Compound Detail
CHEMBL5399736
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Basic Information
| ChEMBL ID | CHEMBL5399736 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | JHSWXVVKRDPJCD-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
363.1
MW (Da)
0.69
ALogP
1
HBA
0
HBD
9.2
PSA (Ų)
0.58
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 6.58
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| G-protein coupled receptor 3 CHEMBL4523856 | EC50 | 6.58 | 6.58 | 260.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| G-protein coupled receptor 3 | EC50 | = | 260.0 | nM | 6.58 | Agonist activity at human GPR3 expressed in HEK293 cells assessed as increase in... | 37541631 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 37541631 | 10.1016/j.bmcl.2023.129427 | G-protein coupled receptor 3 | 4 |
| 37541631 | 10.1016/j.bmcl.2023.129427 | G-protein coupled receptor 6 | 2 |
| 37541631 | 10.1016/j.bmcl.2023.129427 | G-protein coupled receptor 12 | 1 |
| 37541631 | 10.1016/j.bmcl.2023.129427 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine