Compound Detail
CHEMBL525042
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CO[C@H]1[C@@H](O)[C@H](C)C[C@H](C)/C=C/C=C/C=C(\C)[C@@H](c2c[nH]c3c(C)cccc23)C[C@@H]2CC[C@@H](C)[C@@](O)(O2)C(=O)C(=O)N2CCCC[C@H]2C(=O)O[C@H]([C@H](C)C[C@@H]2CC[C@@H](O)[C@H](OC)C2)C[C@H](O)[C@H](C)/C=C(\C)[C@H]1O
Basic Information
| ChEMBL ID | CHEMBL525042 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PSLNMAUXUJLNBW-OUPLBGLBSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
1
Known Names
Molecular Properties
1017.4
MW (Da)
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 8.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Serine/threonine-protein kinase mTOR CHEMBL2842 | IC50 | 8.0 | 8.0 | 10.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Serine/threonine-protein kinase mTOR | IC50 | = | 10.0 | nM | 8.0 | Inhibition of mTOR kinase expressed in human HEK293 cells by Western blot analys... | 17350953 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 17350953 | 10.1074/jbc.m700498200 | Serine/threonine-protein kinase mTOR | 1 |
| 17128262 | 10.1038/nchembio832 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine