Compound Detail
CHEMBL56900
LERISETRON 🧪 Phase III
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🧪 Phase III
Basic Information
| ChEMBL ID | CHEMBL56900 |
| Name | LERISETRON |
| Phase | Phase III |
| Structure Type | MOL |
| InChI Key | PWWDCRQZITYKDV-UHFFFAOYSA-N |
2
Targets
4
Activities
1
Assay Types
0
PK Parameters
20
Publications
1
Known Names
1
Indications
Molecular Properties
292.4
MW (Da)
2.49
ALogP
4
HBA
1
HBD
33.1
PSA (Ų)
0.80
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Chirality | Achiral |
Indications
Postoperative Nausea and Vomiting
Activity Summary
Ki 4 meas. best 9.44
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 3A CHEMBL1899 | Ki | 9.44 | 9.44 | 0.4 | 1 |
| Serotonin 3 (5-HT3) receptor CHEMBL2094116 | Ki | 9.21 | 9.2033 | 0.6 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 3A | Ki | = | 0.36 | nM | 9.44 | Binding affinity against human 5-hydroxytryptamine 3A receptor | 11514154 |
| Serotonin 3 (5-HT3) receptor | Ki | = | 0.62 | nM | 9.21 | Binding affinity towards rat 5-hydroxytryptamine 3 receptor was evaluated | 11755351 |
| Serotonin 3 (5-HT3) receptor | Ki | = | 0.631 | nM | 9.2 | In vitro by displacement of [3H]LY-278584 from 5-hydroxytryptamine 3 receptor on... | 9046349 |
| Serotonin 3 (5-HT3) receptor | Ki | = | 0.631 | nM | 9.2 | Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist | 9622544 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.6019/CHEMBL5303304 | Fibroblast | 5 |
| - | 10.6019/CHEMBL5303304 | U2OS | 4 |
| - | 10.6019/CHEMBL4495565 | SARS-CoV-2 | 4 |
| 11514154 | 10.1016/s0960-894x(01)00417-6 | Unchecked | 3 |
| - | 10.6019/CHEMBL4808148 | Histone deacetylase 6 | 2 |
| - | 10.6019/CHEMBL4495564 | Replicase polyprotein 1ab | 2 |
| 11514154 | 10.1016/s0960-894x(01)00417-6 | 5-hydroxytryptamine receptor 3A | 1 |
| - | 10.6019/CHEMBL5665443 | Uracil-DNA glycosylase | 1 |
| - | 10.6019/CHEMBL5665443 | DNA-3-methyladenine glycosylase | 1 |
| - | 10.6019/CHEMBL5665443 | Methyl-CpG-binding domain protein 4 | 1 |
| - | 10.21203/rs.3.rs-23951/v1 | SARS-CoV-2 | 1 |
| 11755351 | 10.1016/s0960-894x(01)00693-x | Serotonin 3 (5-HT3) receptor | 1 |
| 9622544 | 10.1021/jm970745o | Serotonin 3 (5-HT3) receptor | 1 |
| 9046349 | 10.1021/jm960442e | D(2) dopamine receptor | 1 |
| 9046349 | 10.1021/jm960442e | 5-hydroxytryptamine receptor 4 | 1 |
| 9046349 | 10.1021/jm960442e | 5-hydroxytryptamine receptor 2A | 1 |
| 9046349 | 10.1021/jm960442e | 5-hydroxytryptamine receptor 1A | 1 |
| 9046349 | 10.1021/jm960442e | Rattus norvegicus | 1 |
| 9046349 | 10.1021/jm960442e | Serotonin 3 (5-HT3) receptor | 1 |
| 11755351 | 10.1016/s0960-894x(01)00693-x | D(2) dopamine receptor | 1 |
Data from ChEMBL 36 via Core Engine