Drug General Information
Drug ID
D0U2SS
Former ID
DNC004595
Drug Name
MDL-2170
Synonyms
MDL-28170
Drug Type
Small molecular drug
Indication Discovery agent Terminated [545554]
Structure
Download
2D MOL

3D MOL

Formula
C22H26N2O4
Canonical SMILES
CC(C)C(C(=O)NC(CC1=CC=CC=C1)C=O)NC(=O)OCC2=CC=CC=C2
InChI
1S/C22H26N2O4/c1-16(2)20(24-22(27)28-15-18-11-7-4-8-12-18)21(26)23-19(14-25)13-17-9-5-3-6-10-17/h3-12,14,16,19-20H,13,15H2,1-2H3,(H,23,26)(H,24,27)/t19-,20+/m0/s1
InChIKey
NGBKFLTYGSREKK-VQTJNVASSA-N
PubChem Compound ID
Target and Pathway
Target(s) Calpain Target Info Inhibitor [529828]
Cathepsin B Target Info Inhibitor [530104]
Cathepsin L Target Info Inhibitor [530104]
Cysteine protease falcipain-2 Target Info Inhibitor [528208]
KEGG Pathway Protein processing in endoplasmic reticulum
Apoptosis
Alzheimer's diseasehsa04142:Lysosome
Antigen processing and presentationhsa04142:Lysosome
Phagosome
Antigen processing and presentation
Proteoglycans in cancer
Rheumatoid arthritis
NetPath Pathway TCR Signaling Pathway
IL2 Signaling PathwayNetPath_16:IL4 Signaling Pathway
TGF_beta_Receptor Signaling Pathway
Reactome Degradation of the extracellular matrixR-HSA-1442490: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
Collagen degradation
Degradation of the extracellular matrix
MHC class II antigen presentation
WikiPathways Focal Adhesion
Integrated Pancreatic Cancer Pathway
Alzheimers Disease
Integrin-mediated Cell AdhesionWP2572:Primary Focal Segmental Glomerulosclerosis FSGS
References
Ref 545554Trusted, scientifically sound profiles of drug programs, clinical trials, safety reports, and company deals, written by scientists. Springer. 2015. Adis Insight (drug id 800003692)
Ref 528208J Med Chem. 2006 Jun 1;49(11):3064-7.Novel peptidomimetic cysteine protease inhibitors as potential antimalarial agents.
Ref 529828Bioorg Med Chem Lett. 2009 Jan 15;19(2):502-7. Epub 2008 Nov 14.Design and synthesis of 4-aryl-4-oxobutanoic acid amides as calpain inhibitors.
Ref 530104J Med Chem. 2009 May 14;52(9):3093-7.Identification of 3-acetyl-2-aminoquinolin-4-one as a novel, nonpeptidic scaffold for specific calpain inhibitory activity.

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