Compound Detail
CHEMBL43855
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Basic Information
| ChEMBL ID | CHEMBL43855 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | IICWMVJMJVXCLY-UHFFFAOYSA-N |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
273.2
MW (Da)
-0.33
ALogP
5
HBA
2
HBD
109.6
PSA (Ų)
0.54
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 7.02
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Protein cereblon/DNA damage-binding protein 1 CHEMBL4630734 | IC50 | 7.02 | 7.02 | 94.9 | 1 |
| Protein cereblon CHEMBL3763008 | IC50 | 6.25 | 6.25 | 560.0 | 1 |
| Homo sapiens CHEMBL372 | IC50 | 4.0 | 4.0 | 100000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Protein cereblon/DNA damage-binding protein 1 | IC50 | = | 94.9 | nM | 7.02 | CRBN-DDB1 ligand-displacement AlphaScreen Assay: A thalidomide competition Alpha... | - |
| Protein cereblon | IC50 | = | 560.0 | nM | 6.25 | Displacement of fluorescent tracer from NanoLuc-tagged CRBN (unknown origin) by ... | 36970148 |
| Homo sapiens | IC50 | = | 100000.0 | nM | 4.0 | Inhibition of lipopolysaccharide stimulated TNF-alpha release in human whole blo... | 10386948 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 10386948 | 10.1016/s0960-894x(99)00250-4 | Homo sapiens | 2 |
| 36970148 | 10.1039/d2md00347c | Cereblon/Ikaros | 2 |
| 10386948 | 10.1016/s0960-894x(99)00250-4 | PBMC | 1 |
| 19103485 | 10.1016/j.bmcl.2008.11.118 | Mus musculus | 1 |
| 36970148 | 10.1039/d2md00347c | Protein cereblon | 1 |
| 36970148 | 10.1039/d2md00347c | Protein cereblon/GSPT1 | 1 |
Data from ChEMBL 36 via Core Engine