Compound Detail
CHEMBL2285758
NEREISTOXIN Enter ChEMBL ID:
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Basic Information
| ChEMBL ID | CHEMBL2285758 |
| Name | NEREISTOXIN |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DSOOGBGKEWZRIH-UHFFFAOYSA-N |
1
Targets
6
Activities
2
Assay Types
0
PK Parameters
11
Publications
0
Known Names
Molecular Properties
149.3
MW (Da)
1.31
ALogP
3
HBA
0
HBD
3.2
PSA (Ų)
0.52
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 4.51
Ki 2 meas.
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 4.51 | 4.51 | 30700.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 30700.0 | nM | 4.51 | Displacement of [3H]PCP from nAChR in Apis mellifera (honeybee0 head homogenates | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1584/jpestics.20.49 | Acetylcholine receptor subunit alpha | 3 |
| - | 10.1584/jpestics.20.57 | Musca domestica | 3 |
| - | 10.1584/jpestics.20.57 | Unchecked | 2 |
| - | 10.1584/jpestics.16.387 | Tetranychus urticae | 1 |
| - | 10.1584/jpestics.16.387 | Chilo suppressalis | 1 |
| - | 10.1584/jpestics.16.397 | Spodoptera litura | 1 |
| - | 10.1584/jpestics.16.397 | Tetranychus urticae | 1 |
| - | 10.1584/jpestics.16.397 | Laodelphax striatellus | 1 |
| - | 10.1584/jpestics.16.397 | Chilo suppressalis | 1 |
| - | 10.1584/jpestics.17.4_231 | Unchecked | 1 |
| - | 10.1584/jpestics.17.4_231 | Nicotinic acetylcholine receptor alpha 5 subunit | 1 |
Data from ChEMBL 36 via Core Engine