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Compound Detail

CHEMBL2063035

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O=C([C@@H]1C[C@@H](O)CN1)N1C[C@@H](O)C[C@H]1B(O)O

Basic Information

ChEMBL ID CHEMBL2063035
Phase Preclinical
Structure Type MOL
InChI Key YQHVRHHVEWIRMK-KVPKETBZSA-N
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

244.1
MW (Da)

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C9H17BN2O5
MW 244.06

Activity Summary

IC50 3 meas. best 8.03

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Dipeptidyl peptidase 9
CHEMBL4793
IC50 8.03 8.03 9.3 1
Dipeptidyl peptidase 4
CHEMBL284
IC50 7.7 7.7 20.0 1
Dipeptidyl peptidase 8
CHEMBL4657
IC50 7.57 7.57 27.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
22853995 10.1016/j.bmcl.2012.07.033 Dipeptidyl peptidase 4 1
22853995 10.1016/j.bmcl.2012.07.033 Dipeptidyl peptidase 8 1
22853995 10.1016/j.bmcl.2012.07.033 Dipeptidyl peptidase 9 1

Data from ChEMBL 36 via Core Engine