Drug General Information
Drug ID
DXE0GK
Drug Name
benzyl (2S,3S)-1-(cyanomethylamino)-3-methyl-1-oxopentan-2-ylcarbamate
Synonyms
CHEMBL382971
Indication Discovery agent Investigative [1587926]
Formula
C16H21N3O3
Canonical SMILES
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NCC#N
InChI
InChI=1S/C16H21N3O3/c1-3-12(2)14(15(20)18-10-9-17)19-16(21)22-11-13-7-5-4-6-8-13/h4-8,12,14H,3,10-11H2,1-2H3,(H,18,20)(H,19,21)/t12-,14-/m0/s1
InChIKey
JDHIDTYIXYVCAE-JSGCOSHPSA-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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