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Merck
CN
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文件

安全信息

SML1465

Sigma-Aldrich

UNC0379 trifluoroacetate salt

≥98% (HPLC)

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别名:
6,7-Dimethoxy-2-(pyrrolidin-1-yl)-N-(5-(pyrrolidin-1-yl)-pentyl)quinazolin-4-amine trifluoroacetate salt
经验公式（希尔记法）:
C23H35N5O2 · xC2HF3O2
CAS号:
1620401-83-3
分子量:
413.56 (free base basis)
MDL编号:
MFCD28167817
UNSPSC代码:
12352200
PubChem化学物质编号:
329825899
NACRES:
NA.77

质量水平

100

检测方案

≥98% (HPLC)

形式

powder

储存条件

desiccated

颜色

white to beige

溶解性

H2O: 5 mg/mL, clear

储存温度

2-8°C

SMILES字符串

COC1=C(OC)C=C(N=C(N2CCCC2)N=C3NCCCCCN4CCCC4)C3=C1

InChI

1S/C23H35N5O2/c1-29-20-16-18-19(17-21(20)30-2)25-23(28-14-8-9-15-28)26-22(18)24-10-4-3-5-11-27-12-6-7-13-27/h16-17H,3-15H2,1-2H3,(H,24,25,26)

InChI key

WEXCGGWTIDNVNT-UHFFFAOYSA-N

生化/生理作用

SETD8 expression is observed in cancers such as bladder cancer, chronic myelogenous leukemia, hepatocellular carcinoma, non‐small‐cell lung carcinoma, prostate cancer, small‐cell lung carcinoma. Therefore inhibition of SETD8 (SET‐domain containing protein) by UNC0379 might prevent the progression of cancer.
UNC0379 is the first substrate-competitive inhibitor of the lysine methyltransferase SETD8, the only known methyltransferase that catalyzes monomethylation of histone H4 lysine 20 (H4K20). HK420 methylation has been implicated in the regulation of a variety of biological processes including the DNA damage response. UNC0379 is selective for SETD8 over 15 other methyltransferases, with an IC50 value of 7.3 μM for SETD8 compared to IC50 vlaues over 100 μM for other methyltransferases.

WGK

WGK 3

闪点(°F)

Not applicable

闪点(°C)

Not applicable

法规信息

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Olivia G Dobbs et al.
BMC biology, 21(1), 175-175 (2023-08-15)
Cip1-interacting zinc finger protein 1 (CIZ1) forms RNA-dependent protein assemblies that stabilise epigenetic state, notable at the inactive X chromosome in females. CIZ1 has been linked with a range of human cancers and in mice genetic deletion of CIZ1 manifests
Dysregulation of protein methyltransferases in human cancer: an emerging target class for anticancer therapy.
Hamamoto R and Nakamura Y
Cancer Science, 107(4), 377-384 (2016)
Miku Wada et al.
Biomolecules, 10(12) (2020-12-20)
The histone methyltransferase SETD8, which methylates the lysine 20 of histone H4 (H4K20), is reportedly involved in human carcinogenesis along with nonhistone proteins such as p53. However, its expression profiles and functions in the context of high-grade serous ovarian carcinoma

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