Compound Detail
CHEMBL236989
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Basic Information
| ChEMBL ID | CHEMBL236989 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FSQBPWLJULPEEW-UHFFFAOYSA-N |
1
Targets
3
Activities
2
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
340.9
MW (Da)
3.09
ALogP
5
HBA
1
HBD
65.1
PSA (Ų)
0.79
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 8.22
EC50 1 meas. best 6.74
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 6 CHEMBL3371 | Ki | 8.22 | 8.22 | 6.0 | 2 |
| 5-hydroxytryptamine receptor 6 CHEMBL3371 | EC50 | 6.74 | 6.74 | 181.0 | 1 |
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 | Displacement of [3H]LSD from human 5HT6 receptor expressed in HeLa cells | 17948978 |
| 5-hydroxytryptamine receptor 6 | Ki | = | 6.0 | nM | 8.22 | Displacement of [3H]lysergic acid diethylamide from human 5-HT6 receptor express... | 26099069 |
| 5-hydroxytryptamine receptor 6 | EC50 | = | 181.0 | nM | 6.74 | Agonist activity at human 5HT6 receptor expressed in HeLa cells assessed as cAMP... | 17948978 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 17948978 | 10.1021/jm070521y | 5-hydroxytryptamine receptor 6 | 3 |
| 26099069 | 10.1021/acs.jmedchem.5b00179 | 5-hydroxytryptamine receptor 6 | 1 |
Data from ChEMBL 36 via Core Engine