Compound Detail
CHEMBL5592269
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CC(C)C[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H]2CCCN2C(=O)[C@H](C(C)C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H]2CSSC[C@H](NC1=O)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N2
Basic Information
| ChEMBL ID | CHEMBL5592269 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RHYJZGGFHWTVOJ-GUGUQBAMSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
1946.4
MW (Da)
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.43
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| ICOS-ICOSL CHEMBL5482971 | IC50 | 5.43 | 5.43 | 3680.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| ICOS-ICOSL | IC50 | = | 3680.0 | nM | 5.43 | Inhibition of ICOS/ICOSL (unknown origin) interaction by TR-FRET assay | 38185345 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 38185345 | 10.1016/j.bmcl.2024.129599 | ICOS-ICOSL | 2 |
Data from ChEMBL 36 via Core Engine