Compound Detail
CHEMBL4538274
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)[C@@H]1NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O
Basic Information
| ChEMBL ID | CHEMBL4538274 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | LPATVOINCAVXRL-NTBYCYSFSA-N |
5
Targets
9
Activities
2
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
1005.2
MW (Da)
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 5 meas. best 7.42
Kd 4 meas. best 7.8
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Melanocortin receptor 4 CHEMBL259 | Kd | 7.8 | 7.8 | 15.8 | 1 |
| Melanocortin receptor 4 CHEMBL3719 | IC50 | 7.42 | 7.42 | 38.0 | 1 |
| Melanocortin receptor 4 CHEMBL3719 | Kd | 7.2 | 7.2 | 63.1 | 1 |
| Melanocortin receptor 4 CHEMBL259 | IC50 | 6.6 | 6.6 | 250.0 | 1 |
| Melanocortin receptor 5 CHEMBL4489 | Kd | 6.1 | 6.1 | 794.3 | 1 |
| Melanocortin receptor 3 CHEMBL4774 | Kd | 5.9 | 5.9 | 1258.9 | 1 |
| Melanocyte-stimulating hormone receptor CHEMBL4077 | IC50 | 4.82 | 4.82 | 15000.0 | 1 |
| Melanocortin receptor 5 CHEMBL4489 | IC50 | 4.54 | 4.54 | 29000.0 | 1 |
| Melanocortin receptor 3 CHEMBL4774 | IC50 | 4.28 | 4.28 | 53000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 31845801 | 10.1021/acs.jmedchem.9b00860 | Melanocortin receptor 4 | 8 |
| 31845801 | 10.1021/acs.jmedchem.9b00860 | Melanocortin receptor 3 | 4 |
| 31845801 | 10.1021/acs.jmedchem.9b00860 | Melanocortin receptor 5 | 4 |
| 31845801 | 10.1021/acs.jmedchem.9b00860 | Melanocyte-stimulating hormone receptor | 3 |
Data from ChEMBL 36 via Core Engine