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药物靶标
激酶
CMGC：包含CDK，MAPK，GSK3，CLK家族
4-苯甲基-2-甲基-1,2,4-噻二唑烷-3,5-二酮

4-苯甲基-2-甲基-1,2,4-噻二唑烷-3,5-二酮

选择性，非ATP竞争性GSK-3β抑制剂

规格或纯度: ≥98%

CAS编号: 327036-89-5
分子式: C₁₀H₁₀N₂O₂S
分子量: 222.26
MDL号: MFCD04973552
PubChem编号: 4124851

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货号 (SKU)	包装规格	是否现货
T126722-5mg	5mg	现货
T126722-25mg	25mg	现货
T126722-100mg	100mg	现货

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glycogen synthase kinase 3 beta Inhibitor

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基本描述

规格或纯度	≥98%
英文名称	TDZD-8
别名	TDZD 8;TDZD8;NP 01139
英文别名	TDZD 8;TDZD8;GSK-3β Inhibitor I;NP 01139;4-Benzyl-2-methyl-1,2,4-thiadiazolidine-3,5-dione
生化机理	TDZD-8 is a selective inhibitor of GSK-3, a thiadiazolidinone derivative, non-ATP competitive inhibitor of GSK-3β (IC50 = 2 μM). It does not inhibit Cdk-1/cyclin B, CK-II, PKA or PKC at >100 μM. TDZD-8 has been proposed to bind to the kinase site of GSK-3β.Selective, non-ATP competitive GSK-3β inhibitor (IC 50 = 2 μM). Binds to the active site of GSK3β. Also inhibits PKC activity (IC 50 values are 1.4, 1.1 and 5.5 μM at βI, δ and ι isoforms respectively).
储存温度	-20°C储存
运输条件	超低温冰袋运输
备注	如果有可能，您尽量在使用的当天配置溶液，并在当天使用完它。但是，如果您需要预先配制储备溶液，我们建议您将溶液等份保存在-20°C的密封小瓶中。通常，它们最多可以使用一个月。在使用前和打开样品瓶之前，我们建议您让您的产品在室温下平衡至少1小时。需要更多关于溶解度，用法和处理的建议吗？请访问我们的常见问题（FAQ）页面以获取更多详细信息。
产品介绍	TDZD-8(NP 01139)是thiadiazolidinone的衍生物，是非ATP竞争性GSK-3β抑制剂，IC50为2 μM，对Cdk-1/cyclin B，CK-II，PKA和PKC无活性。TDZD-8 has been used to study the role of GSK-3 in maintaining MLL leukemia stem cell transcriptional program;TDZD-8 has also been used to analyze its effect on neural functions of the mouse olfactory bulb. TDZD-8(NP 01139) is a selective inhibitor of GSK-3, a thiadiazolidinone derivative, non-ATP competitive inhibitor of GSK-3β (IC50 = 2 μM); does not inhibit Cdk-1/cyclin B, CK-II, PKA or PKC at >100 μM. TDZD-8 has been used to study the role of GSK-3 in maintaining MLL leukemia stem cell transcriptional program;TDZD-8 has also been used to analyze its effect on neural functions of the mouse olfactory bulb.

名称和标识符

IUPAC Name	4-benzyl-2-methyl-1,2,4-thiadiazolidine-3,5-dione
INCHI	InChI=1S/C10H10N2O2S/c1-11-9(13)12(10(14)15-11)7-8-5-3-2-4-6-8/h2-6H,7H2,1H3
InChi Key	JDSJDASOXWCHPN-UHFFFAOYSA-N
Canonical SMILES	CN1C(=O)N(C(=O)S1)CC2=CC=CC=C2
分子式	C₁₀H₁₀N₂O₂S
PubChem CID	4124851
分子量	222.26

数据库链接

PubChem CID	4124851
ChEMBL Ligand	CHEMBL284861
CAS Registry No.	327036-89-5
Reactome Reaction	R-HSA-9687724
Reactome Drug	R-ALL-9687653
RCSB PDB Ligand	U3W

化学和物理性质

溶解性	25°C: DMSO
敏感性	对光敏感、对空气敏感、对热敏感
熔点	63 °C

安全信息

象形图	Health Hazard
信号词	Danger
危险声明	H334: May cause allergy or asthma symptoms or breathing difficulties if inhaled
预防措施声明	P261,P501,P284,P304+P340,P342+P316
WGK Germany	3
个人防护装备	dust mask type N95 (US), Eyeshields, Faceshields, Gloves

靶标

Target ID

2030

名称

glycogen synthase kinase 3 beta

缩写名

GSK3B

家族

GSK subfamily

基因和蛋白信息

Species	Transmembrane Domains	Amino Acids	Chromosomal Location	Gene Symbol	Gene Name
Human	2	420	3q13.33	GSK3B	glycogen synthase kinase 3 beta
Mouse	2	420	16 B3	Gsk3b	glycogen synthase kinase 3 beta
Rat	2	420	11q21	Gsk3b	glycogen synthase kinase 3 beta

Ensembl Gene

ENSG00000082701 (Hs) , ENSMUSG00000022812 (Mm) , ENSRNOG00000002833 (Rn)

Entrez Gene

2932 (Hs) , 56637 (Mm) , 84027 (Rn)

OMIM

605004 (Hs)

UniProtKB

P18266 (Rn) , P49841 (Hs) , Q9WV60 (Mm)

RefSeq Nucleotide

NM_001146156 (Hs) , NM_019827 (Mm) , NM_032080 (Rn)

RefSeq Protein

NP_001139628 (Hs) , NP_062801 (Mm) , NP_114469 (Rn)

Protein GI

225903437 (Hs) , 9790077 (Mm) , 14091770 (Rn)

ChEMBL Target

CHEMBL3669 (Rn) , CHEMBL1075321 (Mm) , CHEMBL262 (Hs)

关联配体

Ligand ID	5977
名称	GSK-3beta inhibitor I
别名	TDZD-8
类别	Synthetic organic
学名	4-benzyl-2-methyl-1,2,4-thiadiazolidine-3,5-dione
生物活性评价	The sulfonamide class of antibacterial compounds are primarily bacteriostatic agents and have a broad spectrum of activity against both Gram-positive and Gram-negative species of bacteria (reviewed in ).
评价	Using the code TDZD-8, this compound is used as a reference compound in . TDZD-8 is the first reported non-ATP competitive GSK-3β inhibitor , with positive effects on glucose homeostasis in obese mice . It is a thiadiazolidinone type compound.

参考文献

1. Martinez A, Alonso M, Castro A, Pérez C, Moreno FJ. (2002) First non-ATP competitive glycogen synthase kinase 3 beta (GSK-3beta) inhibitors: thiadiazolidinones (TDZD) as potential drugs for the treatment of Alzheimer's disease.. J Med Chem, 45 (6): (1292-9). [PMID:11881998]
2. Kaidanovich-Beilin O, Eldar-Finkelman H. (2006) Long-term treatment with novel glycogen synthase kinase-3 inhibitor improves glucose homeostasis in ob/ob mice: molecular characterization in liver and muscle.. J Pharmacol Exp Ther, 316 (1): (17-24). [PMID:16169938]
3. Zhang P, Hu HR, Huang ZH, Lei JY, Chu Y, Ye DY. (2012) Identification of novel scaffold of benzothiazepinones as non-ATP competitive glycogen synthase kinase-3β inhibitors through virtual screening.. Bioorg Med Chem Lett, 22 (23): (7232-6). [PMID:23099099]