Compound Detail
CHEMBL3347640
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CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)c1cnccn1)B(O)O
Basic Information
| ChEMBL ID | CHEMBL3347640 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RMFKLORSJSUOQK-YCVJPRETSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
581.5
MW (Da)
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 9.38
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Proteasome Macropain subunit MB1 CHEMBL4662 | IC50 | 9.38 | 9.38 | 0.4 | 1 |
| Unchecked CHEMBL612545 | IC50 | 8.35 | 8.35 | 4.4 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Proteasome Macropain subunit MB1 | IC50 | = | 0.42 | nM | 9.38 | Inhibition of chymotrypsin-like activity of proteasome beta5 subunit (unknown or... | - |
| Unchecked | IC50 | = | 4.43 | nM | 8.35 | Inhibition of post-glutamyl peptide hydrolysis proteasome subunit (unknown origi... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1039/C0MD00119H | Unchecked | 1 |
| - | 10.1039/C0MD00119H | Proteasome subunit beta type-7 | 1 |
| - | 10.1039/C0MD00119H | Proteasome Macropain subunit MB1 | 1 |
Data from ChEMBL 36 via Core Engine