Compound Detail
CHEMBL3916935
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Basic Information
| ChEMBL ID | CHEMBL3916935 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SEMJYLPIAVZGGE-HMFYCAOWSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
350.5
MW (Da)
3.97
ALogP
3
HBA
2
HBD
50.4
PSA (Ų)
0.86
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.17
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Sterol O-acyltransferase 2 CHEMBL3879854 | IC50 | 5.17 | 5.17 | 6800.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Sterol O-acyltransferase 2 | IC50 | = | 6800.0 | nM | 5.17 | Inhibition of African green monkey SOAT2 expressed in CHO cells assessed as redu... | 27876317 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 27876317 | 10.1016/j.bmcl.2016.11.008 | Sterol O-acyltransferase 2 | 2 |
| 27876317 | 10.1016/j.bmcl.2016.11.008 | Sterol O-acyltransferase 1 | 2 |
| 27876317 | 10.1016/j.bmcl.2016.11.008 | NON-PROTEIN TARGET | 2 |
| 27876317 | 10.1016/j.bmcl.2016.11.008 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine