Compound Detail
CHEMBL148378
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Basic Information
| ChEMBL ID | CHEMBL148378 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QEPQZXDNYIQUHH-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
414.5
MW (Da)
1.83
ALogP
5
HBA
0
HBD
73.8
PSA (Ų)
0.76
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.84
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Lanosterol synthase CHEMBL3593 | IC50 | 6.84 | 6.84 | 143.0 | 1 |
| Lanosterol synthase CHEMBL3262 | IC50 | 6.49 | 6.49 | 326.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Lanosterol synthase | IC50 | = | 143.0 | nM | 6.84 | Compound was tested for its inhibition against human OSC enzyme | 11150166 |
| Lanosterol synthase | IC50 | = | 326.0 | nM | 6.49 | In vitro inhibitory activity of the compound against rat microsomal 2,3-Oxidosqu... | 11150166 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 11150166 | 10.1021/jm000139k | Lanosterol synthase | 2 |
| 11150166 | 10.1021/jm000139k | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine