Drug Information

Drug General Information
Drug ID
DX7CCH
Drug Name
{2-[5-(2-Methylsulfanyl-pyrimidin-4-yl)-thiophene-2-sulfonyl]-1,2,3,4-tetrahydro-isoquinolin-3-yl}-oxo-acetic acid
Synonyms
CHEMBL141672
Indication Discovery agent Investigative [1587926]
Formula
C20H17N3O5S3
Canonical SMILES
CSc1nccc(n1)c2ccc(s2)S(=O)(=O)N3Cc4ccccc4CC3C(=O)C(=O)O
InChI
InChI=1S/C20H17N3O5S3/c1-29-20-21-9-8-14(22-20)16-6-7-17(30-16)31(27,28)23-11-13-5-3-2-4-12(13)10-15(23)18(24)19(25)26/h2-9,15H,10-11H2,1H3,(H,25,26)
InChIKey
ULQUQVTVRZFECE-UHFFFAOYSA-N
Target and Pathway
Target(s) Stromelysin-1 Target Info [1587926]
Neutrophil collagenase Target Info [1587926]
KEGG Pathway TNF signaling pathway
Transcriptional misregulation in cancer
Rheumatoid arthritis
NetPath Pathway IL1 Signaling Pathway
IL4 Signaling Pathway
PANTHER Pathway Plasminogen activating cascade
CCKR signaling map STP00004:Alzheimer disease-presenilin pathway
Pathway Interaction Database Posttranslational regulation of adherens junction stability and dissassembly
p75(NTR)-mediated signaling
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 structures
EGFR Transactivation by GastrinR-HSA-1442490:Collagen degradation
WikiPathways Activation of Matrix Metalloproteinases
Gastrin-CREB signalling pathway via PKC and MAPK
Oncostatin M Signaling Pathway
Matrix MetalloproteinasesWP2769:Activation of Matrix Metalloproteinases
Matrix Metalloproteinases
References
Ref 1587926URL: https://www.ebi.ac.uk/chembl/ The ChEMBL database in 2017
Ref 1587926URL: https://www.ebi.ac.uk/chembl/ The ChEMBL database in 2017

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