Compound Detail
CHEMBL327783
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Basic Information
| ChEMBL ID | CHEMBL327783 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FXCTZFMSAHZQTR-KAMYIIQDSA-N |
1
Targets
4
Activities
2
Assay Types
0
PK Parameters
13
Publications
0
Known Names
Molecular Properties
247.2
MW (Da)
1.58
ALogP
5
HBA
1
HBD
68.1
PSA (Ų)
0.49
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 5.47
Ki 1 meas. best 5.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Metabotropic glutamate receptor 1 CHEMBL3772 | IC50 | 5.47 | 5.0967 | 3400.0 | 3 |
| Metabotropic glutamate receptor 1 CHEMBL3772 | Ki | 5.0 | 5.0 | 9900.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Metabotropic glutamate receptor 1 | IC50 | = | 3400.0 | nM | 5.47 | Inhibition of Quisqualate-Induced PI Hydrolysis measured in CHO Metabotropic glu... | 11087567 |
| Metabotropic glutamate receptor 1 | IC50 | = | 6600.0 | nM | 5.18 | Antagonist activity at human mGlu1b receptor | 17489573 |
| Metabotropic glutamate receptor 1 | Ki | = | 9900.0 | nM | 5.0 | Agonist potency against cloned human metabotropic glutamate receptor 1 | 10893301 |
| Metabotropic glutamate receptor 1 | IC50 | = | 23000.0 | nM | 4.64 | Compound was tested for inhibition of glutamate-evoked (10 uM) [Ca2+] mobilizati... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.6019/CHEMBL4495565 | SARS-CoV-2 | 2 |
| - | 10.6019/CHEMBL4808148 | Histone deacetylase 6 | 2 |
| 11087567 | 10.1021/jm0009944 | Metabotropic glutamate receptor 1 | 1 |
| 10893301 | 10.1021/jm000007r | Metabotropic glutamate receptor 1 | 1 |
| 10893301 | 10.1021/jm000007r | Metabotropic glutamate receptor 2 | 1 |
| 10893301 | 10.1021/jm000007r | Metabotropic glutamate receptor 4 | 1 |
| 10893301 | 10.1021/jm000007r | Metabotropic glutamate receptor 5 | 1 |
| 10893301 | 10.1021/jm000007r | Metabotropic glutamate receptor 7 | 1 |
| 10893301 | 10.1021/jm000007r | Metabotropic glutamate receptor 8 | 1 |
| - | 10.1016/0960-894X(96)00104-7 | Metabotropic glutamate receptor 1 | 1 |
| 17489573 | 10.1021/jm060950g | Metabotropic glutamate receptor 1 | 1 |
| - | 10.21203/rs.3.rs-23951/v1 | SARS-CoV-2 | 1 |
| - | 10.6019/CHEMBL4495564 | Replicase polyprotein 1ab | 1 |
Data from ChEMBL 36 via Core Engine