Compound Detail
CHEMBL2152055
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CNC(=N)NCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Basic Information
| ChEMBL ID | CHEMBL2152055 |
| Phase | Preclinical |
| Structure Type | BOTH |
| InChI Key | YZXVMOOMKNHPNU-IPHVNIDGSA-N |
1
Targets
1
Activities
1
Assay Types
1
PK Parameters
3
Publications
0
Known Names
Molecular Properties
1316.5
MW (Da)
Drug Information
| Molecule Type | Protein |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 10.64
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| KiSS-1 receptor CHEMBL5413 | EC50 | 10.64 | 10.64 | 0.0 | 1 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| T1/2 | 0.03 | hr | Mus musculus |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| KiSS-1 receptor | EC50 | = | 0.023 | nM | 10.64 | Agonist activity at human OT7T175 assessed as increase in intracellular calcium ... | 22995619 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 22995619 | 10.1016/j.bmcl.2012.08.087 | Serum | 2 |
| 22995619 | 10.1016/j.bmcl.2012.08.087 | KiSS-1 receptor | 2 |
| 22995619 | 10.1016/j.bmcl.2012.08.087 | No relevant target | 1 |
Data from ChEMBL 36 via Core Engine