Compound Detail
CHEMBL3798768
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(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCCCOCCOCCOCCCNC(=O)COCC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O
Basic Information
| ChEMBL ID | CHEMBL3798768 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | JCKLYCFJKXMTIR-YQCXOBAMSA-N |
5
Targets
8
Activities
3
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
1731.0
MW (Da)
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 7.98
Kd 3 meas. best 7.8
EC50 2 meas. best 6.25
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Melanocortin receptor 4 CHEMBL3719 | IC50 | 7.98 | 7.98 | 10.4 | 1 |
| Melanocortin receptor 4 CHEMBL259 | Kd | 7.8 | 7.8 | 15.8 | 1 |
| Melanocortin receptor 4 CHEMBL3719 | Kd | 7.68 | 7.68 | 20.9 | 1 |
| Melanocortin receptor 3 CHEMBL4774 | IC50 | 6.46 | 6.46 | 350.0 | 1 |
| Melanocyte-stimulating hormone receptor CHEMBL4077 | IC50 | 6.37 | 6.37 | 430.0 | 1 |
| Melanocyte-stimulating hormone receptor CHEMBL4077 | EC50 | 6.25 | 6.25 | 563.0 | 1 |
| Melanocortin receptor 5 CHEMBL4489 | EC50 | 6.11 | 6.11 | 786.0 | 1 |
| Melanocortin receptor 3 CHEMBL4774 | Kd | 6.08 | 6.08 | 831.8 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 29669202 | 10.1021/acs.jmedchem.8b00238 | Melanocortin receptor 4 | 5 |
| 26959173 | 10.1021/acs.jmedchem.5b01894 | Melanocyte-stimulating hormone receptor | 4 |
| 26959173 | 10.1021/acs.jmedchem.5b01894 | Melanocortin receptor 3 | 4 |
| 26959173 | 10.1021/acs.jmedchem.5b01894 | Melanocortin receptor 4 | 4 |
| 26959173 | 10.1021/acs.jmedchem.5b01894 | Melanocortin receptor 5 | 1 |
Data from ChEMBL 36 via Core Engine