Compound Detail
CHEMBL3357574
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Basic Information
| ChEMBL ID | CHEMBL3357574 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | HDLABPAQQVOWQC-UHFFFAOYSA-N |
2
Targets
4
Activities
2
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
395.8
MW (Da)
3.93
ALogP
4
HBA
1
HBD
79.4
PSA (Ų)
0.68
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 8.29
EC50 1 meas. best 7.3
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Metabotropic glutamate receptor 4 CHEMBL2787 | IC50 | 8.29 | 8.29 | 5.1 | 2 |
| Metabotropic glutamate receptor 4 CHEMBL2736 | IC50 | 7.44 | 7.44 | 36.0 | 1 |
| Metabotropic glutamate receptor 4 CHEMBL2736 | EC50 | 7.3 | 7.3 | 50.4 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Metabotropic glutamate receptor 4 | IC50 | = | 5.1 | nM | 8.29 | Displacement of [3H]ML128 from rat mGlu4 receptor expressed in CHO cells after 3... | 25330258 |
| Metabotropic glutamate receptor 4 | IC50 | = | 5.129 | nM | 8.29 | Displacement of [3H]ML128 from rat mGlu4 receptor expressed in CHO cells after 3... | 25330258 |
| Metabotropic glutamate receptor 4 | IC50 | = | 36.0 | nM | 7.44 | Displacement of [3H]-N-(4-{[(2- Chlorophenyl)amino]sulfonyl} phenyl )pyridine-2-... | 25330258 |
| Metabotropic glutamate receptor 4 | EC50 | = | 50.4 | nM | 7.3 | Displacement of [3H]-N-(4-{[(2- Chlorophenyl)amino]sulfonyl} phenyl )pyridine-2-... | 25330258 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 25330258 | 10.1021/jm501245b | Metabotropic glutamate receptor 4 | 5 |
| 25330258 | 10.1021/jm501245b | Metabotropic glutamate receptor 1 | 1 |
| 25330258 | 10.1021/jm501245b | Metabotropic glutamate receptor 5 | 1 |
| 25330258 | 10.1021/jm501245b | Metabotropic glutamate receptor 8 | 1 |
Data from ChEMBL 36 via Core Engine