Drug Information

Drug General Information
Drug ID
D0FD8G
Former ID
DNC009815
Drug Name
2-(biphenyl-4-yl)vinylboronic acid
Drug Type
Small molecular drug
Indication Discovery agent Investigative [530086]
Structure
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2D MOL

3D MOL
Formula
C14H13BO2
Canonical SMILES
B(C=CC1=CC=C(C=C1)C2=CC=CC=C2)(O)O
InChI
1S/C14H13BO2/c16-15(17)11-10-12-6-8-14(9-7-12)13-4-2-1-3-5-13/h1-11,16-17H/b11-10+
InChIKey
NTRGFVQIGQYKIL-ZHACJKMWSA-N
PubChem Compound ID
6011033
Target and Pathway
Target(s) Carbonic anhydrase I Target Info Inhibitor [530086]
Fatty-acid amide hydrolase Target Info Inhibitor [529790]
BioCyc Pathway Anandamide degradation
KEGG Pathway Nitrogen metabolismhsa04723:Retrograde endocannabinoid signaling
PANTHER Pathway Anandamide degradation
Pathway Interaction Database C-MYB transcription factor network
PathWhiz Pathway Gastric Acid Production
Reactome Erythrocytes take up carbon dioxide and release oxygen
Erythrocytes take up oxygen and release carbon dioxide
Reversible hydration of carbon dioxide
WikiPathways Reversible Hydration of Carbon Dioxide
Uptake of Carbon Dioxide and Release of Oxygen by Erythrocytes
Uptake of Oxygen and Release of Carbon Dioxide by Erythrocytes
References
Ref 530086Bioorg Med Chem Lett. 2009 May 15;19(10):2642-5. Epub 2009 Apr 5.Carbonic anhydrase inhibitors. Inhibition of the fungal beta-carbonic anhydrases from Candida albicans and Cryptococcus neoformans with boronic acids.
Ref 529790J Med Chem. 2008 Nov 27;51(22):7057-60.Discovery of boronic acids as novel and potent inhibitors of fatty acid amide hydrolase.
Ref 530086Bioorg Med Chem Lett. 2009 May 15;19(10):2642-5. Epub 2009 Apr 5.Carbonic anhydrase inhibitors. Inhibition of the fungal beta-carbonic anhydrases from Candida albicans and Cryptococcus neoformans with boronic acids.

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