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Compound Detail

CHEMBL434184

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CC(C)[C@@H](NC1CCCCC1)C(=O)N1CCC[C@H]1B(O)O

Basic Information

ChEMBL ID CHEMBL434184
Phase Preclinical
Structure Type MOL
InChI Key XQOKLQVBBMYESS-UONOGXRCSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

296.2
MW (Da)

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C15H29BN2O3
MW 296.22

Activity Summary

IC50 1 meas. best 4.8

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Dipeptidyl peptidase 4
CHEMBL284
IC50 4.8 4.8 16000.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Dipeptidyl peptidase 4 IC50 = 16000.0 nM 4.8 Inhibitory activity against human DPP4 using Gly-Pro-AMC in fluorometric assay 16085416

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