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Compound Detail

CHEMBL443836

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O=C(NCC(=O)N1CCC[C@H]1B(O)O)c1c(Cl)cccc1Cl

Basic Information

ChEMBL ID CHEMBL443836
Phase Preclinical
Structure Type MOL
InChI Key YFJWJINWDUEJAY-JTQLQIEISA-N
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

345.0
MW (Da)

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C13H15BCl2N2O4
MW 344.99

Activity Summary

Ki 3 meas. best 8.36

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Prolyl endopeptidase
CHEMBL3202
Ki 8.36 8.36 4.4 1
Prolyl endopeptidase FAP
CHEMBL4683
Ki 7.92 7.92 12.0 1
Dipeptidyl peptidase 4
CHEMBL284
Ki 5.16 5.16 6871.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
17174090 10.1016/j.bmcl.2006.11.072 Dipeptidyl peptidase 4 1
17174090 10.1016/j.bmcl.2006.11.072 Prolyl endopeptidase 1
17174090 10.1016/j.bmcl.2006.11.072 Prolyl endopeptidase FAP 1

Data from ChEMBL 36 via Core Engine