Compound Detail
CHEMBL3655712
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Basic Information
| ChEMBL ID | CHEMBL3655712 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KIFWXWMOJVGFLN-UHFFFAOYSA-N |
1
Targets
2
Activities
2
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
308.6
MW (Da)
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.16
Ki 1 meas. best 6.26
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Thioredoxin reductase CHEMBL3638339 | Ki | 6.26 | 6.26 | 550.0 | 1 |
| Thioredoxin reductase CHEMBL3638339 | IC50 | 5.16 | 5.16 | 7000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Thioredoxin reductase | Ki | = | 550.0 | nM | 6.26 | Inhibition Assay: All the benzisoselenazol-3(2H)-one and bisbenzisoselenazol-3(2... | - |
| Thioredoxin reductase | IC50 | = | 7000.0 | nM | 5.16 | Inhibition Assay: All the benzisoselenazol-3(2H)-one and bisbenzisoselenazol-3(2... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 29894943 | 10.1016/j.ejmech.2018.06.007 | Escherichia coli | 3 |
| 29894943 | 10.1016/j.ejmech.2018.06.007 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine