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Compound Detail

CHEMBL1093730

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CC(C)OC(=O)c1ccc(Oc2ccc3c(c2)COB3O)nc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1093730
Phase Preclinical
Structure Type MOL
InChI Key FHBVGIUZVIHLLZ-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

313.1
MW (Da)

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H16BNO5
MW 313.12

Activity Summary

IC50 1 meas. best 6.95

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Unchecked
CHEMBL612545
 IC50 6.95 6.95 113.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Unchecked IC50 = 113.0 nM 6.95 Inhibition of PDE4 20188549

Literature References

PubMed DOI Target Context # Activities
20188549 10.1016/j.bmcl.2010.02.010 No relevant target 2
20188549 10.1016/j.bmcl.2010.02.010 Plasma 2
20188549 10.1016/j.bmcl.2010.02.010 Unchecked 1

Data from ChEMBL 36 via Core Engine