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Compound Detail

CHEMBL1813236

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CC(C)C[C@H](NC(=O)[C@@H](N)CO)B(O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1813236
Phase Preclinical
Structure Type MOL
InChI Key FQBIAYITZFXZRR-BQBZGAKWSA-N
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

218.1
MW (Da)

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C8H19BN2O4
MW 218.06

Activity Summary

IC50 2 meas. best 6.72

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Unchecked
CHEMBL612545
 IC50 6.72 6.34 190.0 2

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Unchecked IC50 = 190.0 nM 6.72 Inhibition of chymotrypsin-like activity of 20S proteasome using suc-LLVY-AMC as... 21634429
Unchecked IC50 = 1100.0 nM 5.96 Inhibition of chymotrypsin-like activity of 20S proteasome using suc-LLVY-AMC as... 21634429

Literature References

PubMed DOI Target Context # Activities
21634429 10.1021/jm200460q Unchecked 6
21634429 10.1021/jm200460q ADMET 1

Data from ChEMBL 36 via Core Engine