Drug Information

Drug General Information
Drug ID
D0EH1F
Former ID
DNC014613
Drug Name
1-(3-Nitro-benzyl)-1H-indole-5-carboxamidine
Drug Type
Small molecular drug
Indication Discovery agent Investigative [533527]
Structure
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2D MOL

3D MOL
Formula
C16H14N4O2
Canonical SMILES
C1=CC(=CC(=C1)[N+](=O)[O-])CN2C=CC3=C2C=CC(=C3)C(=N)N
InChI
1S/C16H14N4O2/c17-16(18)13-4-5-15-12(9-13)6-7-19(15)10-11-2-1-3-14(8-11)20(21)22/h1-9H,10H2,(H3,17,18)
InChIKey
SHTQZODGNRZEIP-UHFFFAOYSA-N
PubChem Compound ID
44332057
Target and Pathway
Target(s) Trypsin Target Info Inhibitor [533527]
KEGG Pathway Neuroactive ligand-receptor interaction
Pancreatic secretion
Protein digestion and absorption
Influenza A
Reactome Activation of Matrix Metalloproteinases
Cobalamin (Cbl, vitamin B12) transport and metabolism
WikiPathways Activation of Matrix Metalloproteinases
References
Ref 533527J Med Chem. 1983 Feb;26(2):294-8.Aromatic amidines: comparison of their ability to block respiratory syncytial virus induced cell fusion and to inhibit plasmin, urokinase, thrombin, and trypsin.
Ref 533527J Med Chem. 1983 Feb;26(2):294-8.Aromatic amidines: comparison of their ability to block respiratory syncytial virus induced cell fusion and to inhibit plasmin, urokinase, thrombin, and trypsin.

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