Compound Detail
CHEMBL1201396
FLUTICASONE 🧪 Phase III
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🧪 Phase III
C[C@@H]1C[C@H]2[C@@H]3C[C@H](F)C4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)SCF
Basic Information
| ChEMBL ID | CHEMBL1201396 |
| Name | FLUTICASONE |
| Phase | Phase III |
| Structure Type | MOL |
| InChI Key | MGNNYOODZCAHBA-GQKYHHCASA-N |
1
Targets
1
Activities
1
Assay Types
1
PK Parameters
6
Publications
1
Known Names
5
Indications
Molecular Properties
444.5
MW (Da)
3.47
ALogP
5
HBA
2
HBD
74.6
PSA (Ų)
0.68
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Chirality | Single Enantiomer |
Indications
Asthma Croup Eosinophilic Esophagitis Pulmonary Disease, Chronic Obstructive Diabetes Mellitus
Activity Summary
IC50 1 meas. best 9.82
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glucocorticoid receptor CHEMBL2034 | IC50 | 9.82 | 9.82 | 0.1 | 1 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| F | 1.0 | % | Homo sapiens |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Glucocorticoid receptor | IC50 | = | 0.15 | nM | 9.82 | Glucocorticoid Receptor Competitor Assay: The potency of binding to gucocorticoi... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 16472241 | 10.2174/1570163043334794 | Hepatotoxicity | 18 |
| 22194678 | 10.1371/journal.pcbi.1002310 | Hepatotoxicity | 14 |
| 30351000 | 10.1021/acs.jmedchem.8b00873 | Rattus norvegicus | 2 |
| 17870541 | 10.1016/j.bmc.2007.08.060 | Homo sapiens | 1 |
| 21888439 | 10.1021/jm200677b | No relevant target | 1 |
| 21888439 | 10.1021/jm200677b | Rattus norvegicus | 1 |
Data from ChEMBL 36 via Core Engine