Compound Detail
CHEMBL3093792
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Basic Information
| ChEMBL ID | CHEMBL3093792 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RZHHVUDTXZGPLD-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
422.4
MW (Da)
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.41
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Cholinesterase CHEMBL5763 | IC50 | 7.41 | 7.41 | 38.9 | 1 |
| Acetylcholinesterase CHEMBL4078 | IC50 | 6.18 | 6.18 | 657.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Cholinesterase | IC50 | = | 38.88 | nM | 7.41 | Inhibition of equine serum BuChE using butylthiocholine chloride as substrate pr... | 24220172 |
| Acetylcholinesterase | IC50 | = | 657.0 | nM | 6.18 | Inhibition of electric eel AChE using acetylthiocholine chloride as substrate pr... | 24220172 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 24220172 | 10.1016/j.bmcl.2013.10.034 | Unchecked | 1 |
| 24220172 | 10.1016/j.bmcl.2013.10.034 | Cholinesterase | 1 |
| 24220172 | 10.1016/j.bmcl.2013.10.034 | Acetylcholinesterase | 1 |
Data from ChEMBL 36 via Core Engine