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Compound Detail

CHEMBL194428

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NCC[C@H](N)C(=O)N1CCC[C@@H]1B(O)O

Basic Information

ChEMBL ID CHEMBL194428
Phase Preclinical
Structure Type MOL
InChI Key ISAYLDPRTPLQPU-NKWVEPMBSA-N
5
Targets
5
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names

Molecular Properties

215.1
MW (Da)

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C8H18BN3O3
MW 215.06

Activity Summary

IC50 5 meas. best 9.14

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Dipeptidyl peptidase 2
CHEMBL3976
IC50 9.14 9.14 0.7 1
Dipeptidyl peptidase 9
CHEMBL4793
IC50 8.17 8.17 6.7 1
Dipeptidyl peptidase 4
CHEMBL284
IC50 7.82 7.82 15.0 1
Dipeptidyl peptidase 8
CHEMBL4657
IC50 7.02 7.02 95.0 1
Prolyl endopeptidase FAP
CHEMBL4683
IC50 5.17 5.17 6800.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
16084722 10.1016/j.bmcl.2005.06.076 Dipeptidyl peptidase 2 1
16084722 10.1016/j.bmcl.2005.06.076 Dipeptidyl peptidase 4 1
16084722 10.1016/j.bmcl.2005.06.076 Prolyl endopeptidase FAP 1
16084722 10.1016/j.bmcl.2005.06.076 Dipeptidyl peptidase 8 1
16084722 10.1016/j.bmcl.2005.06.076 Dipeptidyl peptidase 9 1

Data from ChEMBL 36 via Core Engine