Compound Detail
CHEMBL1374578
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Basic Information
| ChEMBL ID | CHEMBL1374578 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PPIPRCBNQISFCA-UHFFFAOYSA-N |
1
Targets
2
Activities
2
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
413.8
MW (Da)
5.33
ALogP
5
HBA
1
HBD
97.5
PSA (Ų)
0.33
QED
1
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.3
Ki 1 meas. best 6.3
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Bcl-2-like protein 1 CHEMBL4625 | IC50 | 6.3 | 6.3 | 500.0 | 1 |
| Bcl-2-like protein 1 CHEMBL4625 | Ki | 6.3 | 6.3 | 500.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Bcl-2-like protein 1 | IC50 | = | 500.0 | nM | 6.3 | Displacement of biotinylated-BH3 peptide from Bcl-xL by TR-FRET assay | 20192224 |
| Bcl-2-like protein 1 | Ki | = | 500.0 | nM | 6.3 | Inhibition of GST-tagged Bcl-xL (unknown origin) measured after 1 hr incubation ... | 25797160 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 20192224 | 10.1021/jm100009z | Bcl-2-like protein 1 | 1 |
| 25797160 | 10.1016/j.bmc.2015.02.060 | Bcl-2-like protein 1 | 1 |
Data from ChEMBL 36 via Core Engine