Compound Detail
CHEMBL450121
LEUCOSCEPTOSIDE A Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
COc1cc(/C=C/C(=O)O[C@H]2[C@H](O[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H](OCCc3ccc(O)c(O)c3)O[C@@H]2CO)ccc1O
Basic Information
| ChEMBL ID | CHEMBL450121 |
| Name | LEUCOSCEPTOSIDE A |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZMYQRHSOVRDQDL-CPPDSBOHSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
638.6
MW (Da)
-0.71
ALogP
15
HBA
8
HBD
234.3
PSA (Ų)
0.09
QED
3
Ro5 Violations
11
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.72
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Protein kinase C alpha type CHEMBL299 | IC50 | 4.72 | 4.72 | 19000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Protein kinase C alpha type | IC50 | = | 19000.0 | nM | 4.72 | Inhibition of human recombinant PKCalpha | 9834166 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 17287127 | 10.1016/j.bmc.2007.01.035 | Tyrosinase | 1 |
| 9834166 | 10.1021/np980147s | Protein kinase C alpha type | 1 |
| 10395493 | 10.1021/np980376e | Staphylococcus epidermidis | 1 |
Data from ChEMBL 36 via Core Engine