Compound Detail
CHEMBL143197
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Basic Information
| ChEMBL ID | CHEMBL143197 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NVYPANNIKFKQTB-UHFFFAOYSA-N |
2
Targets
4
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
298.3
MW (Da)
1.94
ALogP
4
HBA
1
HBD
57.9
PSA (Ų)
0.68
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Kd 4 meas. best 11.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Serotonin 3 (5-HT3) receptor CHEMBL2094132 | Kd | 11.0 | 10.1333 | 0.0 | 3 |
| 5-hydroxytryptamine receptor 4 CHEMBL5017 | Kd | 6.3 | 6.3 | 501.2 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Serotonin 3 (5-HT3) receptor | Kd | = | 0.01 | nM | 11.0 | Evaluated for the antagonistic activity against 5-hydroxytryptamine 3 receptor i... | - |
| Serotonin 3 (5-HT3) receptor | Kd | = | 0.02512 | nM | 10.6 | Evaluated for the antagonistic activity against 5-hydroxytryptamine 3 receptor i... | - |
| Serotonin 3 (5-HT3) receptor | Kd | = | 1.585 | nM | 8.8 | Antagonistic activity against Serotonin 5-hydroxytryptamine 3 receptor of isolat... | - |
| 5-hydroxytryptamine receptor 4 | Kd | = | 501.19 | nM | 6.3 | Evaluated for the antagonistic activity against Serotonin 5-hydroxytryptamine 4 ... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/S0960-894X(00)80170-5 | Serotonin 3 (5-HT3) receptor | 3 |
| - | 10.1016/S0960-894X(00)80170-5 | 5-hydroxytryptamine receptor 4 | 2 |
| - | 10.1016/S0960-894X(00)80170-5 | Serotonin 3 receptor (5HT3) | 1 |
| - | 10.1016/S0960-894X(00)80170-5 | No relevant target | 1 |
Data from ChEMBL 36 via Core Engine