Compound Detail
CHEMBL4160675
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Basic Information
| ChEMBL ID | CHEMBL4160675 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SDDZGCNKTOUMEI-UHFFFAOYSA-N |
3
Targets
6
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
407.3
MW (Da)
5.17
ALogP
4
HBA
0
HBD
39.4
PSA (Ų)
0.56
QED
1
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 6 meas. best 6.13
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Metabotropic glutamate receptor 7 CHEMBL3879 | EC50 | 6.13 | 6.13 | 740.0 | 2 |
| Metabotropic glutamate receptor 8 CHEMBL2718 | EC50 | 6.05 | 6.05 | 890.0 | 2 |
| Metabotropic glutamate receptor 4 CHEMBL2736 | EC50 | 5.68 | 5.675 | 2100.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Metabotropic glutamate receptor 7 | EC50 | = | 740.0 | nM | 6.13 | Positive allosteric modulation of rat mGlu7 receptor expressed in HEK cells co-e... | 29057060 |
| Metabotropic glutamate receptor 7 | EC50 | = | 741.31 | nM | 6.13 | Positive allosteric modulation of rat mGlu7 receptor expressed in HEK cells co-e... | 29057060 |
| Metabotropic glutamate receptor 8 | EC50 | = | 890.0 | nM | 6.05 | Positive allosteric modulation of rat mGlu8 receptor expressed in HEK cells co-e... | 29057060 |
| Metabotropic glutamate receptor 8 | EC50 | = | 891.25 | nM | 6.05 | Positive allosteric modulation of rat mGlu8 receptor expressed in HEK cells co-e... | 29057060 |
| Metabotropic glutamate receptor 4 | EC50 | = | 2100.0 | nM | 5.68 | Positive allosteric modulation of human mGlu4 receptor expressed in CHO cells co... | 29057060 |
| Metabotropic glutamate receptor 4 | EC50 | = | 2137.96 | nM | 5.67 | Positive allosteric modulation of human mGlu4 receptor expressed in CHO cells co... | 29057060 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 29057060 | 10.1021/acsmedchemlett.7b00317 | Metabotropic glutamate receptor 7 | 3 |
| 29057060 | 10.1021/acsmedchemlett.7b00317 | Metabotropic glutamate receptor 8 | 3 |
| 29057060 | 10.1021/acsmedchemlett.7b00317 | Metabotropic glutamate receptor 4 | 3 |
| 29057060 | 10.1021/acsmedchemlett.7b00317 | ADMET | 2 |
Data from ChEMBL 36 via Core Engine