Drug General Information
Drug ID
D0FV9Y
Former ID
DNC008201
Drug Name
PhSO2-Gly-(Me-Gly)-Arg-(2-thiazole)
Drug Type
Small molecular drug
Indication Discovery agent Investigative [529193]
Structure
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2D MOL

3D MOL

Formula
C20H27N7O5S2
Canonical SMILES
CN(CC(=O)NC(CCCN=C(N)N)C(=O)C1=NC=CS1)C(=O)CNS(=O)(=O)C<br />2=CC=CC=C2
InChI
1S/C20H27N7O5S2/c1-27(17(29)12-25-34(31,32)14-6-3-2-4-7-14)13-16(28)26-15(8-5-9-24-20(21)22)18(30)19-23-10-11-33-19/h2-4,6-7,10-11,15,25H,5,8-9,12-13H2,1H3,(H,26,28)(H4,21,22,24)/t15-/m0/s1
InChIKey
GJNJUHMPYZAMBU-HNNXBMFYSA-N
PubChem Compound ID
Target and Pathway
Target(s) Coagulation factor Xa Target Info Inhibitor [529193]
KEGG Pathway Complement and coagulation cascades
PANTHER Pathway Blood coagulation
Pathway Interaction Database Beta2 integrin cell surface interactions
PathWhiz Pathway Coagulation
Reactome Extrinsic Pathway of Fibrin Clot Formation
Intrinsic Pathway of Fibrin Clot Formation
Common Pathway of Fibrin Clot Formation
Gamma-carboxylation of protein precursors
Transport of gamma-carboxylated protein precursors from the endoplasmic reticulum to the Golgi apparatus
Removal of aminoterminal propeptides from gamma-carboxylated proteins
WikiPathways Complement and Coagulation Cascades
Human Complement System
PTM: gamma carboxylation, hypusine formation and arylsulfatase activation
Blood Clotting Cascade
Formation of Fibrin Clot (Clotting Cascade)
References
Ref 529193Bioorg Med Chem. 2008 Feb 15;16(4):1562-95. Epub 2007 Nov 6.Inhibitors of proteases and amide hydrolases that employ an alpha-ketoheterocycle as a key enabling functionality.
Ref 529193Bioorg Med Chem. 2008 Feb 15;16(4):1562-95. Epub 2007 Nov 6.Inhibitors of proteases and amide hydrolases that employ an alpha-ketoheterocycle as a key enabling functionality.

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