Compound Detail
CHEMBL4209396
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
C[C@H]1[C@H](OC(=O)CCC(=O)NCCCN(CCCCCCCCCCN(CCCNC(=O)CCC(=O)O[C@@H]2O[C@@H]3O[C@@]4(C)CC[C@H]5[C@H](C)CC[C@@H]([C@H]2C)[C@@]35OO4)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)O[C@@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@@H]1[C@@]24OO3
Basic Information
| ChEMBL ID | CHEMBL4209396 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | MPOMLGYUWNBSEI-AWRFTPDUSA-N |
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
1219.6
MW (Da)
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 9.1
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Plasmodium falciparum CHEMBL364 | IC50 | 9.1 | 9.1 | 0.8 | 2 |
| L6 CHEMBL614793 | IC50 | 6.3 | 6.3 | 500.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Plasmodium falciparum | IC50 | = | 0.8 | nM | 9.1 | Antiplasmodial activity against chloroquine sensitive Plasmodium falciparum NF54... | 28988153 |
| Plasmodium falciparum | IC50 | = | 0.8 | nM | 9.1 | Antiplasmodial activity against chloroquine and pyrimethamine resistant Plasmodi... | 28988153 |
| L6 | IC50 | = | 500.0 | nM | 6.3 | Cytotoxicity in rat L6 cells assessed as reduction in cell viability incubated f... | 28988153 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 28988153 | 10.1016/j.ejmech.2017.09.040 | Plasmodium falciparum | 2 |
| 28988153 | 10.1016/j.ejmech.2017.09.040 | L6 | 1 |
| 28988153 | 10.1016/j.ejmech.2017.09.040 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine