Compound Detail
CHEMBL1719459
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Basic Information
| ChEMBL ID | CHEMBL1719459 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GZQSASCGRJKNOY-UHFFFAOYSA-N |
9
Targets
10
Activities
2
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
270.7
MW (Da)
4.34
ALogP
3
HBA
2
HBD
45.1
PSA (Ų)
0.73
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 8 meas. best 5.5
EC50 2 meas. best 5.7
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Protein RecA CHEMBL1741171 | EC50 | 5.7 | 5.7 | 1990.0 | 1 |
| Sentrin-specific protease 6 CHEMBL1741215 | IC50 | 5.5 | 5.5 | 3140.0 | 1 |
| Unchecked CHEMBL612545 | IC50 | 5.46 | 5.46 | 3470.0 | 1 |
| M-phase inducer phosphatase 2 CHEMBL4804 | IC50 | 5.38 | 5.38 | 4190.0 | 1 |
| Sentrin-specific protease 8 CHEMBL1741207 | IC50 | 5.37 | 5.37 | 4230.0 | 1 |
| Caspase-3 CHEMBL2334 | IC50 | 5.36 | 5.36 | 4420.0 | 1 |
| Sentrin-specific protease 7 CHEMBL1741213 | IC50 | 5.33 | 5.33 | 4700.0 | 1 |
| Apoptotic protease-activating factor 1 CHEMBL1795093 | IC50 | 5.21 | 5.21 | 6110.0 | 1 |
| Tyrosyl-DNA phosphodiesterase 2 CHEMBL2169736 | IC50 | 4.55 | 4.55 | 28413.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 25703307 | 10.1016/j.bmc.2015.01.043 | M-phase inducer phosphatase 2 | 1 |
Data from ChEMBL 36 via Core Engine