Drug General Information
Drug ID
D04BGT
Former ID
DNC010608
Drug Name
4-propyl-6-m-tolylpyrimidine-2-carbonitrile
Drug Type
Small molecular drug
Indication Discovery agent Investigative [531005]
Structure
Download
2D MOL

3D MOL

Formula
C15H15N3
Canonical SMILES
CCCC1=NC(=NC(=C1)C2=CC(=CC=C2)C)C#N
InChI
1S/C15H15N3/c1-3-5-13-9-14(18-15(10-16)17-13)12-7-4-6-11(2)8-12/h4,6-9H,3,5H2,1-2H3
InChIKey
LWTLVKKUNGVFHE-UHFFFAOYSA-N
PubChem Compound ID
Target and Pathway
Target(s) Cathepsin K Target Info Inhibitor [531005]
Cathepsin S Target Info Inhibitor [531005]
KEGG Pathway Lysosome
Osteoclast differentiation
Toll-like receptor signaling pathway
Rheumatoid arthritishsa04142:Lysosome
Phagosome
Antigen processing and presentation
Tuberculosis
NetPath Pathway TGF_beta_Receptor Signaling Pathway
RANKL Signaling Pathway
IL2 Signaling PathwayNetPath_22:Leptin Signaling Pathway
IL2 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 SignalingWP2796:Class I MHC mediated antigen processing & presentation
Trafficking and processing of endosomal TLR
References
Ref 531005Bioorg Med Chem Lett. 2010 Aug 1;20(15):4447-50. Epub 2010 Jun 15.2-Phenyl-9H-purine-6-carbonitrile derivatives as selective cathepsin S inhibitors.
Ref 531005Bioorg Med Chem Lett. 2010 Aug 1;20(15):4447-50. Epub 2010 Jun 15.2-Phenyl-9H-purine-6-carbonitrile derivatives as selective cathepsin S inhibitors.

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