Drug General Information
Drug ID
DXW0R3
Drug Name
N-[1-(2S-Ethyl-4-oxo-tetrahydro-furan-3S-ylcarbamoyl)-2S-(1-methyl-cyclopentyl)-ethyl]-3-methanesulfonylamino-benzamide
Synonyms
CHEMBL481503
Indication Discovery agent Investigative [1587926]
Formula
C23H33N3O6S
Canonical SMILES
CC[C@@H]1OCC(=O)[C@H]1NC(=O)[C@H](CC2(C)CCCC2)NC(=O)c3cccc(NS(=O)(=O)C)c3
InChI
InChI=1S/C23H33N3O6S/c1-4-19-20(18(27)14-32-19)25-22(29)17(13-23(2)10-5-6-11-23)24-21(28)15-8-7-9-16(12-15)26-33(3,30)31/h7-9,12,17,19-20,26H,4-6,10-11,13-14H2,1-3H3,(H,24,28)(H,25,29)/t17-,19-,20+/m0/s1
InChIKey
LTPMAMKKBKZMKQ-YSIASYRMSA-N
Target and Pathway
Target(s) Cathepsin K Target Info [1587926]
Cathepsin L Target Info [1587926]
KEGG Pathway Lysosome
Osteoclast differentiation
Toll-like receptor signaling pathway
Rheumatoid arthritishsa04142:Lysosome
Phagosome
Antigen processing and presentation
Proteoglycans in cancer
Rheumatoid arthritis
NetPath Pathway TGF_beta_Receptor Signaling Pathway
RANKL Signaling Pathway
IL2 Signaling PathwayNetPath_16:IL4 Signaling Pathway
Reactome Collagen degradation
Degradation of the extracellular matrix
Activation of Matrix Metalloproteinases
Trafficking and processing of endosomal TLR
MHC class II antigen presentationR-HSA-1236977:Endosomal/Vacuolar pathway
Assembly of collagen fibrils and other multimeric structures
MHC class II antigen presentation
WikiPathways RANKL/RANK Signaling Pathway
Osteoclast SignalingWP2572:Primary Focal Segmental Glomerulosclerosis FSGS
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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