| 17507232 | 10.1016/j.bmc.2007.05.011 | ADMET | 1 |
| 17507232 | 10.1016/j.bmc.2007.05.011 | Unchecked | 1 |
| 26986086 | 10.1016/j.ejmech.2016.03.008 | No relevant target | 1 |
Data from ChEMBL 36 via Core Engine