[CAS NO. 2988594-85-8] AFM32ahydrochloride

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Catalog:	HY-136557A
Brand:	MCE
CAS:	2988594-85-8

Overview

MDL	-
Molecular Weight	517.00
Molecular Formula	C25H30ClFN6O3
SMILES	O=C(C1=CC=CC(CN2)=C1C2=O)N[C@H](C3=NC4=C(OCC)C=CC=C4N3C)CCCNC(CF)=N.[H]Cl

For research use only. We do not sell to patients.

1 Publications Citing Use of MCE

[1]Front Immunol. 01 December 2021.

Summary

PAD2-IN-1 hydrochloride, a benzimidazole-based derivative, is a potent and selective protein arginine deiminase 2 (PAD2) inhibitor. PAD2-IN-1 hydrochloride shows superior selectivity for PAD2 over PAD4 (95-fold) and PAD3 (79-fold) ^[1] .

IC50 & Target

Protein Arginine Deiminase 2 (PAD2) ^[1]

In Vitro

In the target engagement assay, the EC ₅₀ of PAD2-IN-1 (compound 32a) hydrochloride is 8.3 μM in HEK293T/PAD2 cells, the enhanced potency of PAD2-IN-1 overcomes its relatively poor ability to enter cells ^[1] .
PAD2-IN-1 (compound 32a; 1-25 μM) hydrochloride treatment strongly inhibits histone H3 citrullination with an EC ₅₀ of 2.7 μM in HEK293T/PAD2 cells ^[1] .

MCE has not independently confirmed the accuracy of these methods. They are for reference only.

Appearance

Solid

Shipping

Room temperature in continental US; may vary elsewhere.

Storage

4°C, sealed storage, away from moisture and light

* In solvent : -80°C, 6 months; -20°C, 1 month (sealed storage, away from moisture and light)

References

[1] Aaron Muth, et al. Development of a Selective Inhibitor of Protein Arginine Deiminase 2. J Med Chem. 2017 Apr 13;60(7):3198-3211.

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