Compound Detail
CHEMBL2153293
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Basic Information
| ChEMBL ID | CHEMBL2153293 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QOEOFYFNXKCGDY-UHFFFAOYSA-N |
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
7
Publications
0
Known Names
Molecular Properties
334.8
MW (Da)
5.79
ALogP
3
HBA
1
HBD
34.1
PSA (Ų)
0.48
QED
1
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 3 meas. best 6.27
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| NON-PROTEIN TARGET CHEMBL3879801 | EC50 | 6.27 | 6.27 | 540.0 | 1 |
| HT-22 CHEMBL614316 | EC50 | 6.27 | 5.55 | 540.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| NON-PROTEIN TARGET | EC50 | = | 540.0 | nM | 6.27 | Antiprion activity against mouse prion protein RML infected mouse ScN2a cells as... | 21531054 |
| HT-22 | EC50 | = | 540.0 | nM | 6.27 | Neuroprotective activity in mouse HT22 cells assessed as protection against glut... | 24602904 |
| HT-22 | EC50 | = | 14640.0 | nM | 4.83 | Cytotoxicity against mouse HT22 cells after 24 hrs by MTT assay | 24602904 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 24602904 | 10.1016/j.bmcl.2014.02.006 | HT-22 | 8 |
| 21531054 | 10.1016/j.ejmech.2011.04.016 | NON-PROTEIN TARGET | 6 |
| 21531054 | 10.1016/j.ejmech.2011.04.016 | N2a | 1 |
| 21531054 | 10.1016/j.ejmech.2011.04.016 | Major prion protein | 1 |
| 21531054 | 10.1016/j.ejmech.2011.04.016 | ADMET | 1 |
| 21531054 | 10.1016/j.ejmech.2011.04.016 | No relevant target | 1 |
| 24602904 | 10.1016/j.bmcl.2014.02.006 | NON-PROTEIN TARGET | 1 |
Data from ChEMBL 36 via Core Engine