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Compound Detail

CHEMBL5283829

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COc1cc(Nc2nc(Nc3ccc(N4CCC(N(C)C)CC4)cc3OC)ncc2Cl)cc(B(O)O)c1

Basic Information

ChEMBL ID CHEMBL5283829
Phase Preclinical
Structure Type MOL
InChI Key RHRGACFCHDEOQP-UHFFFAOYSA-N
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

526.8
MW (Da)

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C25H32BClN6O4
MW 526.83

Activity Summary

IC50 3 meas. best 7.29

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
ALK tyrosine kinase receptor
CHEMBL4247
IC50 7.29 6.9167 51.7 3

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
36332597 10.1016/j.bmc.2022.117071 ALK tyrosine kinase receptor 3

Data from ChEMBL 36 via Core Engine