Compound Detail
CHEMBL215418
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
Basic Information
| ChEMBL ID | CHEMBL215418 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | IEJFFMAPQSUQIU-UHFFFAOYSA-N |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
551.5
MW (Da)
6.33
ALogP
4
HBA
3
HBD
82.7
PSA (Ų)
0.31
QED
2
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 8.3
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Melanin-concentrating hormone receptor 1 CHEMBL1075228 | IC50 | 8.3 | 8.3 | 5.0 | 1 |
| Melanin-concentrating hormone receptor 1 CHEMBL344 | IC50 | 7.96 | 7.96 | 11.0 | 1 |
| Melanin-concentrating hormone receptor 1 CHEMBL4730 | IC50 | 7.55 | 7.55 | 28.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Melanin-concentrating hormone receptor 1 | IC50 | = | 5.0 | nM | 8.3 | Inhibition of [125I]MCH binding to rat MCHR1 expressed in HEK293 cells by HT-SPA | 16887348 |
| Melanin-concentrating hormone receptor 1 | IC50 | = | 11.0 | nM | 7.96 | Inhibition of [125I]MCH binding to human MCHR1 expressed in HEK293 cells by HT-S... | 16887348 |
| Melanin-concentrating hormone receptor 1 | IC50 | = | 28.0 | nM | 7.55 | Inhibition of [125I]MCH binding to mouse MCHR1 expressed in HEK293 cells by HT-S... | 16887348 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 16887348 | 10.1016/j.bmcl.2006.07.040 | Melanin-concentrating hormone receptor 1 | 3 |
Data from ChEMBL 36 via Core Engine