Compound Detail
CHEMBL2151442
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Basic Information
| ChEMBL ID | CHEMBL2151442 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WIEWCOLOPGXZDJ-UHFFFAOYSA-N |
3
Targets
3
Activities
2
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
202.3
MW (Da)
2.63
ALogP
2
HBA
0
HBD
16.1
PSA (Ų)
0.70
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 7.96
EC50 1 meas. best 6.36
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Neuronal acetylcholine receptor subunit alpha-7 CHEMBL4980 | Ki | 7.96 | 7.96 | 11.0 | 1 |
| Unchecked CHEMBL612545 | Ki | 7.96 | 7.96 | 11.0 | 1 |
| Neuronal acetylcholine receptor subunit alpha-7 CHEMBL2492 | EC50 | 6.36 | 6.36 | 440.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Neuronal acetylcholine receptor subunit alpha-7 | Ki | = | 11.0 | nM | 7.96 | Binding affinity to alpha7 nAChR in rat hippocampal membranes | 21919481 |
| Unchecked | Ki | = | 11.0 | nM | 7.96 | Displacement of [3H]methyllycaconitine from Sprague-Dawley rat brain alpha7* nAC... | 26840365 |
| Neuronal acetylcholine receptor subunit alpha-7 | EC50 | = | 440.0 | nM | 6.36 | Agonist activity at human alpha7 nAChR expressed in Xenopus oocyte | 21919481 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 21919481 | 10.1021/jm2007672 | Neuronal acetylcholine receptor subunit alpha-7 | 3 |
| 21919481 | 10.1021/jm2007672 | 5-hydroxytryptamine receptor 3A | 1 |
| 26840365 | 10.1016/j.ejmech.2016.01.025 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine