Drug General Information
Drug ID
DX1BM6
Drug Name
[(S)-1-((S)-3-Hydroxy-2-oxo-1-phenethyl-propylcarbamoyl)-2-methyl-butyl]-carbamic acid benzyl ester
Synonyms
CHEMBL99561
Indication Discovery agent Investigative [1587926]
Formula
C25H32N2O5
Canonical SMILES
CCC(C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](CCc2ccccc2)C(=O)CO
InChI
InChI=1S/C25H32N2O5/c1-3-18(2)23(27-25(31)32-17-20-12-8-5-9-13-20)24(30)26-21(22(29)16-28)15-14-19-10-6-4-7-11-19/h4-13,18,21,23,28H,3,14-17H2,1-2H3,(H,26,30)(H,27,31)/t18?,21-,23-/m0/s1
InChIKey
SWDBTDNRUQLZFB-BUQVANKGSA-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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