Compound Detail
CHEMBL370441
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Basic Information
| ChEMBL ID | CHEMBL370441 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KVRCAGKHAZRSQX-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
303.2
MW (Da)
0.00
ALogP
6
HBA
1
HBD
126.7
PSA (Ų)
0.47
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.51
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Protein cereblon/DNA damage-binding protein 1 CHEMBL4630734 | IC50 | 5.51 | 5.5 | 3060.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Protein cereblon/DNA damage-binding protein 1 | IC50 | = | 3060.0 | nM | 5.51 | CRBN-DDB1 ligand-displacement AlphaScreen Assay: A thalidomide competition Alpha... | - |
| Protein cereblon/DNA damage-binding protein 1 | IC50 | = | 3250.0 | nM | 5.49 | CRBN-DDB1 ligand-displacement AlphaScreen Assay: A thalidomide competition Alpha... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 16183272 | 10.1016/j.bmcl.2005.08.086 | HUVEC | 1 |
| 31251063 | 10.1021/acs.jmedchem.9b00454 | Cereblon isoform 4 | 1 |
| 31251063 | 10.1021/acs.jmedchem.9b00454 | Cereblon/Casein kinase I alpha | 1 |
| 31251063 | 10.1021/acs.jmedchem.9b00454 | Protein cereblon/Aiolos | 1 |
Data from ChEMBL 36 via Core Engine