Compound Detail
CHEMBL551635
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Basic Information
| ChEMBL ID | CHEMBL551635 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PPWLYNRCVNCXAA-UHFFFAOYSA-N |
2
Targets
4
Activities
2
Assay Types
2
PK Parameters
11
Publications
0
Known Names
Molecular Properties
246.2
MW (Da)
2.48
ALogP
3
HBA
1
HBD
51.2
PSA (Ų)
0.90
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 6.43
IC50 2 meas. best 7.5
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Metabotropic glutamate receptor 4 CHEMBL2736 | IC50 | 7.5 | 7.5 | 31.6 | 2 |
| Metabotropic glutamate receptor 4 CHEMBL2787 | EC50 | 6.43 | 6.43 | 370.0 | 1 |
| Metabotropic glutamate receptor 4 CHEMBL2736 | EC50 | 6.11 | 6.11 | 780.0 | 1 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| Fu | 0.065 | - | Rattus norvegicus |
| Fu | 0.051 | - | Homo sapiens |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Metabotropic glutamate receptor 4 | IC50 | = | 31.6 | nM | 7.5 | Displacement of [3H]N-(4-chloro-3-methoxyphenyl)picolinamide from human mGlu4 re... | 26231155 |
| Metabotropic glutamate receptor 4 | IC50 | = | 31.62 | nM | 7.5 | Displacement of [3H]N-(4-chloro-3-methoxyphenyl)picolinamide from human mGlu4 re... | 26231155 |
| Metabotropic glutamate receptor 4 | EC50 | = | 370.0 | nM | 6.43 | Activity at rat mGluR4 receptor expressed in HEK293 cells assessed as effect on ... | 19469556 |
| Metabotropic glutamate receptor 4 | EC50 | = | 780.0 | nM | 6.11 | Activity at human mGluR4 receptor expressed in CHO cells assessed as effect on c... | 19469556 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 19469556 | 10.1021/jm9005065 | Metabotropic glutamate receptor 4 | 6 |
| 19469556 | 10.1021/jm9005065 | Plasma | 2 |
| 19469556 | 10.1021/jm9005065 | Liver microsomes | 2 |
| 19469556 | 10.1021/jm9005065 | Unchecked | 2 |
| 26231155 | 10.1016/j.bmcl.2015.07.031 | Metabotropic glutamate receptor 4 | 2 |
| 19469556 | 10.1021/jm9005065 | Metabotropic glutamate receptor 3 | 1 |
| 19469556 | 10.1021/jm9005065 | Metabotropic glutamate receptor 8 | 1 |
| 19469556 | 10.1021/jm9005065 | Metabotropic glutamate receptor 7 | 1 |
| 19469556 | 10.1021/jm9005065 | Metabotropic glutamate receptor 5 | 1 |
| 19469556 | 10.1021/jm9005065 | Metabotropic glutamate receptor 2 | 1 |
| 19469556 | 10.1021/jm9005065 | Metabotropic glutamate receptor 1 | 1 |
Data from ChEMBL 36 via Core Engine