Compound Detail
CHEMBL2372650
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](C)NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H]1CCCN1C(=O)[C@@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CO)[C@@H](C)CC)[C@@H](C)O)C(C)C)[C@@H](C)CC)C(N)=O
Basic Information
| ChEMBL ID | CHEMBL2372650 |
| Phase | Preclinical |
| Structure Type | BOTH |
| InChI Key | GBONBLHJMVUBSJ-SAQZUZQPSA-N |
3
Targets
5
Activities
2
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
4757.5
MW (Da)
Drug Information
| Molecule Type | Protein |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 3 meas. best 9.7
Ki 2 meas. best 8.35
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Rattus norvegicus CHEMBL376 | EC50 | 9.7 | 9.7 | 0.2 | 1 |
| Corticotropin-releasing factor receptor 1 CHEMBL1800 | EC50 | 8.46 | 8.46 | 3.5 | 1 |
| Corticotropin-releasing factor receptor 1 CHEMBL1800 | Ki | 8.35 | 8.35 | 4.4 | 1 |
| Corticotropin-releasing factor receptor 2 CHEMBL4069 | Ki | 7.91 | 7.91 | 12.2 | 1 |
| Corticotropin-releasing factor receptor 2 CHEMBL4069 | EC50 | 7.88 | 7.88 | 13.2 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Rattus norvegicus | EC50 | = | 0.2 | nM | 9.7 | effective concentration used to stimulate the secretion of adenocorticotropic ho... | 10794681 |
| Corticotropin-releasing factor receptor 1 | EC50 | = | 3.5 | nM | 8.46 | Activity of peptidic agonists on corticotropin releasing factor receptor using a... | 10794681 |
| Corticotropin-releasing factor receptor 1 | Ki | = | 4.43 | nM | 8.35 | Binding affinity of the receptor corticotropin releasing factor receptor with pe... | 10794681 |
| Corticotropin-releasing factor receptor 2 | Ki | = | 12.2 | nM | 7.91 | Binding affinity of the receptor h-CRF2-alpha with peptidic agonists | 10794681 |
| Corticotropin-releasing factor receptor 2 | EC50 | = | 13.2 | nM | 7.88 | Activity of peptidic agonists on h-CRF2-alpha receptor using agonist-stimulated ... | 10794681 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 10794681 | 10.1021/jm990590f | Corticotropin-releasing factor receptor 1 | 2 |
| 10794681 | 10.1021/jm990590f | Corticotropin-releasing factor receptor 2 | 2 |
| 10794681 | 10.1021/jm990590f | Rattus norvegicus | 1 |
Data from ChEMBL 36 via Core Engine