Compound Detail
CHEMBL285843
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Basic Information
| ChEMBL ID | CHEMBL285843 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DDOQBQRIEWHWBT-UHFFFAOYSA-N |
5
Targets
6
Activities
2
Assay Types
0
PK Parameters
20
Publications
0
Known Names
Molecular Properties
183.1
MW (Da)
-1.03
ALogP
3
HBA
4
HBD
120.8
PSA (Ų)
0.41
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 3 meas. best 6.55
IC50 3 meas. best 8.29
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Metabotropic glutamate receptor 8 CHEMBL3228 | IC50 | 8.29 | 8.29 | 5.1 | 1 |
| Metabotropic glutamate receptor 6 CHEMBL4573 | EC50 | 6.55 | 6.55 | 280.0 | 1 |
| Metabotropic glutamate receptor 4 CHEMBL2736 | EC50 | 6.48 | 6.48 | 330.0 | 1 |
| Metabotropic glutamate receptor 6 CHEMBL3842 | EC50 | 6.0 | 6.0 | 1000.0 | 1 |
| Unchecked CHEMBL612545 | IC50 | 5.0 | 5.0 | 10000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Metabotropic glutamate receptor 8 | IC50 | = | 5.1 | nM | 8.29 | Inhibitory concentration against [3H]1 binding to recombinant human Metabotropic... | 15603952 |
| Metabotropic glutamate receptor 6 | EC50 | = | 280.0 | nM | 6.55 | Compound was tested for the inhibition of Metabotropic glutamate receptor 6 | 9572889 |
| Metabotropic glutamate receptor 4 | EC50 | = | 330.0 | nM | 6.48 | Compound was tested for the inhibition of Metabotropic glutamate receptor 4 | 9572889 |
| Metabotropic glutamate receptor 6 | EC50 | = | 1000.0 | nM | 6.0 | Tested for the agonistic activity against Metabotropic glutamate receptor 6 | - |
| Unchecked | IC50 | = | 10000.0 | nM | 5.0 | Concentration required to inhibit glucosamine-6-phosphate synthase (GFAT) isolat... | 12182877 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.6019/CHEMBL4689842 | HEK-293T | 10 |
| - | 10.6019/CHEMBL4689842 | U2OS | 9 |
| - | 10.6019/CHEMBL4689842 | Fibroblast | 5 |
| - | 10.6019/CHEMBL5209801 | Beta-2 adrenergic receptor | 2 |
| - | 10.6019/CHEMBL5209801 | Free fatty acid receptor 4 | 2 |
| - | 10.6019/CHEMBL5209801 | Glucose-dependent insulinotropic receptor | 2 |
| - | 10.6019/CHEMBL5209801 | Glucagon-like peptide 1 receptor | 2 |
| - | 10.6019/CHEMBL5209801 | G-protein coupled receptor 35 | 2 |
| - | 10.6019/CHEMBL5209801 | Adhesion G-protein coupled receptor F1 | 2 |
| - | 10.6019/CHEMBL5209801 | Apelin receptor | 2 |
| - | 10.6019/CHEMBL5209801 | Alpha-2A adrenergic receptor | 2 |
| - | 10.6019/CHEMBL5209801 | C5a anaphylatoxin chemotactic receptor 1 | 2 |
| 24507924 | 10.1016/j.bmcl.2013.12.114 | Unchecked | 2 |
| - | 10.6019/CHEMBL5209801 | N-formyl peptide receptor 2 | 2 |
| - | 10.6019/CHEMBL5209801 | CX3C chemokine receptor 1 | 2 |
| - | 10.6019/CHEMBL5209801 | Type-1 angiotensin II receptor | 2 |
| - | 10.6019/CHEMBL5209801 | Sphingosine 1-phosphate receptor 1 | 2 |
| - | 10.6019/CHEMBL5060014 | Aurora kinase A | 1 |
| - | 10.6019/CHEMBL5060014 | Tyrosine-protein kinase ABL1 | 1 |
| - | 10.6019/CHEMBL5665443 | Uracil-DNA glycosylase | 1 |
Data from ChEMBL 36 via Core Engine