Drug General Information
Drug ID
D0VE0F
Former ID
DNC006243
Drug Name
(S)-1-benzylcyclopentyl 1-oxohexan-2-ylcarbamate
Drug Type
Small molecular drug
Indication Discovery agent Investigative [527872]
Structure
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2D MOL

3D MOL

Formula
C19H27NO3
Canonical SMILES
CCCCC(C=O)NC(=O)OC1(CCCC1)CC2=CC=CC=C2
InChI
1S/C19H27NO3/c1-2-3-11-17(15-21)20-18(22)23-19(12-7-8-13-19)14-16-9-5-4-6-10-16/h4-6,9-10,15,17H,2-3,7-8,11-14H2,1H3,(H,20,22)/t17-/m0/s1
InChIKey
ONABDOMWRCXLPX-KRWDZBQOSA-N
PubChem Compound ID
Target and Pathway
Target(s) Cathepsin B Target Info Inhibitor [527872]
Cathepsin L Target Info Inhibitor [527872]
Cathepsin K Target Info Inhibitor [527872]
KEGG Pathway Lysosome
Antigen processing and presentationhsa04142:Lysosome
Phagosome
Antigen processing and presentation
Proteoglycans in cancer
Rheumatoid arthritishsa04142:Lysosome
Osteoclast differentiation
Toll-like receptor signaling pathway
Rheumatoid arthritis
NetPath Pathway TCR Signaling Pathway
IL2 Signaling PathwayNetPath_16:IL4 Signaling Pathway
TGF_beta_Receptor Signaling PathwayNetPath_7:TGF_beta_Receptor Signaling Pathway
RANKL Signaling Pathway
IL2 Signaling Pathway
Reactome Collagen degradation
Trafficking and processing of endosomal TLR
Assembly of collagen fibrils and other multimeric structures
MHC class II antigen presentationR-HSA-1236977:Endosomal/Vacuolar pathway
Degradation of the extracellular matrix
MHC class II antigen presentationR-HSA-1442490:Collagen degradation
Activation of Matrix Metalloproteinases
MHC class II antigen presentation
WikiPathways Primary Focal Segmental Glomerulosclerosis FSGSWP2018:RANKL/RANK Signaling Pathway
Osteoclast Signaling
References
Ref 527872Bioorg Med Chem Lett. 2006 Feb 15;16(4):978-83. Epub 2005 Nov 15.Semicarbazone-based inhibitors of cathepsin K, are they prodrugs for aldehyde inhibitors?.
Ref 527872Bioorg Med Chem Lett. 2006 Feb 15;16(4):978-83. Epub 2005 Nov 15.Semicarbazone-based inhibitors of cathepsin K, are they prodrugs for aldehyde inhibitors?.

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