Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL510594

Enter ChEMBL ID:
Free Research Context This compound will appear in recent viewed items on the research home for this browser.
Research home View demo workspace
CC(C)[C@H](N)C(=O)N1CSC[C@H]1B(O)O

Basic Information

ChEMBL ID CHEMBL510594
Phase Preclinical
Structure Type MOL
InChI Key IAXFZVFUACWVDO-BQBZGAKWSA-N
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names

Molecular Properties

232.1
MW (Da)

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C8H17BN2O3S
MW 232.11

Activity Summary

IC50 3 meas. best 7.66

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Dipeptidyl peptidase 4
CHEMBL284
IC50 7.66 7.66 22.0 1
Dipeptidyl peptidase 8
CHEMBL4657
IC50 7.29 7.29 51.0 1
Dipeptidyl peptidase 2
CHEMBL3976
IC50 7.07 7.07 86.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Dipeptidyl peptidase 4 IC50 = 22.0 nM 7.66 Inhibition of DPP4 18556199
Dipeptidyl peptidase 8 IC50 = 51.0 nM 7.29 Inhibition of DPP8 18556199
Dipeptidyl peptidase 2 IC50 = 86.0 nM 7.07 Inhibition of DPP2 18556199

Literature References

PubMed DOI Target Context # Activities
18556199 10.1016/j.bmcl.2008.05.080 Dipeptidyl peptidase 8 1
18556199 10.1016/j.bmcl.2008.05.080 Dipeptidyl peptidase 9 1
18556199 10.1016/j.bmcl.2008.05.080 Dipeptidyl peptidase 4 1
18556199 10.1016/j.bmcl.2008.05.080 Dipeptidyl peptidase 2 1

Data from ChEMBL 36 via Core Engine