Compound Detail
CHEMBL4865838
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
CS(=O)(=O)c1cncc(COc2nc(O[C@H]3CCc4c(-c5cccc6c5CC[C@@H]6Oc5nc(OCc6cncc(S(C)(=O)=O)c6)c(CN6C[C@@H](O)C[C@H]6C(=O)O)cc5Cl)cccc43)c(Cl)cc2CN2C[C@@H](O)C[C@H]2C(=O)O)c1
Basic Information
| ChEMBL ID | CHEMBL4865838 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DQQWLGPJTBOCFK-YSRSYPDWSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
1146.1
MW (Da)
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 10.29
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Programmed cell death protein 1/Programmed cell death 1 ligand 1 CHEMBL4523993 | IC50 | 10.29 | 10.29 | 0.1 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Programmed cell death protein 1/Programmed cell death 1 ligand 1 | IC50 | = | 0.051 | nM | 10.29 | Inhibition of PD1/PD-L1 (unknown origin) | 34481337 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 34481337 | 10.1016/j.bmc.2021.116370 | Programmed cell death protein 1/Programmed cell death 1 ligand 1 | 1 |
Data from ChEMBL 36 via Core Engine