Drug General Information
Drug ID
DX8FYI
Drug Name
(S)-2-((S)-1-(4-benzoylphenyl)-2,2,2-trifluoroethylamino)-N-(cyanomethyl)-4-methylpentanamide
Synonyms
CHEMBL426493
Indication Discovery agent Investigative [1587926]
Formula
C23H24F3N3O2
Canonical SMILES
CC(C)C[C@H](N[C@@H](c1ccc(cc1)C(=O)c2ccccc2)C(F)(F)F)C(=O)NCC#N
InChI
InChI=1S/C23H24F3N3O2/c1-15(2)14-19(22(31)28-13-12-27)29-21(23(24,25)26)18-10-8-17(9-11-18)20(30)16-6-4-3-5-7-16/h3-11,15,19,21,29H,13-14H2,1-2H3,(H,28,31)/t19-,21-/m0/s1
InChIKey
YNFROJBIFZUSFU-FPOVZHCZSA-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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