Compound Detail
CHEMBL85398
THIAZOLIDINEDIONE 🧪 Phase III
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🧪 Phase III
Basic Information
| ChEMBL ID | CHEMBL85398 |
| Name | THIAZOLIDINEDIONE |
| Phase | Phase III |
| Structure Type | MOL |
| InChI Key | ZOBPZXTWZATXDG-UHFFFAOYSA-N |
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
16
Publications
3
Known Names
5
Indications
Molecular Properties
117.1
MW (Da)
-0.03
ALogP
3
HBA
1
HBD
46.2
PSA (Ų)
0.48
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Chirality | Achiral |
Indications
Coronary Disease Diabetes Mellitus Diabetes Mellitus, Type 2 Insulin Resistance Diabetes Mellitus, Type 1
Activity Summary
IC50 3 meas. best 6.27
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Alpha glucosidase CHEMBL3833502 | IC50 | 6.27 | 6.27 | 540.0 | 1 |
| Glycogen synthase kinase-3 CHEMBL2095188 | IC50 | 4.0 | 4.0 | 100000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Alpha glucosidase | IC50 | = | 540.0 | nM | 6.27 | Inhibition of alpha-glucosidase (unknown origin) | 31112894 |
| Glycogen synthase kinase-3 | IC50 | = | 100000.0 | nM | 4.0 | Inhibition of rabbit GSK3 | 16279768 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 22077389 | 10.1021/jm201243p | Unchecked | 3 |
| 37399710 | 10.1016/j.ejmech.2023.115604 | Unchecked | 2 |
| 12852958 | 10.1016/s0960-894x(03)00484-0 | Unchecked | 1 |
| 16279768 | 10.1021/jm040895g | Glycogen synthase kinase-3 | 1 |
| 19027993 | 10.1016/j.ejmech.2008.10.006 | Staphylococcus aureus | 1 |
| 19027993 | 10.1016/j.ejmech.2008.10.006 | Bacillus subtilis | 1 |
| 19027993 | 10.1016/j.ejmech.2008.10.006 | Micrococcus luteus | 1 |
| 19027993 | 10.1016/j.ejmech.2008.10.006 | Enterococcus faecalis | 1 |
| 19027993 | 10.1016/j.ejmech.2008.10.006 | Pseudomonas aeruginosa | 1 |
| 19027993 | 10.1016/j.ejmech.2008.10.006 | Escherichia coli | 1 |
| 19027993 | 10.1016/j.ejmech.2008.10.006 | Serratia marcescens | 1 |
| 19027993 | 10.1016/j.ejmech.2008.10.006 | Mycolicibacterium smegmatis | 1 |
| 19027993 | 10.1016/j.ejmech.2008.10.006 | Candida albicans | 1 |
| 22077389 | 10.1021/jm201243p | Prothrombin | 1 |
| 23419324 | 10.1016/j.bmc.2013.01.029 | No relevant target | 1 |
| 31112894 | 10.1016/j.ejmech.2019.04.025 | Alpha glucosidase | 1 |
Data from ChEMBL 36 via Core Engine