Compound Detail
CHEMBL3786667
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 | CHEMBL3786667 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BHSHZTNHTMTQFY-MSIVUJLLSA-N |
4
Targets
7
Activities
2
Assay Types
0
PK Parameters
13
Publications
0
Known Names
Molecular Properties
217.2
MW (Da)
-1.04
ALogP
4
HBA
4
HBD
137.9
PSA (Ų)
0.46
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 5 meas. best 6.89
Ki 2 meas. best 4.89
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Metabotropic glutamate receptor 4 CHEMBL2787 | EC50 | 6.89 | 6.89 | 130.0 | 1 |
| Metabotropic glutamate receptor 6 CHEMBL3842 | EC50 | 6.31 | 6.31 | 490.0 | 1 |
| Metabotropic glutamate receptor 8 CHEMBL2718 | EC50 | 6.17 | 6.17 | 680.0 | 1 |
| Glutamate NMDA receptor CHEMBL1907608 | Ki | 4.89 | 4.89 | 12882.5 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Metabotropic glutamate receptor 4 | EC50 | = | 130.0 | nM | 6.89 | Agonist activity at rat mGlu4 receptor expressed in HEK293 cells assessed as IP1... | 26814576 |
| Metabotropic glutamate receptor 6 | EC50 | = | 490.0 | nM | 6.31 | Agonist activity at rat mGlu6 receptor expressed in HEK293 cells assessed as IP1... | 26814576 |
| Metabotropic glutamate receptor 8 | EC50 | = | 680.0 | nM | 6.17 | Agonist activity at rat mGlu8 receptor expressed in HEK293 cells assessed as IP1... | 26814576 |
| Glutamate NMDA receptor | Ki | = | 13000.0 | nM | 4.89 | Displacement of [3H]CGP from rat synaptosome NMDA receptor after 60 mins by micr... | 26814576 |
| Glutamate NMDA receptor | Ki | = | 12882.5 | nM | 4.89 | Displacement of [3H]CGP from rat synaptosome NMDA receptor after 60 mins by micr... | 26814576 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 26814576 | 10.1021/acs.jmedchem.5b01333 | Metabotropic glutamate receptor 2 | 3 |
| 26814576 | 10.1021/acs.jmedchem.5b01333 | Metabotropic glutamate receptor 3 | 3 |
| 26814576 | 10.1021/acs.jmedchem.5b01333 | Unchecked | 2 |
| 26814576 | 10.1021/acs.jmedchem.5b01333 | Glutamate NMDA receptor | 2 |
| 26814576 | 10.1021/acs.jmedchem.5b01333 | Excitatory amino acid transporter 1 | 2 |
| 26814576 | 10.1021/acs.jmedchem.5b01333 | Excitatory amino acid transporter 2 | 2 |
| 26814576 | 10.1021/acs.jmedchem.5b01333 | Excitatory amino acid transporter 3 | 2 |
| 26814576 | 10.1021/acs.jmedchem.5b01333 | Metabotropic glutamate receptor 1 | 1 |
| 26814576 | 10.1021/acs.jmedchem.5b01333 | Metabotropic glutamate receptor 5 | 1 |
| 26814576 | 10.1021/acs.jmedchem.5b01333 | Metabotropic glutamate receptor 4 | 1 |
| 26814576 | 10.1021/acs.jmedchem.5b01333 | Metabotropic glutamate receptor 6 | 1 |
| 26814576 | 10.1021/acs.jmedchem.5b01333 | Metabotropic glutamate receptor 7 | 1 |
| 26814576 | 10.1021/acs.jmedchem.5b01333 | Metabotropic glutamate receptor 8 | 1 |
Data from ChEMBL 36 via Core Engine