Drug Information

Drug General Information
Drug ID
DX2YN8
Drug Name
4-[(R)-Carboxy-(5-phenylthiophene-2-sulfonylamino)-methyl]-piperidine-1-carboxylic Acid tert-Butyl Ester
Synonyms
CHEMBL511729
Indication Discovery agent Investigative [1587926]
Formula
C22H28N2O6S2
Canonical SMILES
CC(C)(C)OC(=O)N1CCC(CC1)[C@@H](NS(=O)(=O)c2ccc(s2)c3ccccc3)C(=O)O
InChI
InChI=1S/C22H28N2O6S2/c1-22(2,3)30-21(27)24-13-11-16(12-14-24)19(20(25)26)23-32(28,29)18-10-9-17(31-18)15-7-5-4-6-8-15/h4-10,16,19,23H,11-14H2,1-3H3,(H,25,26)/t19-/m1/s1
InChIKey
AOBTZEZFLADCMR-LJQANCHMSA-N
Target and Pathway
Target(s) Collagenase 3 Target Info [1587926]
Interstitial collagenase Target Info [1587926]
KEGG Pathway PPAR signaling pathway
Pathways in cancer
Bladder cancer
Rheumatoid arthritis
NetPath Pathway IL1 Signaling PathwayNetPath_13:IL1 Signaling Pathway
EGFR1 Signaling Pathway
TWEAK Signaling Pathway
Wnt Signaling Pathway
PANTHER Pathway Alzheimer disease-presenilin pathway
Plasminogen activating cascadeP00004:Alzheimer disease-presenilin pathway
Plasminogen activating cascade
Pathway Interaction Database Urokinase-type plasminogen activator (uPA) and uPAR-mediated signalingendothelinpathway:Endothelins
Validated transcriptional targets of AP1 family members Fra1 and Fra2
Glucocorticoid receptor regulatory network
AP-1 transcription factor network
Syndecan-1-mediated signaling events
Reactome Collagen degradation
Degradation of the extracellular matrix
Activation of Matrix Metalloproteinases
Assembly of collagen fibrils and other multimeric structuresR-HSA-1442490:Collagen degradation
Basigin interactions
Regulation of Insulin-like Growth Factor (IGF) transport and uptake by Insulin-like Growth Factor Binding Proteins (IGFBPs)
WikiPathways Endochondral Ossification
Activation of Matrix Metalloproteinases
Oncostatin M Signaling Pathway
AGE/RAGE pathway
Matrix MetalloproteinasesWP366:TGF beta Signaling Pathway
Bladder Cancer
Degradation of collagen
Quercetin and Nf-kB/ AP-1 Induced Cell Apoptosis
Prostate Cancer
Integrated Breast Cancer Pathway
Integrated Cancer pathway
Cell surface interactions at the vascular wall
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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