Drug General Information
Drug ID
DX8SNS
Drug Name
2-[3-(1H-Indol-6-yl)-phenyl]-4-methyl-pentanoic acid cyanomethyl-amide
Synonyms
CHEMBL122318
Indication Discovery agent Investigative [1587926]
Formula
C22H23N3O
Canonical SMILES
CC(C)CC(C(=O)NCC#N)c1cccc(c1)c2ccc3cc[nH]c3c2
InChI
InChI=1S/C22H23N3O/c1-15(2)12-20(22(26)25-11-9-23)19-5-3-4-17(13-19)18-7-6-16-8-10-24-21(16)14-18/h3-8,10,13-15,20,24H,11-12H2,1-2H3,(H,25,26)
InChIKey
QBNGROARPWCXCH-UHFFFAOYSA-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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