Drug General Information
Drug ID
DXQ0UW
Drug Name
N-((S)-3-cyclohexyl-1-((S)-1-(5-fluoroindolin-1-yl)propan-2-ylamino)-1-oxopropan-2-yl)morpholine-4-carboxamide
Synonyms
CHEMBL213610
Indication Discovery agent Investigative [1587926]
Formula
C25H37FN4O3
Canonical SMILES
C[C@@H](CN1CCc2cc(F)ccc12)NC(=O)[C@H](CC3CCCCC3)NC(=O)N4CCOCC4
InChI
InChI=1S/C25H37FN4O3/c1-18(17-30-10-9-20-16-21(26)7-8-23(20)30)27-24(31)22(15-19-5-3-2-4-6-19)28-25(32)29-11-13-33-14-12-29/h7-8,16,18-19,22H,2-6,9-15,17H2,1H3,(H,27,31)(H,28,32)/t18-,22-/m0/s1
InChIKey
WMOMSFMNBOGEPA-AVRDEDQJSA-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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