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Compound Detail

CHEMBL373269

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O=C(CNC12CC3CC(CC(C3)C1)C2)N1CCC[C@@H]1B(O)O

Basic Information

ChEMBL ID CHEMBL373269
Phase Preclinical
Structure Type MOL
InChI Key PDSFQJYJMMJUTN-MHCOZEDOSA-N
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

306.2
MW (Da)

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H27BN2O3
MW 306.21

Activity Summary

IC50 3 meas. best 8.34

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Prolyl endopeptidase FAP
CHEMBL4683
IC50 8.34 8.34 4.6 1
Dipeptidyl peptidase 4
CHEMBL284
IC50 8.1 8.1 8.0 1
Dipeptidyl peptidase 2
CHEMBL3976
IC50 6.38 6.38 420.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
16085416 10.1016/j.bmcl.2005.06.075 Dipeptidyl peptidase 4 1
16085416 10.1016/j.bmcl.2005.06.075 Prolyl endopeptidase FAP 1
16085416 10.1016/j.bmcl.2005.06.075 Dipeptidyl peptidase 2 1

Data from ChEMBL 36 via Core Engine