Compound Detail
CHEMBL188144
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Basic Information
| ChEMBL ID | CHEMBL188144 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QBWKAYAFIXQNCU-UHFFFAOYSA-N |
1
Targets
5
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
278.4
MW (Da)
3.79
ALogP
2
HBA
0
HBD
8.2
PSA (Ų)
0.69
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 5 meas. best 8.22
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 6 CHEMBL3371 | Ki | 8.22 | 8.22 | 6.0 | 5 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 6 | Ki | = | 6.0 | nM | 8.22 | Binding affinity against 5-hydroxytryptamine 6 receptor | 15357994 |
| 5-hydroxytryptamine receptor 6 | Ki | = | 6.0 | nM | 8.22 | Binding affinity against h5-HT6 receptor transiently expressed in HEK293 cells | 15990303 |
| 5-hydroxytryptamine receptor 6 | Ki | = | 6.0 | nM | 8.22 | Binding affinity against human 5-Hydroxytryptamine 6 receptor expressed in HEK29... | 15808453 |
| 5-hydroxytryptamine receptor 6 | Ki | = | 6.0 | nM | 8.22 | Displacement of [3H] LSD from human 5HT6 receptor expressed in HEK293 cells | 17239595 |
| 5-hydroxytryptamine receptor 6 | Ki | = | 6.0 | nM | 8.22 | Displacement of [3H]LSD from human 5HT6 receptor expressed in HEK293 cells by li... | 19159187 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 15357994 | 10.1016/j.bmcl.2004.05.076 | 5-hydroxytryptamine receptor 6 | 1 |
| 15990303 | 10.1016/j.bmcl.2005.05.092 | 5-hydroxytryptamine receptor 6 | 1 |
| 15808453 | 10.1016/j.bmcl.2005.02.070 | 5-hydroxytryptamine receptor 6 | 1 |
| 17239595 | 10.1016/j.bmcl.2006.12.089 | 5-hydroxytryptamine receptor 6 | 1 |
| 19159187 | 10.1021/jm8009469 | 5-hydroxytryptamine receptor 6 | 1 |
Data from ChEMBL 36 via Core Engine