Compound Detail
CHEMBL3350882
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C[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC(N)=O)CSSC[C@@H](C(=O)O)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O
Basic Information
| ChEMBL ID | CHEMBL3350882 |
| Phase | Preclinical |
| Structure Type | BOTH |
| InChI Key | AUSJXPHBBAYKTR-HFEZEVQOSA-N |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
1209.4
MW (Da)
Drug Information
| Molecule Type | Protein |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 8.62
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Somatostatin receptor type 4 CHEMBL1853 | IC50 | 8.62 | 8.62 | 2.4 | 1 |
| Somatostatin receptor type 2 CHEMBL1804 | IC50 | 6.16 | 6.16 | 700.0 | 1 |
| Somatostatin receptor type 3 CHEMBL2028 | IC50 | 6.01 | 6.01 | 980.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Somatostatin receptor type 4 | IC50 | = | 2.4 | nM | 8.62 | Binding affinity towards human somatostatin receptor type 4 using [125I][Leu8,D-... | 14667214 |
| Somatostatin receptor type 2 | IC50 | = | 700.0 | nM | 6.16 | Binding affinity towards human somatostatin receptor type 2 using [125I][Leu8,D-... | 14667214 |
| Somatostatin receptor type 3 | IC50 | = | 980.0 | nM | 6.01 | 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