Compound Detail
CHEMBL5275131
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Basic Information
| ChEMBL ID | CHEMBL5275131 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | OUHFVWVTONSREN-UHFFFAOYSA-N |
2
Targets
2
Activities
2
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
420.9
MW (Da)
2.68
ALogP
6
HBA
0
HBD
71.0
PSA (Ų)
0.65
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 6.87
IC50 1 meas. best 7.85
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| SUM-159-PT CHEMBL4483269 | IC50 | 7.85 | 7.85 | 14.0 | 1 |
| ATP-dependent Clp protease proteolytic subunit, mitochondrial CHEMBL4523305 | EC50 | 6.87 | 6.87 | 135.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| SUM-159-PT | IC50 | = | 14.0 | nM | 7.85 | Cytotoxicity against human SUM159PT cells assessed as cell growth inhibition mea... | 33656892 |
| ATP-dependent Clp protease proteolytic subunit, mitochondrial | EC50 | = | 135.0 | nM | 6.87 | Agonist activity at human recombinant CLpP (57 to 277 amino acids) expressed in ... | 33656892 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 33656892 | 10.1021/acs.jmedchem.0c01640 | SUM-159-PT | 2 |
| 33656892 | 10.1021/acs.jmedchem.0c01640 | ATP-dependent Clp protease proteolytic subunit, mitochondrial | 1 |
Data from ChEMBL 36 via Core Engine