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

CHEMBL79870

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
COc1ccc(CCB(O)O)cc1

Basic Information

ChEMBL ID CHEMBL79870
Phase Preclinical
Structure Type MOL
InChI Key RWPNEJOLOHADOQ-UHFFFAOYSA-N
1
Targets
4
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

180.0
MW (Da)

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C9H13BO3
MW 180.01

Activity Summary

Ki 4 meas. best 4.24

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Subtilisin Carlsberg
CHEMBL4299
Ki 4.24 4.24 58000.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Subtilisin Carlsberg Ki = 58000.0 nM 4.24 Competitive inhibition of Subtilisin Carlsberg enzyme from Bacillus lentus -

Literature References

PubMed DOI Target Context # Activities
- 10.1016/0960-894X(96)00466-0 Subtilisin BL 3
- 10.1016/0960-894X(96)00466-0 Subtilisin Carlsberg 1

Data from ChEMBL 36 via Core Engine