Compound Detail
CHEMBL3350885
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C[C@H](c1c[nH]c2ccccc12)[C@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)O)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CCCCN)NC1=O
Basic Information
| ChEMBL ID | CHEMBL3350885 |
| Phase | Preclinical |
| Structure Type | BOTH |
| InChI Key | YPLMANLAHPOVGA-VGLAWRBQSA-N |
5
Targets
5
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
1093.3
MW (Da)
Drug Information
| Molecule Type | Protein |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 5 meas. best 8.4
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Somatostatin receptor type 4 CHEMBL1853 | IC50 | 8.4 | 8.4 | 4.0 | 1 |
| Somatostatin receptor type 2 CHEMBL1804 | IC50 | 7.4 | 7.4 | 40.0 | 1 |
| Somatostatin receptor type 5 CHEMBL1792 | IC50 | 7.38 | 7.38 | 42.0 | 1 |
| Somatostatin receptor type 1 CHEMBL1917 | IC50 | 7.31 | 7.31 | 49.0 | 1 |
| Somatostatin receptor type 3 CHEMBL2028 | IC50 | 7.28 | 7.28 | 53.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Somatostatin receptor type 4 | IC50 | = | 4.0 | nM | 8.4 | Binding affinity towards human somatostatin receptor type 4 using [125I][Leu8,D-... | 14667214 |
| Somatostatin receptor type 2 | IC50 | = | 40.0 | nM | 7.4 | Binding affinity towards human somatostatin receptor type 2 using [125I][Leu8,D-... | 14667214 |
| Somatostatin receptor type 5 | IC50 | = | 42.0 | nM | 7.38 | Binding affinity towards human somatostatin receptor type 5 using [125I][Leu8,D-... | 14667214 |
| Somatostatin receptor type 1 | IC50 | = | 49.0 | nM | 7.31 | Binding affinity towards human somatostatin receptor type 1 using [125I][Leu8,D-... | 14667214 |
| Somatostatin receptor type 3 | IC50 | = | 53.0 | nM | 7.28 | Binding affinity towards human somatostatin receptor type 3 using [125I][Leu8,D-... | 14667214 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 14667214 | 10.1021/jm030245x | Somatostatin receptor type 1 | 1 |
| 14667214 | 10.1021/jm030245x | Somatostatin receptor type 2 | 1 |
| 14667214 | 10.1021/jm030245x | Somatostatin receptor type 3 | 1 |
| 14667214 | 10.1021/jm030245x | Somatostatin receptor type 4 | 1 |
| 14667214 | 10.1021/jm030245x | Somatostatin receptor type 5 | 1 |
Data from ChEMBL 36 via Core Engine