Drug General Information
Drug ID
DXF74T
Drug Name
(4-Chloro-2-trifluoromethyl-phenyl)-carbamic acid (3R)-2-oxo-1-{[4-oxo-(1S)-1-phenethylpent-2-enylcarbamoyl]-methyl}-5-phenyl-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-ylmethylester
Synonyms
CHEMBL450459
Indication Discovery agent Investigative [1587926]
Formula
C39H34ClF3N4O5
Canonical SMILES
CC(=O)\\C=C\\[C@H](CCc1ccccc1)NC(=O)CN2C(=O)[C@@H](COC(=O)Nc3ccc(Cl)cc3C(F)(F)F)N=C(c4ccccc4)c5ccccc25
InChI
InChI=1S/C39H34ClF3N4O5/c1-25(48)16-19-29(20-17-26-10-4-2-5-11-26)44-35(49)23-47-34-15-9-8-14-30(34)36(27-12-6-3-7-13-27)45-33(37(47)50)24-52-38(51)46-32-21-18-28(40)22-31(32)39(41,42)43/h2-16,18-19,21-22,29,33H,17,20,23-24H2,1H3,(H,44,49)(H,46,51)/b19-16+/t29-,33-/m1/s1
InChIKey
FOKNRHPLVHWJHK-SFTMMTGKSA-N
Target and Pathway
Target(s) Cathepsin L Target Info [1587926]
Cathepsin B Target Info [1587926]
KEGG Pathway Lysosome
Phagosome
Antigen processing and presentation
Proteoglycans in cancer
Rheumatoid arthritishsa04142:Lysosome
NetPath Pathway IL4 Signaling Pathway
TGF_beta_Receptor Signaling PathwayNetPath_11:TCR Signaling Pathway
IL2 Signaling Pathway
Reactome Endosomal/Vacuolar pathway
Collagen degradation
Degradation of the extracellular matrix
Trafficking and processing of endosomal TLR
Assembly of collagen fibrils and other multimeric structures
MHC class II antigen presentationR-HSA-1442490:Collagen degradation
MHC class II antigen presentation
WikiPathways 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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