Compound Detail
CHEMBL2370836
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CC(C)[C@H](NC(=O)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](NC(=O)[C@@H](N)CC(=O)O)C(C)(C)SSC1(C)C)C(=O)O
Basic Information
| ChEMBL ID | CHEMBL2370836 |
| Phase | Preclinical |
| Structure Type | BOTH |
| InChI Key | RTOREIRGIQARBE-IHTALPIPSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
1117.4
MW (Da)
Drug Information
| Molecule Type | Protein |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 8.9
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Urotensin-2 receptor CHEMBL3764 | Ki | 8.9 | 8.9 | 1.3 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Urotensin-2 receptor | Ki | = | 1.259 | nM | 8.9 | Binding affinity towards human Urotensin 2 receptor was determined | 15027856 |
| Urotensin-2 receptor | Ki | = | 1.259 | nM | 8.9 | Ability to displace radioligand [125I]Tyr-hU-II from human recombinant Urotensin... | 12238917 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 12238917 | 10.1021/jm025549i | Urotensin-2 receptor | 2 |
| 15027856 | 10.1021/jm0309912 | Urotensin-2 receptor | 1 |
| 15027856 | 10.1021/jm0309912 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine