Compound Detail
CHEMBL269098
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CSCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@@H](N)CC(=O)O)C(=O)NCC(=O)N[C@@H](Cc1cc2ccccc2[nH]1)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Basic Information
| ChEMBL ID | CHEMBL269098 |
| Phase | Preclinical |
| Structure Type | BOTH |
| InChI Key | RBRHXWRGPSTXRX-YRVFCXMDSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
1143.3
MW (Da)
Drug Information
| Molecule Type | Protein |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 10.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Cholecystokinin receptor type A CHEMBL2871 | IC50 | 10.0 | 10.0 | 0.1 | 1 |
| Gastrin/cholecystokinin type B receptor CHEMBL2854 | IC50 | 9.52 | 9.52 | 0.3 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Cholecystokinin receptor type A | IC50 | = | 0.1 | nM | 10.0 | Compound was tested for the inhibition of specific binding of [125I]bolton Hunte... | - |
| Gastrin/cholecystokinin type B receptor | IC50 | = | 0.3 | nM | 9.52 | Compound was tested for the inhibition of specific binding of [125I]bolton Hunte... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/S0960-894X(01)81250-6 | Cholecystokinin receptor type A | 1 |
| - | 10.1016/S0960-894X(01)81250-6 | Gastrin/cholecystokinin type B receptor | 1 |
| - | 10.1016/S0960-894X(01)81250-6 | Cholecystokinin receptor | 1 |
Data from ChEMBL 36 via Core Engine