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Compound Detail

CHEMBL91108

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O=[N+]([O-])c1ccc(B(O)O)cc1

Basic Information

ChEMBL ID CHEMBL91108
Phase Preclinical
Structure Type MOL
InChI Key NSFJAFZHYOAMHL-UHFFFAOYSA-N
1
Targets
2
Activities
1
Assay Types
1
PK Parameters
4
Publications
0
Known Names

Molecular Properties

166.9
MW (Da)

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C6H6BNO4
MW 166.93

Activity Summary

IC50 2 meas. best 6.68

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Fatty-acid amide hydrolase 1
CHEMBL3229
IC50 6.68 6.68 210.0 1

Pharmacokinetic Data

Parameter Value Units Species
Ka 4660.0 M-1 -

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
20594849 10.1016/j.bmcl.2010.06.039 Unchecked 2
14684290 10.1016/j.bmcl.2003.10.017 Unchecked 1
18983140 10.1021/jm801051t Fatty-acid amide hydrolase 1 1
18983140 10.1021/jm801051t Monoglyceride lipase 1

Data from ChEMBL 36 via Core Engine