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Compound Detail

CHEMBL5287991

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COc1c(B(O)O)cccc1-c1ccc2c(ccc3[nH]ncc32)n1

Basic Information

ChEMBL ID CHEMBL5287991
Phase Preclinical
Structure Type MOL
InChI Key GSOQMEARYDGDSU-UHFFFAOYSA-N
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

319.1
MW (Da)

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H14BN3O3
MW 319.13

Activity Summary

IC50 2 meas. best 9.29

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Rho-associated protein kinase 2
CHEMBL2973
IC50 9.29 9.29 0.5 1
Rho-associated protein kinase 1
CHEMBL3231
IC50 8.91 8.91 1.2 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
34388381 10.1016/j.ejmech.2021.113742 Rho-associated protein kinase 1 1
34388381 10.1016/j.ejmech.2021.113742 Rho-associated protein kinase 2 1

Data from ChEMBL 36 via Core Engine