Compound Detail
CHEMBL5801330
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Cc1sc2c(c1C)C(c1ccc(Cl)cc1)=N[C@@H](CC(=O)NCCCCC(=O)Nc1cccc3c1CN(C1CCC(=O)NC1=O)C3=O)c1nnc(C)n1-2
Basic Information
| ChEMBL ID | CHEMBL5801330 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WSFUNVYDDZKPSU-MBMZGMDYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
741.3
MW (Da)
4.88
ALogP
10
HBA
3
HBD
167.8
PSA (Ų)
0.15
QED
1
Ro5 Violations
10
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.57
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Protein cereblon/DNA damage-binding protein 1/Bromodomain-containing protein 4 CHEMBL4296145 | IC50 | 7.57 | 7.57 | 26.9 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Protein cereblon/DNA damage-binding protein 1/Bromodomain-containing protein 4 | IC50 | = | 26.9 | nM | 7.57 | CRBN-DDB1/BRD4 Dimerization Assay: AlphaScreen technology was used to detect CRB... | - |
Data from ChEMBL 36 via Core Engine