Compound Detail
CHEMBL3314375
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CC(=O)Oc1c(OC(C)=O)c(-c2ccc(O[Si](C)(C)C(C)(C)C)cc2)c2c(c1-c1ccc(O[Si](C)(C)C(C)(C)C)cc1)OC(OC(C)=O)O2
Basic Information
| ChEMBL ID | CHEMBL3314375 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VUSUWMQIHXYSSU-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
709.0
MW (Da)
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.46
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Prolyl endopeptidase CHEMBL3202 | IC50 | 5.46 | 5.46 | 3500.0 | 1 |
| NON-PROTEIN TARGET CHEMBL3879801 | IC50 | 5.38 | 5.38 | 4200.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Prolyl endopeptidase | IC50 | = | 3500.0 | nM | 5.46 | Inhibition of prolyl oligopeptidase (unknown origin) | 24948566 |
| NON-PROTEIN TARGET | IC50 | = | 4200.0 | nM | 5.38 | Cytotoxicity against human HL60 cells after 48 hrs by MTT assay | 24948566 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 24948566 | 10.1016/j.bmcl.2014.05.091 | NON-PROTEIN TARGET | 1 |
| 24948566 | 10.1016/j.bmcl.2014.05.091 | Prolyl endopeptidase | 1 |
Data from ChEMBL 36 via Core Engine