Compound Detail
CHEMBL55068
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Basic Information
| ChEMBL ID | CHEMBL55068 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZDHCZVWCTKTBRY-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
216.3
MW (Da)
2.96
ALogP
2
HBA
2
HBD
57.5
PSA (Ų)
0.52
QED
0
Ro5 Violations
11
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 4.68
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| G-protein coupled receptor 84 CHEMBL3714079 | EC50 | 4.68 | 4.68 | 20893.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| G-protein coupled receptor 84 | EC50 | = | 20892.96 | nM | 4.68 | Agonist activity at N-terminal FLAG-tagged/C-terminal eYFP-fused human GPR84 exp... | 30108848 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 31721581 | 10.1021/acs.jmedchem.9b01339 | G-protein coupled receptor 84 | 6 |
| 1829486 | 10.1021/jm00110a020 | Oryctolagus cuniculus | 1 |
| 30108848 | 10.1039/C7MD00130D | G-protein coupled receptor 84 | 1 |
| 30108848 | 10.1039/C7MD00130D | Free fatty acid receptor 4 | 1 |
| 30108848 | 10.1039/C7MD00130D | Free fatty acid receptor 1 | 1 |
Data from ChEMBL 36 via Core Engine