Compound Detail
CHEMBL394202
COROSOLIC ACID METHYL ESTER Enter ChEMBL ID:
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COC(=O)[C@]12CC[C@@H](C)[C@H](C)[C@H]1C1=CC[C@@H]3[C@@]4(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2
Basic Information
| ChEMBL ID | CHEMBL394202 |
| Name | COROSOLIC ACID METHYL ESTER |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BRZWXKGDPAZBLF-OKUTUCSLSA-N |
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
7
Publications
0
Known Names
Molecular Properties
486.7
MW (Da)
6.15
ALogP
4
HBA
2
HBD
66.8
PSA (Ų)
0.34
QED
1
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 4.47
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glycogen phosphorylase, muscle form CHEMBL4696 | IC50 | 4.47 | 4.47 | 33700.0 | 2 |
| Unchecked CHEMBL612545 | IC50 | 4.47 | 4.47 | 33700.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 33700.0 | nM | 4.47 | Inhibition of rabbit muscle glycogen phosphorylase a | 17869102 |
| Glycogen phosphorylase, muscle form | IC50 | = | 33700.0 | nM | 4.47 | Inhibition of rabbit muscle glycogen phosphorylase A assessed as release of phos... | 21439694 |
| Glycogen phosphorylase, muscle form | IC50 | = | 33884.42 | nM | 4.47 | Inhibition of rabbit muscle glycogen phosphorylase A assessed as release of phos... | 21439694 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18603338 | 10.1016/j.ejmech.2008.05.024 | HT-29 | 8 |
| 18603338 | 10.1016/j.ejmech.2008.05.024 | NON-PROTEIN TARGET | 2 |
| 21439694 | 10.1016/j.ejmech.2011.02.053 | Glycogen phosphorylase, muscle form | 2 |
| 17869102 | 10.1016/j.bmcl.2007.08.057 | Unchecked | 1 |
| 18603338 | 10.1016/j.ejmech.2008.05.024 | Rattus norvegicus | 1 |
| 20100662 | 10.1016/j.bmc.2010.01.010 | 11-beta-hydroxysteroid dehydrogenase 1 | 1 |
| 20100662 | 10.1016/j.bmc.2010.01.010 | 11-beta-hydroxysteroid dehydrogenase type 2 | 1 |
Data from ChEMBL 36 via Core Engine