Compound Detail
CHEMBL2436887
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Basic Information
| ChEMBL ID | CHEMBL2436887 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VYQFVFZWQVNTIH-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
378.4
MW (Da)
2.99
ALogP
5
HBA
5
HBD
118.9
PSA (Ų)
0.35
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 5.88
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Apoptosis regulator Bcl-2 CHEMBL4860 | Ki | 5.88 | 5.88 | 1323.0 | 1 |
| Induced myeloid leukemia cell differentiation protein Mcl-1 CHEMBL4361 | Ki | 5.55 | 5.55 | 2816.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Apoptosis regulator Bcl-2 | Ki | = | 1323.0 | nM | 5.88 | Displacement of FAM-Bid BH3 peptide from recombinant Bcl-2 (unknown origin) expr... | 24095762 |
| Induced myeloid leukemia cell differentiation protein Mcl-1 | Ki | = | 2816.0 | nM | 5.55 | Displacement of FAM-Bid BH3 peptide from recombinant Mcl-1 (unknown origin) expr... | 24095762 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 24095762 | 10.1016/j.ejmech.2013.09.030 | Apoptosis regulator Bcl-2 | 1 |
| 24095762 | 10.1016/j.ejmech.2013.09.030 | Induced myeloid leukemia cell differentiation protein Mcl-1 | 1 |
Data from ChEMBL 36 via Core Engine