TTD | Drug: D05QMJ

Drug General Information
Drug ID	D05QMJ
Former ID	DNC014733
Drug Name	RWJ-56423
Drug Type	Small molecular drug
Indication	Asthma [ICD10:J45]		Discontinued in Phase 1	[526697]
Structure		Download 2D MOL 3D MOL
Formula	C20H26N6O4S
Canonical SMILES	CC(=O)N1CC(CC1C(=O)NC(CCCN=C(N)N)C(=O)C2=NC3=CC=CC=C3S2<br />)O
InChI	1S/C20H26N6O4S/c1-11(27)26-10-12(28)9-15(26)18(30)24-14(6-4-8-23-20(21)22)17(29)19-25-13-5-2-3-7-16(13)31-19/h2-3,5,7,12,14-15,28H,4,6,8-10H2,1H3,(H,24,30)(H4,21,22,23)/t12-,14+,15+/m1/s1
InChIKey	VXDAVYUFYPFGDX-SNPRPXQTSA-N
PubChem Compound ID	5287596
Target and Pathway
Target(s)	Trypsin	Target Info	Inhibitor	[526956]
KEGG Pathway	Neuroactive ligand-receptor interaction
	Pancreatic secretion
	Protein digestion and absorption
	Influenza A
Reactome	Activation of Matrix Metalloproteinases
Reactome	Cobalamin (Cbl, vitamin B12) transport and metabolism
WikiPathways	Activation of Matrix Metalloproteinases
References
Ref 526697	Potent, small-molecule inhibitors of human mast cell tryptase. Antiasthmatic action of a dipeptide-based transition-state analogue containing a benzothiazole ketone. J Med Chem. 2003 Aug 28;46(18):3865-76.
Ref 526956	J Med Chem. 2004 Feb 12;47(4):769-87.Inhibitors of serine proteases as potential therapeutic agents: the road from thrombin to tryptase to cathepsin G.

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Drug Information