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94

抑制剂 & 化合物

2

天然产物

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Cat. No.	Product Name	Target	Signaling Pathways
T8719	SC99	Apoptosis; JAK; STAT	Angiogenesis; Apoptosis; Chromatin/Epigenetic; JAK/STAT signaling; Stem Cells
	SC99 是一种口服有效选择性STAT3抑制剂，靶向 JAK2-STAT3 途径，抑制血小板活化和聚集，有抗骨髓瘤和抗血栓活性。它结合在 JAK2 的 ATP 结合袋中，抑制 JAK2 和 STAT3 的磷酸化。
T6541	Ibutilide Fumarate Corvert Fumarate,U70226E,富马酸伊布利特	Calcium Channel; Sodium Channel	Membrane transporter/Ion channel; Metabolism
	Ibutilide Fumarate (U70226E) 是一种 III 类抗心律失常药物，可作用于急性心梗阻塞。
T8491	Vorolanib CM082,X-82	VEGFR; PDGFR	Angiogenesis; Tyrosine Kinase/Adaptors
	Vorolanib (X-82) 是一种有效的 ATP 结合盒 (ABC) 转运蛋白抑制剂，是一种有效的、具有口服活性的 VEGFR/PDGFR 抑制剂，是一种血管生成抑制剂，与 ZD1839 联用具有抗肿瘤作用。
T3148	MK-571 sodium L-660711 (sodium salt),L-660711 sodium salt,Verlukast sodium,L-660711,MK571,MK-571 sodium salt,Propanoic acid	Leukotriene Receptor; LTR	GPCR/G Protein; Immunology/Inflammation
	MK-571 sodium (L-660711 sodium salt) 是一种可口服的选择性白三烯 D4受体拮抗剂，在豚鼠和人肺膜的 Ki 分别为0.22 和 2.1 nM。
T6152	PD318088	MEK	MAPK
	PD318088 是非 ATP 竞争性的MEK1/2变构抑制剂，是 PD184352 的结构类似物。它在MEK1 活性位点与 ATP 结合位点相邻的区域与 ATP 同时结合，可用于癌症研究。
T24111	GSK3i XIII GSK3 inhibitor XIII,GSK3iXIII,GSK3i-XIII	GSK-3	PI3K/Akt/mTOR signaling; Stem Cells
	GSK3i XIII (GSK3 inhibitor XIII) 是ATP 竞争性GSK-3抑制剂(Ki: 24 nM)。
TQ0186	Ko 143	BCRP; ABC	Membrane transporter/Ion channel
	Ko 143 有效且选择性抑制 ATP 结合盒亚家族 G 成员 2 (ABCG2/BCRP)
T15385	Glibornuride	Potassium Channel	Membrane transporter/Ion channel
	Glibornuride 是对 ATP 敏感的 K+通道 (KATP 通道) 阻滞剂，pKi 为 5.75。Glibornuride 显示抗糖尿病活性。
T13547L	AMP-PCP disodium	HSP	Cytoskeletal Signaling; Metabolism
	AMP-PCP disodium 是一种 ATP 类似物，具有与 Hsp90 N 末端结构域的结合亲和力，其 Kd 值为 3.8 μM。AMP-PCP disodium 的结合有助于形成 Hsp90 活性同型二聚体。
T15375	Inavolisib GDC-0077,RG6114	Apoptosis; PI3K	Apoptosis; PI3K/Akt/mTOR signaling
	Inavolisib (GDC-0077) 是一种可口服的选择性PI3Kα抑制剂，IC50值为0.038 nM。Inavolisib 通过与 PI3K 的 ATP 结合位点结合而发挥其活性，从而抑制了 PIP2 到 PIP3 的磷酸化。
T8864	Thymidylate Kinase Inhibitor, YMU1	Others	Others
	YMU1 是一种选择性抑制剂，特异性作用于人胸苷酸激酶 (IC50: 610 nM) 。
T10585	Bozitinib CBT-101,PLB-1001	c-Met/HGFR	Tyrosine Kinase/Adaptors
	Bozitinib (PLB-1001) 是一种可透过血脑屏障的、高效的、选择性的的、 ATP 竞争性的小分子 c-MET 激酶抑制剂，能够与酪氨酸激酶超家族的常规 ATP 结合口袋结合。
T12609	R-10015	LIM Kinase; Reverse Transcriptase	Cell Cycle/Checkpoint; Microbiology/Virology
	R-10015 是一种高效选择性 LIMK 抑制剂，通过结合 ATP 结合口袋阻断 LIMK，抑制人 LIMK1 的 IC50值为 38 nM。它还发挥广谱抗病毒作用，可用于 HIV 感染研究。
T10965	DBPR112	EGFR	Angiogenesis; JAK/STAT signaling; Tyrosine Kinase/Adaptors
	DBPR112 是一种口服有效的基于氟嘧啶的 EGFR 抑制剂，对 EGFRWT 和 EGFRL858R/T790M 的 IC50 分别为 15 nM 和 48 nM。DBPR112 可以占据 ATP 结合位点。DBPR112 具有显着的抗肿瘤功效。
T6337	RepSox ALK5 Inhibitor II,SJN 2511,E-616452	ALK; TGF-beta/Smad	Angiogenesis; Stem Cells; Tyrosine Kinase/Adaptors
	RepSox (ALK5 Inhibitor II) 是一种 TGFβR-1/ALK5 的抑制剂，可以抑制 ATP 与 ALK5 结合以及 ALK5 自磷酸化 (IC50=23/4 nM)，具有选择性。RepSox 可以诱导 MEFs 细胞的脂肪生成。
T11348	G907	Antibiotic	Microbiology/Virology
	G907 是一种具有选择性和有效性的小分子ATP 结合盒 (ABC) 转运蛋白 MsbA 的拮抗剂，具有杀菌活性，可将 MsbA 捕获在朝内的脂多糖中。 G907 对大肠杆菌 MsbA 有抑制作用， IC50 值为 18 nM。
T4487	TNP IP3K Inhibitor	Others	Others
	TNP (IP3K Inhibitor) 是细胞渗透性的IP6K1和IP3K 的抑制剂，其对IP6K1 和IP3K 的IC50值分别为 0.55 μM 和 10.2 μM。TNP 与两种酶的ATP 结合位点结合。
T7424	NDI-091143	ATP Citrate Lyase	Metabolism
	NDI-091143 是高亲和力人 ATP 柠檬酸裂解酶抑制剂，其IC50为 2.1 nM (ADP-Glo 分析)，Ki 为 7.0 nM，Kd 为 2.2 nM。它能够稳定柠檬酸盐域中的大构象变化，间接抑制柠檬酸的结合和识别，进而抑制ACLY 催化变构反应。
T1849	Momelotinib CYT11387,CYT387,LM-1149	Apoptosis; JAK; Autophagy	Angiogenesis; Apoptosis; Autophagy; Chromatin/Epigenetic; JAK/STAT signaling; Stem Cells
	Momelotinib (LM-1149) 是一种 ATP 竞争性的 JAK1/JAK2抑制剂，IC50值分别为 11 nM/18 nM。
T14366	AZ10606120 dihydrochloride	P2X Receptor	Membrane transporter/Ion channel; Neuroscience
	AZ10606120 dihydrochloride 是一种可选择的、有效的、高亲和力的受体拮抗剂，在人和大鼠 P2X 7 受体上的 K D 值分别为 1.4 和 19 nM。AZ10606120 dihydrochloride 抑制肿瘤生长，具有抗血管生成活性。AZ 10606120在与 ATP 结合位点偶联的位点结合时充当负变构调节剂。
T16125	MMV390048	Parasite; PI4K	Microbiology/Virology; PI3K/Akt/mTOR signaling
	MMV390048 是一种抗疟药，是一种新型化学疟原虫 PI4K 抑制剂。它与疟原虫 PI4K 的 ATP 结合位点结合，不与除人类 PIP4K2C 外的其他恶性疟原虫和人类激酶结合。
T35343	MTI-31 MTI-31,LXI-15029	mTOR	PI3K/Akt/mTOR signaling
	MTI-31 (LXI-15029) 是口服有效的，高度选择性的mTORC1和mTORC2抑制剂，对 mTOR 的Kd 为 0.20 nM，IC50为 39 nM。MTI-31可用于乳腺癌的研究。
T2064	Semaxinib 司马沙尼,SU5416	VEGFR	Angiogenesis; Tyrosine Kinase/Adaptors
	Semaxinib (SU5416) 是一种选择性的 VEGFR(Flk-1/KDR) 抑制剂，其 IC50=1.23 μM。
T17182	TX1-85-1	EGFR	Angiogenesis; JAK/STAT signaling; Tyrosine Kinase/Adaptors
	TX1-85-1 是不可逆 Her3 抑制剂，IC50值为 23 nM。它诱导 Her3 蛋白部分降解，并减弱 Her3 依赖性信号传导。它是选择性 Her3 配体，与位于 Her3 的 ATP 结合位点的 Cys721 形成共价键。
T16550	PKR-IN-C16	Others	Others
	PKR-IN-C16 是一种特异性蛋白激酶抑制剂。它能够抑制 PKR 的自磷酸化，解除 PKR 在原代神经元细胞培养中诱导的翻译阻断。
T8333	Aurintricarboxylic acid ATA,NSC-4056,NSC4056,金精三羧酸,NSC 4056	Apoptosis; P2X Receptor; Influenza Virus; Topoisomerase	Apoptosis; DNA Damage/DNA Repair; Membrane transporter/Ion channel; Microbiology/Virology; Neuroscience
	Aurintricarboxylic acid (NSC-4056) 是高效的αβ-亚甲基-ATP 敏感选择性P2X1Rs 和P2X3Rs 变构拮抗剂。它是核糖核酸酶和拓扑异构酶 II 的有效抑制剂，可阻止核酸与酶结合。
T2024	A-803467 A 803467,A803467	Sodium Channel	Membrane transporter/Ion channel
	A-803467 是有效的、选择性的河豚毒素不敏感型Nav1.8 钠通道阻断剂。它在炎症性疼痛和神经性疼痛模型中有缓解疼痛作用。它通过与 ATP-binding cassette subfamily G member 2 (ABCG2) 转运蛋白的相互作用，增强了传统抗癌物的化疗敏感性。
T1448L	Dasatinib monohydrate 达沙替尼,BMS-354825 Monohydrate	Apoptosis; Bcr-Abl; Src; c-Kit; Ephrin Receptor; Autophagy	Angiogenesis; Apoptosis; Autophagy; Cytoskeletal Signaling; Tyrosine Kinase/Adaptors
	Dasatinib monohydrate (BMS-354825 Monohydrate) 是一种具有口服活性的，ATP 竞争性的双重Src/Bcr-Abl 抑制剂，有抗肿瘤活性，还诱导凋亡和自噬。它抑制Src 和Bcr-Abl 的IC50分别为 0.5 nM 和 <1.0 nM，Ki 值分别为 16 pM 和 30 pM。
T23881	Wee1 Inhibitor II Wee1-Inhibitor II,Wee1-Inhibitor-II,Wee1 Inhibitor-II
	Wee1 Inhibitor II is an ATP-binding site-targeting Wee1 inhibitor.
T41113	3BrB-PP1 3BrB-PP1
	3BrB-PP1 is an ATP-competitive analog that exhibits specific inhibitory activity towards protein kinase. It is effective in inhibiting protein kinase with mutations in the ATP-binding pocket, specifically the mutation of Thr97 within Sty1's ATP-binding pocket.
T23869	WEE1-IN-4 Wee1-Inhibitor-I,Wee1 Inhibitor-I,Wee1 Inhibitor I,Wee1-Inhibitor I
	Wee1 Inhibitor I is an ATP-binding site-targeting Wee1 inhibitor.
T24099	GP29 GP-29,GP 29
	GP29 is a Type II kinase inhibitor of the IRE1α endoribonuclease that acts by targeting the ATP-binding pocket of IRE1α.
T18917	ATP-Red 1	Others	Others
	ATP-Red 1 is a multisite-binding switchable fluorescent probe. It can rapidly and selectively respond to intracellular concentrations of ATP in living cells.
T28389	PF-6422899 PF6422899,PF 6422899
	PF-6422899 irreversibly inhibits EGFR kinase activity by binding covalently to active-site cysteine residues in the ATP binding pocket of EGFR.
T0373L1	Erlotinib mesylate CP-358774,CP-358,774,埃罗替尼甲磺酸盐,OSI-774,CP358774,OSI 774
	Erlotinib is an epidermal growth factor receptor inhibitor. Erlotinib binds in a reversible fashion to the adenosine triphosphate (ATP) binding site of the receptor.
T74034	6-Me-ATP trisodium
	6-Me-ATP trisodium (N6-Methyl-ATP) 是N6-修饰的ATP衍生物，展现对GSK3良好的结合亲和力，可作为GSK3β磷酸化底物肽的磷酸基团供体。
T24098	GP17 GP-17,GP 17
	GP17 is a type II kinase inhibitor of the IRE1α endoribonuclease that acts by targeting the ATP-binding pocket of IRE1α.
T32085	HM30181AK HM-30181AK,HM 30181AK
	HM30181AK is an inhibitor of the adenosine triphosphate (ATP) binding cassette (ABC) transporter P-glycoprotein (P-gp) with adjuvant activity.
T36778	MK2-IN-1 MK2-IN-1 (MK2 Inhibitor)
	MK2-IN-1 is a potent and selecitve MAPKAPK2(MK2) inhibitor(IC50=0.11 uM) with a non-ATP competitive binding mode.
T16107	ML230 CID44640177,SID 88095709	CGRP Receptor	GPCR/G Protein; Neuroscience
	ML230 is a selective ATP-binding cassette (ABC) transporter ABCG2 inhibitor. It 36-fold selective for ABCG2 over ABCB1 (EC50s: 0.13 μM and 4.65 μM, respectively).
T78832	FGFR1 inhibitor-9	FGFR	Angiogenesis; Tyrosine Kinase/Adaptors
	FGFR1inhibitor-9（Compound 9），一种FGFR1抑制剂（IC50为0.85 nM），可与FGFR1的ATP结合袋发生结合，并展现出抗癌活性。
T15659	KHK-IN-1 hydrochloride	Others	Others
	KHK-IN-1 hydrochloride is a potent inhibitor of ketohexokinase (KHK) (IC50: 12 nM). In the ATP-binding region of KHK, KHK-IN-1 hydrochloride interacts with Asp-27B.
T68349	Lck inhibitor II
	Lck inhibitor II is a cell-permeable, ATP binding site-targeting, tri-substituted pyrimidine that acts as a highly potent Lck (lymphocyte specific kinase) inhibitor
T13547	AMP-PCP	HSP	Cytoskeletal Signaling; Metabolism
	AMP-PCP is an ATP analog and can bind to the Hsp90 N-terminal domain (Kd: 3.8 μM). AMP-PCP binding favors the formation of the active homodimer of Hsp90.
T74033	6-Me-ATP
	6-Me-ATP（N6-Methyl-ATP）为ATP的N6修饰衍生物。该化合物与GSK3β结合亲和力显著，能有效作为GSK3β催化底物肽磷酸化的磷酸基团供体。
T62089	FWM-1
	FWM-1是一种 SARS-COV-2 NSP13 解旋酶的有效抑制剂 (结合自由能:-328.6 kcal/mol)。FWM-1 对 ATP 与 SARS-COV2 解旋酶的结合显示出有效的破坏作用。
T33955	PF-6808472 OX-44,OX44,PF 6808472,OX 44,PF6808472
	PF-6808472 is a cell permeable covalent probe suitable for click chemistry designated to measure kinase selectivity in intact cells. PF-6808472 contains sulfonyl fluoride group, which react with conserved lysine residue within kinase ATP binding site.
T10172	5-Iodo-indirubin-3'-monoxime	GSK-3; CDK	Cell Cycle/Checkpoint; PI3K/Akt/mTOR signaling; Stem Cells
	5-Iodo-indirubin-3'-monoxime 是一种 GSK-3β、CDK5/P25和CDK1/cyclin B 抑制剂，IC50值分别为 9、20 和 25 nM，与 ATP 竞争性地结合酶的催化位点。
T69727	ADA-07
	ADA-07 is a TOPK inhibitor which interacts with TOPK at the ATP-binding pocket and inhibits its kinase activity, thereby suppressing SUV-induced phosphorylation of ERK1/2, p38, and JNKs, and subsequently inhibiting AP-1 activity.
T13222	TTT-28	Others	Others
	TTT-28 is a thiazole-valine peptidomimetic, and is a selective ABCB1 (P-gp/MDR1) inhibitor with high efficacy and low toxicity, which reverses the ATP-binding cassette sub-family B member 1 (ABCB1)-mediated Multidrug resistance (MDR) by selectively blocki

化合物

Cat.No: T8719

Target: Apoptosis, JAK, STAT

Ibutilide Fumarate

Cat.No: T6541

Synonym: Corvert Fumarate,U70226E,富马酸伊布利特

Target: Calcium Channel, Sodium Channel

Cat.No: T8491

Synonym: CM082,X-82

Target: VEGFR, PDGFR

Cat.No: T3148

Synonym: L-660711 (sodium salt),L-660711 sodium salt,Verlukast sodium,L-660711,MK571,MK-571 sodium salt,Propanoic acid

Target: Leukotriene Receptor, LTR

Cat.No: T6152

Target: MEK

Cat.No: T24111

Synonym: GSK3 inhibitor XIII,GSK3iXIII,GSK3i-XIII

Target: GSK-3

Cat.No: TQ0186

Target: BCRP, ABC

Cat.No: T15385

Target: Potassium Channel

AMP-PCP disodium

Cat.No: T13547L

Target: HSP

Cat.No: T15375

Synonym: GDC-0077,RG6114

Target: Apoptosis, PI3K

Thymidylate Kinase Inhibitor, YMU1

Cat.No: T8864

Target: Others

Cat.No: T10585

Synonym: CBT-101,PLB-1001

Target: c-Met/HGFR

Cat.No: T12609

Target: LIM Kinase, Reverse Transcriptase

Cat.No: T10965

Target: EGFR

Cat.No: T6337

Synonym: ALK5 Inhibitor II,SJN 2511,E-616452

Target: ALK, TGF-beta/Smad

Cat.No: T11348

Target: Antibiotic

Cat.No: T4487

Synonym: IP3K Inhibitor

Target: Others

Cat.No: T7424

Target: ATP Citrate Lyase

Cat.No: T1849

Synonym: CYT11387,CYT387,LM-1149

Target: Apoptosis, JAK, Autophagy

AZ10606120 dihydrochloride

Cat.No: T14366

Target: P2X Receptor

Cat.No: T16125

Target: Parasite, PI4K

Cat.No: T35343

Synonym: MTI-31,LXI-15029

Target: mTOR

Cat.No: T2064

Synonym: 司马沙尼,SU5416

Target: VEGFR

Cat.No: T17182

Target: EGFR

Cat.No: T16550

Target: Others

Aurintricarboxylic acid

Cat.No: T8333

Synonym: ATA,NSC-4056,NSC4056,金精三羧酸,NSC 4056

Target: Apoptosis, P2X Receptor, Influenza Virus, Topoisomerase

Cat.No: T2024

Synonym: A 803467,A803467

Target: Sodium Channel

Dasatinib monohydrate

Cat.No: T1448L

Synonym: 达沙替尼,BMS-354825 Monohydrate

Target: Apoptosis, Bcr-Abl, Src, c-Kit, Ephrin Receptor, Autophagy

Wee1 Inhibitor II

Cat.No: T23881

Synonym: Wee1-Inhibitor II,Wee1-Inhibitor-II,Wee1 Inhibitor-II

Cat.No: T41113

Synonym: 3BrB-PP1

Cat.No: T23869

Synonym: Wee1-Inhibitor-I,Wee1 Inhibitor-I,Wee1 Inhibitor I,Wee1-Inhibitor I

Cat.No: T24099

Synonym: GP-29,GP 29

Cat.No: T18917

Target: Others

Cat.No: T28389

Synonym: PF6422899,PF 6422899

Erlotinib mesylate

Cat.No: T0373L1

Synonym: CP-358774,CP-358,774,埃罗替尼甲磺酸盐,OSI-774,CP358774,OSI 774

6-Me-ATP trisodium

Cat.No: T74034

Cat.No: T24098

Synonym: GP-17,GP 17

Cat.No: T32085

Synonym: HM-30181AK,HM 30181AK

Cat.No: T36778

Synonym: MK2-IN-1 (MK2 Inhibitor)

Cat.No: T16107

Synonym: CID44640177,SID 88095709

Target: CGRP Receptor

FGFR1 inhibitor-9

Cat.No: T78832

Target: FGFR

KHK-IN-1 hydrochloride

Cat.No: T15659

Target: Others

Lck inhibitor II

Cat.No: T68349

Cat.No: T13547

Target: HSP

Cat.No: T74033

Cat.No: T62089

Cat.No: T33955

Synonym: OX-44,OX44,PF 6808472,OX 44,PF6808472

5-Iodo-indirubin-3'-monoxime

Cat.No: T10172

Target: GSK-3, CDK

Cat.No: T69727

Cat.No: T13222

Target: Others

Cat. No.	Product Name	Target	Signaling Pathways
T20003	Acridone	Antibacterial; ABC	Membrane transporter/Ion channel; Microbiology/Virology
	Acridone 具有抗菌、抗疟、抗病毒和抗肿瘤活性。它可诱导细胞凋亡，抑制 ABCG2 蛋白，并调节激素水平。
T37714	Fuscin
	Fuscin is a quinonoid fungal metabolite originally isolated from O. fuscum that has diverse biological activities. It inhibits binding of the ADP/ATP translocase inhibitor atractyloside to rat liver mitochondria in an ADP-dependent manner when used at a concentration of 50 μM in a radioligand binding assay. Fuscin (20 μM) reduces the glutathione content of rat liver mitochondria to 28% of controls and inhibits NADH oxidation in sonicated pigeon heart mitochondria preparations in a concentration-...

天然产物

Cat.No: T20003

Target: Antibacterial, ABC

Cat.No: T37714

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