Compound Detail
CHEMBL1402456
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Basic Information
| ChEMBL ID | CHEMBL1402456 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | UZQIOQVHUUAJOZ-UHFFFAOYSA-N |
12
Targets
12
Activities
2
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
236.3
MW (Da)
3.68
ALogP
3
HBA
2
HBD
45.1
PSA (Ų)
0.71
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 11 meas. best 6.46
EC50 1 meas. best 5.72
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Sentrin-specific protease 6 CHEMBL1741215 | IC50 | 6.46 | 6.46 | 345.0 | 1 |
| Sentrin-specific protease 7 CHEMBL1741213 | IC50 | 6.12 | 6.12 | 750.0 | 1 |
| Sentrin-specific protease 8 CHEMBL1741207 | IC50 | 6.05 | 6.05 | 899.0 | 1 |
| Caspase-3 CHEMBL2334 | IC50 | 5.99 | 5.99 | 1020.0 | 1 |
| Unchecked CHEMBL612545 | IC50 | 5.76 | 5.76 | 1720.0 | 1 |
| Protein RecA CHEMBL1741171 | EC50 | 5.72 | 5.72 | 1900.0 | 1 |
| Apoptotic protease-activating factor 1 CHEMBL1795093 | IC50 | 5.48 | 5.48 | 3310.0 | 1 |
| M-phase inducer phosphatase 2 CHEMBL4804 | IC50 | 5.48 | 5.48 | 3300.0 | 1 |
| SUMO E1/E2 CHEMBL3137290 | IC50 | 5.2 | 5.2 | 6320.0 | 1 |
| Cysteine protease ATG4B CHEMBL1741221 | IC50 | 5.04 | 5.04 | 9220.0 | 1 |
| Mothers against decapentaplegic homolog 3 CHEMBL1293258 | IC50 | 4.71 | 4.71 | 19560.0 | 1 |
| Serine/threonine-protein phosphatase CHEMBL1293265 | IC50 | 4.5 | 4.5 | 31558.0 | 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