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Merck
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主要文件

444283

Sigma-Aldrich

MMP-13抑制剂

The MMP-13 Inhibitor, also referenced under CAS 544678-85-5, controls the biological activity of MMP-13. This small molecule/inhibitor is primarily used for Protease Inhibitors applications.

别名:

MMP-13抑制剂, 嘧啶-4,6-二羧酸,-(4-氟-3-甲基-苄基酰胺)

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About This Item

经验公式(希尔记法):
C22H20F2N4O2
分子量:
410.42
MDL编号:
UNSPSC代码:
12352200
NACRES:
NA.77

质量水平

方案

≥98% (HPLC)

表单

solid

制造商/商品名称

Calbiochem®

储存条件

OK to freeze
protect from light

颜色

light yellow

溶解性

DMSO: 10 mg/mL

运输

ambient

储存温度

2-8°C

SMILES字符串

Fc1c(cc(cc1)CNC(=O)c2ncnc(c2)C(=O)NCc3cc(c(cc3)F)C)C

InChI

1S/C22H20F2N4O2/c1-13-7-15(3-5-17(13)23)10-25-21(29)19-9-20(28-12-27-19)22(30)26-11-16-4-6-18(24)14(2)8-16/h3-9,12H,10-11H2,1-2H3,(H,25,29)(H,26,30)

InChI key

PYFRREJCFXFNRR-UHFFFAOYSA-N

一般描述

MMP-13活性的强效抑制剂(IC50=8 nM),并通过构象结构分析确定对MMP-1,-2,-3,-7,-8,-9,-10,-12,-14和-16具有预期的选择性。显示与MMP-13催化结构域结合并充当非锌螯合抑制剂。
一种嘧啶二甲酰胺化合物,可有效抑制MMP-13活性(IC50=8 nM),并通过构象结构分析确定对MMP-1,-2,-3,-7,-8,-9,-10,-12,-14和-16具有预期的选择性。显示与MMP-13催化结构域结合并充当非锌螯合抑制剂。

生化/生理作用

主要靶标
MMP-13活性
产物不与ATP竞争。
可逆:否
细胞渗透性:否
靶标IC50:MMP-13为8 nM

包装

用惰性气体包装

警告

毒性:标准处理(A)

制备说明

使用前立即用缓冲液进一步稀释。

重悬

复溶后,等分并冷冻保存(-20°C)。贮备液在-20°C下可稳定保存至多6个月。

其他说明

Engel, C.K., et al. 2005.Chem. Biol.12, 181.

法律信息

CALBIOCHEM is a registered trademark of Merck KGaA, Darmstadt, Germany

储存分类代码

11 - Combustible Solids

WGK

WGK 1

闪点(°F)

Not applicable

闪点(°C)

Not applicable


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Christian K Engel et al.
Chemistry & biology, 12(2), 181-189 (2005-03-01)
Inhibitors for matrix metalloproteinases (MMPs) are under investigation for the treatment of cancer, arthritis, and cardiovascular disease. Here, we report a class of highly selective MMP-13 inhibitors (pyrimidine dicarboxamides) that exhibit no detectable activity against other MMPs. The high-resolution X-ray
Spenser S Smith et al.
eLife, 11 (2022-06-07)
Precise developmental control of jaw length is critical for survival, but underlying molecular mechanisms remain poorly understood. The jaw skeleton arises from neural crest mesenchyme (NCM), and we previously demonstrated that these progenitor cells express more bone-resorbing enzymes including Matrix
Kristina Viiklepp et al.
The Journal of investigative dermatology (2021-11-11)
Cutaneous squamous cell carcinoma (cSCC) is the most common metastatic skin cancer with increasing incidence worldwide. Previous studies have demonstrated the role of complement system in cSCC progression. In this study we have investigated the mechanistic role of serine protease

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