862812-98-4

862812-98-4 structure

Name: IKK-3 Inhibitor
Chemical Name: 5-(5,6-dimethoxybenzimidazol-1-yl)-3-[(2-methylsulfonylphenyl)methoxy]thiophene-2-carbonitrile
CAS Number: 862812-98-4
Molecular Formula: C₂₂H₁₉N₃O₅S₂
Molecular Weight: 469.533
Catalog: Research Areas Inflammation/Immunology
Create Date: 2017-07-09 04:03:33
Modify Date: 2024-01-08 23:24:42
IKK-3 Inhibitor is a dual inhibitor of TBK1 and IKKε with IC50s of 93 nM and 469 nM, respectively. IKK-3 Inhibitor also inhibits IKK2 with an IC50 of 790 nM.

Name	5-(5,6-dimethoxybenzimidazol-1-yl)-3-[(2-methylsulfonylphenyl)methoxy]thiophene-2-carbonitrile
Synonyms	HMS3229F19 5-(5,6-Dimethoxy-1H-benzimidazol-1-yl)-3-{[2-(methylsulfonyl)benzyl]oxy}-2-thiophenecarbonitrile 5-(5,6-dimethoxy-1H-benzimidazol-1-yl)-3-{[2-(methylsulfonyl)benzyl]oxy}thiophene-2-carbonitrile 2-Thiophenecarbonitrile, 5-(5,6-dimethoxy-1H-benzimidazol-1-yl)-3-[[2-(methylsulfonyl)phenyl]methoxy]- IKK-3 Inhibitor

Description	IKK-3 Inhibitor is a dual inhibitor of TBK1 and IKKε with IC50s of 93 nM and 469 nM, respectively. IKK-3 Inhibitor also inhibits IKK2 with an IC50 of 790 nM.
Related Catalog	Research Areas >> Inflammation/Immunology
Target	TBK1:93 nM (IC50) IKK-ε:469 nM (IC50) IKK2:790 nM (IC50)
In Vitro	IKK-3 Inhibitor (Compound 1) inhibits TBK1 enzyme with an IC50 of 93 nM, which also translates into good cell potency (72 nM). Moreover, IKK-3 Inhibitor exhibits excellent selectivity against cell-cycle kinases CDK2 and AurB[1]. IKK-3 Inhibitor (Compound 13) is a novel IκB kinase 2 (IKK2) inhibitor with an IC50 of 790 nM[2].
References	[1]. Johannes JW, et al. Discovery of 6-aryl-azabenzimidazoles that inhibit the TBK1/IKK-ε kinases. Bioorg Med Chem Lett. 2014 Feb 15;24(4):1138-43. [2]. Xie HZ, et al. Pharmacophore modeling and hybrid virtual screening for the discovery of novel IκB kinase 2 (IKK2) inhibitors. J Biomol Struct Dyn. 2011 Aug;29(1):165-79.