Drug General Information
Drug ID
DXE9MN
Drug Name
(S)-N-((S)-3-cyclohexyl-1-oxo-1-((S)-1-(4-(trifluoromethoxy)phenylamino)propan-2-ylamino)propan-2-yl)-tetrahydrofuran-2-carboxamide
Synonyms
CHEMBL214897
Indication Discovery agent Investigative [1587926]
Formula
C24H34F3N3O4
Canonical SMILES
C[C@@H](CNc1ccc(OC(F)(F)F)cc1)NC(=O)[C@H](CC2CCCCC2)NC(=O)[C@@H]3CCCO3
InChI
InChI=1S/C24H34F3N3O4/c1-16(15-28-18-9-11-19(12-10-18)34-24(25,26)27)29-22(31)20(14-17-6-3-2-4-7-17)30-23(32)21-8-5-13-33-21/h9-12,16-17,20-21,28H,2-8,13-15H2,1H3,(H,29,31)(H,30,32)/t16-,20-,21-/m0/s1
InChIKey
JZPVDDNAUOMUOJ-NDXORKPFSA-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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