Drug Information

Drug General Information
Drug ID
D08KLL
Former ID
DNC006795
Drug Name
2-(2,3-bis(2-chlorobenzyloxy)phenyl)acetic acid
Drug Type
Small molecular drug
Indication Discovery agent Investigative [528353]
Structure
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2D MOL

3D MOL
Formula
C22H18Cl2O4
Canonical SMILES
C1=CC=C(C(=C1)COC2=CC=CC(=C2OCC3=CC=CC=C3Cl)CC(=O)O)Cl
InChI
1S/C22H18Cl2O4/c23-18-9-3-1-6-16(18)13-27-20-11-5-8-15(12-21(25)26)22(20)28-14-17-7-2-4-10-19(17)24/h1-11H,12-14H2,(H,25,26)
InChIKey
JDODANGOYUAOQT-UHFFFAOYSA-N
PubChem Compound ID
10126984
Target and Pathway
Target(s) Fatty acid-bindingprotein, epidermal Target Info Inhibitor [528353]
Fatty acid-binding protein, adipocyte Target Info Inhibitor [528353]
KEGG Pathway PPAR signaling pathwayhsa03320:PPAR signaling pathway
NetPath Pathway IL1 Signaling PathwayNetPath_11:TCR Signaling Pathway
Pathway Interaction Database AP-1 transcription factor network
Reactome Hormone-sensitive lipase (HSL)-mediated triacylglycerol hydrolysisR-HSA-163560:Hormone-sensitive lipase (HSL)-mediated triacylglycerol hydrolysis
Transcriptional regulation of white adipocyte differentiation
WikiPathways Lipid digestion, mobilization, and transport
Transcriptional Regulation of White Adipocyte Differentiation
References
Ref 528353J Med Chem. 2006 Aug 10;49(16):5013-7.NMR structure of a potent small molecule inhibitor bound to human keratinocyte fatty acid-binding protein.
Ref 528353J Med Chem. 2006 Aug 10;49(16):5013-7.NMR structure of a potent small molecule inhibitor bound to human keratinocyte fatty acid-binding protein.

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