Drug Information

Drug General Information
Drug ID
D00KSS
Former ID
DNC004453
Drug Name
3-(4-Methoxy-benzenesulfonyl)-propane-1-thiol
Drug Type
Small molecular drug
Indication Discovery agent Investigative [525485]
Formula
C10H14O3S2
Canonical SMILES
COC1=CC=C(C=C1)S(=O)(=O)CCCS
InChI
1S/C10H14O3S2/c1-13-9-3-5-10(6-4-9)15(11,12)8-2-7-14/h3-6,14H,2,7-8H2,1H3
InChIKey
JIFLEYNNNKKNOQ-UHFFFAOYSA-N
PubChem Compound ID
18411961
Target and Pathway
Target(s) Collagenase 3 Target Info Inhibitor [525485]
Neutrophil collagenase Target Info Inhibitor [525535]
NetPath Pathway IL1 Signaling Pathway
PANTHER Pathway Alzheimer disease-presenilin pathway
Plasminogen activating cascadeP00004:Alzheimer disease-presenilin pathway
Pathway Interaction Database 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 MetalloproteinasesWP2769:Activation of Matrix Metalloproteinases
Matrix Metalloproteinases
References
Ref 525485Bioorg Med Chem Lett. 1999 Apr 5;9(7):943-8.Discovery of a novel series of selective MMP inhibitors: identification of the gamma-sulfone-thiols.
Ref 525485Bioorg Med Chem Lett. 1999 Apr 5;9(7):943-8.Discovery of a novel series of selective MMP inhibitors: identification of the gamma-sulfone-thiols.
Ref 525535Bioorg Med Chem Lett. 1999 Jul 5;9(13):1757-60.Synthesis and identification of conformationally constrained selective MMP inhibitors.

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