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TAK-715

强大的p38 MAPK抑制剂

规格或纯度: ≥99%

CAS编号: 303162-79-0
分子式: C₂₄H₂₁N₃OS
分子量: 399.51
MDL号: MFCD17012805
PubChem编号: 9952773

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货号 (SKU)	包装规格	是否现货
T125460-1mg	1mg	现货
T125460-5mg	5mg	现货
T125460-25mg	25mg	现货
T125460-100mg	100mg	现货

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mitogen-activated protein kinase 11 Inhibitor mitogen-activated protein kinase 14 Inhibitor

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基本描述

规格或纯度	≥99%
英文名称	TAK-715
别名	N-(4-(2-Ethyl-4-(3-methylphenyl)-1，3-thiazol-5-yl)-2-pyridyl)benzamide
英文别名	N-(4-(2-Ethyl-4-(3-methylphenyl)-1，3-thiazol-5-yl)-2-pyridyl)benzamide
生化机理	TAK-715 is a inhibitor of p38 MAPK (IC50 = 7.1 nM for p38 MAPKα). TAK-715 also inhibits Wnt-3a-stimulated β-catenin signaling. Inhibits 22 kinases by more than 80%, including CKIδ/ε. Anti-inflammatory and anti-rheumatoid arthritis agent. Orally bioavailable.Potent p38 MAPK inhibitor (IC 50 = 7.1 nM at p38 MAPKα). Additionally inhibits Wnt-3a stimulated β-catenin signaling and shows cross-reactivity with casein kinase Iδ and ε. Antirheumatic. Active in vivo .
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	TAK-715 TAK-715

名称和标识符

IUPAC Name	N-[4-[2-ethyl-4-(3-methylphenyl)-1,3-thiazol-5-yl]pyridin-2-yl]benzamide
INCHI	InChI=1S/C24H21N3OS/c1-3-21-27-22(18-11-7-8-16(2)14-18)23(29-21)19-12-13-25-20(15-19)26-24(28)17-9-5-4-6-10-17/h4-15H,3H2,1-2H3,(H,25,26,28)
InChi Key	HEKAIDKUDLCBRU-UHFFFAOYSA-N
Canonical SMILES	CCC1=NC(=C(S1)C2=CC(=NC=C2)NC(=O)C3=CC=CC=C3)C4=CC=CC(=C4)C
分子式	C₂₄H₂₁N₃OS
PubChem CID	9952773
分子量	399.51

数据库链接

PubChem CID	9952773
ChEMBL Ligand	CHEMBL363648
CAS Registry No.	303162-79-0
BindingDB Ligand	50173609
RCSB PDB Ligand	T75

化学和物理性质

溶解性	DMSO≥40 mg/mL in DMSO; insoluble in H2O; ≥12.13 mg/mL in EtOH with ultrasonic

安全信息

象形图	Harmful
信号词	Warning
危险声明	H319: Causes serious eye irritation H302: Harmful if swallowed
预防措施声明	P305+P351+P338,P280,P501,P264,P270,P330,P264+P265,P301+P317,P337+P317
WGK Germany	3

靶标

Target ID

1499

名称

mitogen-activated protein kinase 14

缩写名

p38α

家族

p38 subfamily

别名

D7Ertd680e

基因和蛋白信息

Species	Transmembrane Domains	Amino Acids	Chromosomal Location	Gene Symbol	Gene Name
Human	2	360	6p21.31	MAPK14	mitogen-activated protein kinase 14
Mouse	2	360	17 14.85 cM	Mapk14	mitogen-activated protein kinase 14
Rat	2	360	20p12	Mapk14	mitogen activated protein kinase 14

Ensembl Gene

ENSG00000112062 (Hs) , ENSMUSG00000053436 (Mm) , ENSRNOG00000000513 (Rn)

Entrez Gene

26416 (Mm) , 81649 (Rn) , 1432 (Hs)

OMIM

600289 (Hs)

Protein GI

20986516 (Hs) , 270341386 (Mm) , 62461582 (Rn)

UniProtKB

P47811 (Mm) , P70618 (Rn) , Q16539 (Hs)

RefSeq Nucleotide

NM_001168508 (Mm) , NM_001315 (Hs) , NM_031020 (Rn)

RefSeq Protein

NP_001161980 (Mm) , NP_001161985 (Mm) , NP_001161986 (Mm) , NP_001306 (Hs) , NP_036081 (Mm) , NP_112282 (Rn)

ChEMBL Target

CHEMBL2336 (Mm) , CHEMBL4825 (Rn) , CHEMBL260 (Hs)

Target ID

1500

名称

mitogen-activated protein kinase 11

缩写名

p38β

家族

p38 subfamily

别名

D7Ertd680e

基因和蛋白信息

Species	Transmembrane Domains	Amino Acids	Chromosomal Location	Gene Symbol	Gene Name
Human	2	364	22q13.33	MAPK11	mitogen-activated protein kinase 11
Mouse	2	364	15 E3	Mapk11	mitogen-activated protein kinase 11
Rat	2	364	7q34	Mapk11	mitogen-activated protein kinase 11

Ensembl Gene

ENSG00000185386 (Hs) , ENSMUSG00000053137 (Mm) , ENSRNOG00000006984 (Rn)

Entrez Gene

19094 (Mm) , 689314 (Rn) , 5600 (Hs)

OMIM

602898 (Hs)

Protein GI

20128774 (Hs) , 201023331 (Rn) , 168693637 (Mm)

UniProtKB

Q15759 (Hs) , Q9WUI1 (Mm)

RefSeq Nucleotide

NM_001109532 (Rn) , NM_002751 (Hs) , NM_011161 (Mm)

RefSeq Protein

NP_001103002 (Rn) , NP_002742 (Hs) , NP_035291 (Mm)

DrugBank Target

Q15759 (Hs)

ChEMBL Target

CHEMBL4335 (Mm) , CHEMBL3961 (Hs)

关联配体

Ligand ID	9328
名称	TAK-715
别名	TAK 715
类别	Synthetic organic
学名	N-[4-[2-ethyl-4-(3-methylphenyl)-1,3-thiazol-5-yl]pyridin-2-yl]benzamide
生物活性评价	TAK-715 inhibits LPS-induced TNFα production in vitro and in vivo, shows good bioavailability in rodents and no inhibitory activity for major CYP450 drug-metabolising enzymes . It shows efficacy in a rat adjuvant-induced arthritis model.
评价	TAK-715 was developed as a p38 MAP kinase inhibitor, with anti-TNFα activity of potential clinical use as an anti-rheumatoid arthritis (RA) agent . TAK-715 is now available for repurposing via the MRC-Industry Asset Sharing Initiative 2016 (full compound list).

参考文献

1. Miwatashi S, Arikawa Y, Kotani E, Miyamoto M, Naruo K, Kimura H, Tanaka T, Asahi S, Ohkawa S. (2005) Novel inhibitor of p38 MAP kinase as an anti-TNF-alpha drug: discovery of N-[4-[2-ethyl-4-(3-methylphenyl)-1,3-thiazol-5-yl]-2-pyridyl]benzamide (TAK-715) as a potent and orally active anti-rheumatoid arthritis agent.. J Med Chem, 48 (19): (5966-79). [PMID:16162000]