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

CHEMBL2386181

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
c1ccc(-c2ccc([B-]3(c4ccccc4)[NH2+]CCO3)cc2)cc1

Basic Information

ChEMBL ID CHEMBL2386181
Phase Preclinical
Structure Type MOL
InChI Key LKYXOFXGDRTLIJ-UHFFFAOYSA-N
2
Targets
4
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

301.2
MW (Da)

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H20BNO
MW 301.20

Activity Summary

IC50 4 meas. best 5.11

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
ORAI 1/2/3
CHEMBL3038476
IC50 5.11 4.99 7700.0 2
Transient receptor potential cation channel subfamily V member 6
CHEMBL1628465
IC50 4.29 4.215 51300.0 2

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
23602525 10.1016/j.bmc.2013.03.037 ORAI 1/2/3 2
23602525 10.1016/j.bmc.2013.03.037 Transient receptor potential cation channel subfamily V member 6 2

Data from ChEMBL 36 via Core Engine