Drug Information

Drug General Information
Drug ID
D0LM2K
Former ID
DNC009965
Drug Name
2-(2-(biphenyl-4-yl)ethylsulfonyl)acetic acid
Drug Type
Small molecular drug
Indication Discovery agent Investigative [530333]
Structure
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2D MOL

3D MOL
Formula
C16H16O4S
Canonical SMILES
C1=CC=C(C=C1)C2=CC=C(C=C2)CCS(=O)(=O)CC(=O)O
InChI
1S/C16H16O4S/c17-16(18)12-21(19,20)11-10-13-6-8-15(9-7-13)14-4-2-1-3-5-14/h1-9H,10-12H2,(H,17,18)
InChIKey
PPYPHJNYICUMPA-UHFFFAOYSA-N
PubChem Compound ID
45483015
Target and Pathway
Target(s) Collagenase 3 Target Info Inhibitor [530333]
MMP-12 Target Info Inhibitor [530333]
NetPath Pathway IL1 Signaling PathwayNetPath_13:IL1 Signaling Pathway
IL5 Signaling Pathway
PANTHER Pathway Alzheimer disease-presenilin pathway
Plasminogen activating cascade
Pathway Interaction Database Urokinase-type plasminogen activator (uPA) and uPAR-mediated signalingupa_upar_pathway:Urokinase-type plasminogen activator (uPA) and uPAR-mediated signaling
Reactome Collagen degradation
Degradation of the extracellular matrix
Activation of Matrix Metalloproteinases
Assembly of collagen fibrils and other multimeric structuresR-HSA-1442490:Collagen degradation
WikiPathways Endochondral Ossification
Activation of Matrix Metalloproteinases
Oncostatin M Signaling Pathway
AGE/RAGE pathway
Matrix MetalloproteinasesWP366:TGF beta Signaling Pathway
Degradation of collagen
Matrix Metalloproteinases
References
Ref 530333Bioorg Med Chem Lett. 2009 Oct 1;19(19):5760-3. Epub 2009 Aug 6.The identification of beta-hydroxy carboxylic acids as selective MMP-12 inhibitors.
Ref 530333Bioorg Med Chem Lett. 2009 Oct 1;19(19):5760-3. Epub 2009 Aug 6.The identification of beta-hydroxy carboxylic acids as selective MMP-12 inhibitors.

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