Compound Detail
CHEMBL3038085
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=C/C[C@@H](C)[C@@H](O)[C@H]1C(=O)N[C@@H](CC)C(=O)N(C)[C@H](SCCN(C)C(C)(C)C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](C(C)C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@H](C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N(C)[C@@H](C(C)C)C(=O)N1C
Basic Information
| ChEMBL ID | CHEMBL3038085 |
| Phase | Preclinical |
| Structure Type | BOTH |
| InChI Key | NMTZHGMDHMNRSK-VTNCBTMKSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
1347.9
MW (Da)
Drug Information
| Molecule Type | Protein |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.62
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Human immunodeficiency virus type 1 reverse transcriptase CHEMBL247 | IC50 | 7.62 | 7.62 | 24.0 | 1 |
| Peptidyl-prolyl cis-trans isomerase A CHEMBL1949 | IC50 | 6.56 | 6.56 | 277.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Human immunodeficiency virus type 1 reverse transcriptase | IC50 | = | 24.0 | nM | 7.62 | In vitro inhibitory activity against HIV-1 RT in CEM4 cell line | 14643337 |
| Peptidyl-prolyl cis-trans isomerase A | IC50 | = | 277.0 | nM | 6.56 | Immunosuppressive activity was measured by inhibition of the IL-2 production in ... | 14643337 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 14643337 | 10.1016/j.bmcl.2003.09.042 | Human immunodeficiency virus type 1 reverse transcriptase | 1 |
| 14643337 | 10.1016/j.bmcl.2003.09.042 | Peptidyl-prolyl cis-trans isomerase A | 1 |
Data from ChEMBL 36 via Core Engine