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

CHEMBL4639665

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
C=CC(=O)Nc1cccc(Nc2nc(Nc3cccc4c3B(O)OC4)ncc2C(F)(F)F)c1

Basic Information

ChEMBL ID CHEMBL4639665
Phase Preclinical
Structure Type MOL
InChI Key PICSGDJZUKVMGU-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

455.2
MW (Da)

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H17BF3N5O3
MW 455.21

Activity Summary

IC50 1 meas. best 6.57

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Tyrosine-protein kinase BTK
CHEMBL5251
IC50 6.57 6.57 267.8 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
31843459 10.1016/j.bmc.2019.115236 Tyrosine-protein kinase BTK 1

Data from ChEMBL 36 via Core Engine