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Description: N6022 is a selective, first-in-class and reversible inhibitor of S-nitrosoglutathione reductase (GSNOR) with IC50 of 8 nM and Ki of 2.5 nM. Inhibition of GSNOR causes the accumulation of GSNO which acts as a vasodilator and anti-inflammatory factor. N6022 presents an IC50 value of 8nM in the GSNO reduction assay and 32nM in the HMGSH oxidation assay. The Ki values are 2.5nM and 3.1nM, respectively. N6022 is selective against GSNOR over other human ADH enzymes. The IC50 values are 21uM, 67uM and 0.5uM for ADH IB, ADH II and ADH IV, respectively.
References: Biochemistry. 2012 Mar 13; 51(10):2157-68; ACS Med Chem Lett. 2011 Mar 11; 2(5):402-6.
Chemical Name: 3-(5-(4-(1H-imidazol-1-yl)phenyl)-1-(4-carbamoyl-2-methylphenyl)-1H-pyrrol-2-yl)propanoic acid
InChi Key: YVPGZQLRPAGKLA-UHFFFAOYSA-N
InChi Code: InChI=1S/C24H22N4O3/c1-16-14-18(24(25)31)4-9-21(16)28-20(8-11-23(29)30)7-10-22(28)17-2-5-19(6-3-17)27-13-12-26-15-27/h2-7, 9-10, 12-15H, 8, 11H2, 1H3, (H2, 25, 31)(H, 29, 30)
SMILES Code: O=C(O)CCC1=CC=C(C2=CC=C(N3C=CN=C3)C=C2)N1C4=CC=C(C(N)=O)C=C4C
N6022; N-6022; N 6022
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