Drug Information

Drug General Information
Drug ID
DX4QMG
Drug Name
2-(4'-Methoxy-biphenyl-4-sulfonylamino)-5-(4-morpholin-4-yl-phenyl)-pent-4-ynoic acid
Synonyms
CHEMBL10792
Indication Discovery agent Investigative [1587926]
Formula
C28H28N2O6S
Canonical SMILES
COc1ccc(cc1)c2ccc(cc2)S(=O)(=O)NC(CC#Cc3ccc(cc3)N4CCOCC4)C(=O)O
InChI
InChI=1S/C28H28N2O6S/c1-35-25-13-7-22(8-14-25)23-9-15-26(16-10-23)37(33,34)29-27(28(31)32)4-2-3-21-5-11-24(12-6-21)30-17-19-36-20-18-30/h5-16,27,29H,4,17-20H2,1H3,(H,31,32)
InChIKey
LQLNFJVHRIWFTO-UHFFFAOYSA-N
Target and Pathway
Target(s) 72 kDa type IV collagenase Target Info [1587926]
Collagenase 3 Target Info [1587926]
KEGG Pathway Leukocyte transendothelial migration
GnRH signaling pathway
Estrogen signaling pathway
Pathways in cancer
Proteoglycans in cancer
Bladder cancer
NetPath Pathway Leptin Signaling Pathway
TCR Signaling Pathway
ID Signaling PathwayNetPath_13:IL1 Signaling Pathway
PANTHER Pathway Alzheimer disease-presenilin pathwayP00004:Alzheimer disease-presenilin pathway
Plasminogen activating cascade
Pathway Interaction Database LPA receptor mediated events
Plasma membrane estrogen receptor signaling
Osteopontin-mediated events
Validated transcriptional targets of AP1 family members Fra1 and Fra2
Angiopoietin receptor Tie2-mediated signaling
Direct p53 effectors
amb2 Integrin signaling
ATF-2 transcription factor network
FOXM1 transcription factor network
Regulation of nuclear beta catenin signaling and target gene transcription
Syndecan-2-mediated signaling eventsupa_upar_pathway:Urokinase-type plasminogen activator (uPA) and uPAR-mediated signaling
Reactome Collagen degradation
Degradation of the extracellular matrix
Activation of Matrix Metalloproteinases
Regulation of Insulin-like Growth Factor (IGF) transport and uptake by Insulin-like Growth Factor Binding Proteins (IGFBPs)
EPH-ephrin mediated repulsion of cellsR-HSA-1442490:Collagen degradation
Assembly of collagen fibrils and other multimeric structures
WikiPathways Activation of Matrix Metalloproteinases
AGE/RAGE pathway
Matrix MetalloproteinasesWP474:Endochondral Ossification
Oncostatin M Signaling Pathway
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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