Compound Detail
CHEMBL4061906
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
CCCCCCCCCCCCCCCC(=O)NC[C@H]1CC[C@H](C(=O)N[C@@H](CCC(=O)NCCCOCCOCCOCCCNC(=O)COCC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NC(C)(Cc2ccccc2)C(=O)N[C@@H](CC(C)C)C(=O)NC(CCCC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCNC(=N)NC)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)O)CC1
Basic Information
| ChEMBL ID | CHEMBL4061906 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | LSYQZQURNCICEV-DEJRTDMUSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
1931.4
MW (Da)
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 9.1
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Neuromedin-U receptor 2 CHEMBL1075144 | EC50 | 9.1 | 9.1 | 0.8 | 1 |
| Neuromedin-U receptor 2 CHEMBL3351217 | EC50 | 8.55 | 8.55 | 2.8 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Neuromedin-U receptor 2 | EC50 | = | 0.8 | nM | 9.1 | Agonist activity at human NMUR2 expressed in CHO cells assessed as increase in i... | 28935264 |
| Neuromedin-U receptor 2 | EC50 | = | 2.8 | nM | 8.55 | Agonist activity at mouse NMUR2 expressed in CHO cells assessed as increase in i... | 28935264 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 28935264 | 10.1016/j.bmcl.2017.09.019 | Mus musculus | 3 |
| 28935264 | 10.1016/j.bmcl.2017.09.019 | Neuromedin-U receptor 1 | 2 |
| 28935264 | 10.1016/j.bmcl.2017.09.019 | Neuromedin-U receptor 2 | 2 |
Data from ChEMBL 36 via Core Engine