Compound Detail
CHEMBL210288
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Basic Information
| ChEMBL ID | CHEMBL210288 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | TXCGMRVPXUBHAL-NCELDCMTSA-N |
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
366.3
MW (Da)
5.50
ALogP
2
HBA
0
HBD
32.7
PSA (Ų)
0.59
QED
1
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 3 meas. best 7.77
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Galanin receptor type 3 CHEMBL2731 | Ki | 7.77 | 7.77 | 17.0 | 2 |
| 5-hydroxytryptamine receptor 4 CHEMBL1875 | Ki | 7.14 | 7.14 | 72.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Galanin receptor type 3 | Ki | = | 17.0 | nM | 7.77 | Displacement of [125I]galanin from human GAL3 | 16789730 |
| Galanin receptor type 3 | Ki | = | 17.0 | nM | 7.77 | Displacement of [125I]galanin from human galanin Gal3 receptor | 16730981 |
| 5-hydroxytryptamine receptor 4 | Ki | = | 72.0 | nM | 7.14 | Binding affinity to human 5HT4 | 16789730 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 16789730 | 10.1021/jm060001n | Rattus norvegicus | 4 |
| 16789730 | 10.1021/jm060001n | Plasma | 4 |
| 16789730 | 10.1021/jm060001n | 5-hydroxytryptamine receptor 4 | 3 |
| 16789730 | 10.1021/jm060001n | Galanin receptor type 3 | 1 |
| 16730981 | 10.1016/j.bmcl.2006.05.025 | No relevant target | 1 |
| 16730981 | 10.1016/j.bmcl.2006.05.025 | Galanin receptor type 3 | 1 |
Data from ChEMBL 36 via Core Engine