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Compound Detail

CHEMBL139928

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O=C(O)/C=C/c1ccc(B(O)O)cc1

Basic Information

ChEMBL ID CHEMBL139928
Phase Preclinical
Structure Type MOL
InChI Key IEMLKNHGGSYOMP-ZZXKWVIFSA-N
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

192.0
MW (Da)

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C9H9BO4
MW 191.98

Activity Summary

Ki 3 meas. best 5.38

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Beta-lactamase
CHEMBL2026
Ki 5.38 5.38 4200.0 2
Unchecked
CHEMBL612545
Ki 5.38 5.38 4200.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
12109906 10.1021/jm020002p Beta-lactamase 1
9804697 10.1021/jm980343w Beta-lactamase 1
20452208 10.1016/j.bmcl.2010.04.007 Unchecked 1

Data from ChEMBL 36 via Core Engine