Trade Names: | |
Synonyms: | |
Status: | Approved (2014) |
Entry Type: | Small molecule |
Molecule Category: | Parent |
ATC: | A10BK01 |
UNII: | 1ULL0QJ8UC |
InChI Key | JVHXJTBJCFBINQ-ADAARDCZSA-N |
---|---|
Smile | |
InChI |
|
Property Name | Value |
---|---|
Molecular Formula | C21H25ClO6 |
Molecular Weight | 408.88 |
AlogP | 1.84 |
Hydrogen Bond Acceptor | 6.0 |
Hydrogen Bond Donor | 4.0 |
Number of Rotational Bond | 6.0 |
Polar Surface Area | 99.38 |
Molecular species | NEUTRAL |
Aromatic Rings | 2.0 |
Heavy Atoms | 28.0 |
Action | Mechanism of Action | Reference |
---|---|---|
INHIBITOR | Sodium/glucose cotransporter 2 inhibitor | DailyMed |
Primary Target | |
---|---|
Sodium/glucose cotransporter 2 |
Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
---|---|---|---|---|---|---|
Transporter
Electrochemical transporter
SLC superfamily of solute carriers
SLC02 family of hexose and sugar alcohol transporters
|
- | - | - | - | 8 | |
Transporter
Electrochemical transporter
SLC superfamily of solute carriers
SLC05 family of sodium-dependent glucose transporters
|
1-3 | 1-3100 | - | - | 70-103 |
Mesh Heading | Maximum Phase | Mesh ID | Reference |
---|---|---|---|
Diabetes Mellitus | 4 | D003920 | ClinicalTrials |
Diabetes Mellitus, Type 2 | 3 | D003924 | ClinicalTrials |
Heart Failure | 3 | D006333 | ClinicalTrials |
Severe Acute Respiratory Syndrome | 3 | D045169 | ClinicalTrials |
Renal Insufficiency, Chronic | 3 | D051436 | ClinicalTrials |
Coronary Disease | 3 | D003327 | ClinicalTrials |
Diabetes Mellitus, Type 1 | 3 | D003922 | ClinicalTrials |
Polycystic Ovary Syndrome | 3 | D011085 | ClinicalTrials |
Non-alcoholic Fatty Liver Disease | 3 | D065626 | ClinicalTrials |
Cystinuria | 2 | D003555 | ClinicalTrials |
Obesity | 2 | D009765 | ClinicalTrials |
Weight Loss | 2 | D015431 | ClinicalTrials |
Hyperuricemia | 2 | D033461 | ClinicalTrials |
Metabolic Syndrome | 2 | D024821 | ClinicalTrials |
Diabetic Nephropathies | 2 | D003928 | ClinicalTrials |
Heart Failure, Diastolic | 2 | D054144 | ClinicalTrials |
Breast Neoplasms | 2 | D001943 | ClinicalTrials |
Aging | 1 | D000375 | ClinicalTrials |
Prostatic Neoplasms | 1 | D011471 | ClinicalTrials |
Pancreatic Neoplasms | 1 | D010190 | ClinicalTrials |
Alzheimer Disease | 1 | D000544 | ClinicalTrials |
Acute Kidney Injury | 0 | D058186 | ClinicalTrials |
Atrial Fibrillation | 0 | D001281 | ClinicalTrials |
Resources | Reference |
---|---|
CAS NUMBER | 461432-26-8 |
ChEBI | 85078 |
ChEMBL | CHEMBL429910 |
DrugBank | DB06292 |
DrugCentral | 4304 |
FDA SRS | 1ULL0QJ8UC |
Guide to Pharmacology | 4594 |
KEGG | D08897 |
PubChem | 9887712 |
SureChEMBL | SCHEMBL157820 |
ZINC | ZINC000003819138 |