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10

抑制剂 & 化合物

11

天然产物

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Cat. No.	Product Name	Target	Signaling Pathways
T2670	ML167 NCGC00188654,CID44968231	DYRK; CDK	Cell Cycle/Checkpoint; Tyrosine Kinase/Adaptors
	ML167 (CID44968231) 是一种高选择性的 Cdc2 样激酶 4 抑制剂，IC50为 136 nM。
T0242L	Sitagliptin phosphate monohydrate MK-0431,MK-0431 phosphate monohydrate,西他列汀磷酸盐一水合物	Proteasome; DPP-4; Autophagy	Autophagy; Proteases/Proteasome; Ubiquitination
	Sitagliptin phosphate monohydrate (MK-0431 phosphate monohydrate) 是一种有效的 DPP-IV 抑制剂，在 Caco-2 细胞提取物中的 IC50 为 19 nM。
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。
T40930	(S)-Sitagliptin phosphate (S)-Sitagliptin phosphate,(S)-MK-0431 phosphate
	(S)-Sitagliptin phosphate, the less active S-enantiomer of Sitagliptin phosphate, is a high-potency inhibitor of DPP4. It exhibits an IC50 of 19 nM in Caco-2 cell extracts.
T61783	Antimicrobial agent-1
	Antimicrobial Agent-1 (compound 6C) shows strong activity (MIC = 2 μg/mL) against TolC mutant E. coli. Additionally, it synergistically interacts with Colistin to exhibit enhanced activity against Gram-negative bacteria. Importantly, Antimicrobial Agent-1 exhibits no cytotoxic effects on mammalian cell lines. Its MIC values on Caco-2 and Vero cell lines are greater than 128 μg/mL [1].
T30491	BMS 183920 BMS-183920,BMS183920
	BMS-183920 is a diacid, potent angiotensin II receptor antagonist that improves Caco-2 cell permeability and in vivo oral absorption. The relative degree of hydrolysis (biological activation) and prodrug metabolism determines whether substantial improveme
T82489	eIF4E-IN-6
	eIF4E-IN-6（化合物4b）是一种针对eIF4E设计的抑制剂，可阻止其与cap mRNA的结合，其化学结构为GMP类似物。该化合物在Caco-2、HepG-2和MCF-7细胞系中显示出细胞毒性效果，其IC50值分别约为31、27和21 μM。
T82314	GK444	HDAC	Chromatin/Epigenetic; DNA Damage/DNA Repair
	GK444（Compound 15a），一种针对HDAC1/2的抑制剂，IC50分别为HDAC1和HDAC2的100 nM与92 nM。其对Caco-2细胞的IC50为4.1μM，并能下调原代正常人肺成纤维细胞中TGF-β1刺激的COL1A1 mRNA水平。此外，GK444还能抑制博来霉素诱发的小鼠肺纤维化。
T79915	Antioxidant agent-15	COX	Immunology/Inflammation; Neuroscience
	Antioxidant agent-15 (Compound 4) 显示出显著的抗氧化抑制活性，其 IC50 为 15.44 nM。在细胞水平上，Antioxidant agent-15 对Hela、Hep G2 和 Caco-2肿瘤细胞生长的抑制作用各自具有不同的 IC50 值，分别为 395.26 nM、4000.4 nM 和 24.6 nM。
T35775	HT-2 Toxin-13C22 HT-2 Toxin-13C22
	HT-2 toxin-13C22is intended for use as an internal standard for the quantification of HT-2 toxin by GC- or LC-MS. HT-2 toxin is a type A trichothecene mycotoxin and an active, deacetylated metabolite of the trichothecene mycotoxin T-2 toxin .1,2Like T-2 toxin, HT-2 toxin inhibits protein synthesis and cell proliferation in plants.2HT-2 toxin also reduces viability of HepG2, A549, HEp-2, Caco-2, A-204, U937, Jurkat, and RPMI-8226 cancer cells with IC50values ranging from 3.1 to 23 ng/ml and human...

化合物

Cat.No: T2670

Synonym: NCGC00188654,CID44968231

Target: DYRK, CDK

Sitagliptin phosphate monohydrate

Cat.No: T0242L

Synonym: MK-0431,MK-0431 phosphate monohydrate,西他列汀磷酸盐一水合物

Target: Proteasome, DPP-4, Autophagy

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

(S)-Sitagliptin phosphate

Cat.No: T40930

Synonym: (S)-Sitagliptin phosphate,(S)-MK-0431 phosphate

Antimicrobial agent-1

Cat.No: T61783

Cat.No: T30491

Synonym: BMS-183920,BMS183920

Cat.No: T82489

Cat.No: T82314

Target: HDAC

Antioxidant agent-15

Cat.No: T79915

Target: COX

HT-2 Toxin-13C22

Cat.No: T35775

Synonym: HT-2 Toxin-13C22

Cat. No.	Product Name	Target	Signaling Pathways
TQ0265	Indolelactic acid	Endogenous Metabolite	Metabolism
	Indolelactic acid 是 Azotobacter vinelandii 培养中的色氨酸分解代谢物。
T19676	Tributyrin NSC661583,NSC 661583,NSC-661583,甘油三丁酸酯	Apoptosis	Apoptosis
	Tributyrin (Glyceryl tributyrate) 是一种中性短链脂肪酸甘油三酯，是一种稳定且吸收迅速的丁酸前药。它通过生物膜扩散并被细胞内脂肪酶代谢，在体内将有效的丁酸直接释放到细胞中，有抗增殖、促凋亡和诱导分化作用。
TN1237	3-O-Methylgallic acid 3,4-Dihydroxy-5-methoxybenzoic acid,3-O-甲基没食子酸	Apoptosis; NF-κB; OCT; DNA/RNA Synthesis; STAT	Apoptosis; Cell Cycle/Checkpoint; DNA Damage/DNA Repair; JAK/STAT signaling; Membrane transporter/Ion channel; NF-κB; Stem Cells
	3-O-Methylgallic acid (3,4-Dihydroxy-5-methoxybenzoic acid) 是一种花青素代谢产物，具有强大的抗氧化能力。它还诱导细胞凋亡并具有抗癌作用，可抑制 Caco-2 细胞增殖，IC50值为 24.1 μM。
TN3967	Epieriocalyxin A	ERK; BCL; ROS; Caspase; DNA/RNA Synthesis; JNK	Apoptosis; Cell Cycle/Checkpoint; DNA Damage/DNA Repair; Immunology/Inflammation; MAPK; Proteases/Proteasome
	Epieriocalyxin A 可以抑制 Caco-2 结肠癌细胞的生长。它可能是未来结肠癌治疗的潜在药物。
T5S0890	Oleandrin Neriostene,Folinerin,Foliandrin,欧夹竹桃苷	Apoptosis; ATPase; Potassium Channel; Sodium Channel	Apoptosis; Membrane transporter/Ion channel
	Oleandrin (Folinerin) 是夹竹桃属中的一种类固醇，可抑制Na+/K+-ATPase 活性，IC50为 620 nM。
T6S1315	Oroxylin A 千层纸素A,6-Methoxybaicalein,Baicalein 6-methyl ether	Virus Protease; HIF/HIF Prolyl-Hydroxylase; Autophagy	Autophagy; Chromatin/Epigenetic; Metabolism; Microbiology/Virology
	Oroxylin A (Baicalein 6-methyl ether) 是一种有活性的黄酮，具有较强的抗癌作用。
TN1387	Angelol B	Others	Others
	The absorption and transport of angelol A and Angelol B are passive diffusion as the dominating process in Caco-2 cell monolayer model.
TN1386	Angelol A 当归酚A,当归醇A	Others	Others
	Angelol A and angelol B are passive diffusion as the dominating process in Caco-2 cell monolayer model.
TN6645	Lucidumol A
	Lucidumol A has relatively good effect against aldose reductase with IC50 of 19.1uM. Lucidumol A has cytotoxic activity, it reduced cell growth in three human carcinoma cells (Caco-2, HepG2, and HeLa cells) dose dependently with LC50s from 20.87 to 84.36
T37810	6',7'-Epoxybergamottin
	6'7'-Epoxybergamottin is a furanocoumarin found in grapefruit. It is a potent inhibitor of the cytochrome P450 (CYP) isoform CYP3A4 with an IC50 value of 0.30 ppm in a cell-free assay, 0.33 μM in HL7 human liver cells, and 0.22 μM in S9 human intestine cells. It has been studied in the context of drug interactions with grapefruit constituents. It is found in grapefruit juice at concentrations of 0.1-7.4 μM and inhibits the transport of talinolol , a permeability glycoprotein (P-gp/ABCB1) transpo...
TN2190	Scoulerine	Apoptosis; Beta-Secretase; BACE; Parasite	Apoptosis; Microbiology/Virology; Neuroscience
	Scoulerine 是抗有丝分裂化合物。它抑制细胞增殖，阻止细胞周期，并诱导癌细胞凋亡。它也是BACE1(淀粉样前体蛋白裂解酶 1) 的抑制剂。

天然产物

Indolelactic acid

Cat.No: TQ0265

Target: Endogenous Metabolite

Cat.No: T19676

Synonym: NSC661583,NSC 661583,NSC-661583,甘油三丁酸酯

Target: Apoptosis

3-O-Methylgallic acid

Cat.No: TN1237

Synonym: 3,4-Dihydroxy-5-methoxybenzoic acid,3-O-甲基没食子酸

Target: Apoptosis, NF-κB, OCT, DNA/RNA Synthesis, STAT

Epieriocalyxin A

Cat.No: TN3967

Target: ERK, BCL, ROS, Caspase, DNA/RNA Synthesis, JNK

Cat.No: T5S0890

Synonym: Neriostene,Folinerin,Foliandrin,欧夹竹桃苷

Target: Apoptosis, ATPase, Potassium Channel, Sodium Channel

Cat.No: T6S1315

Synonym: 千层纸素A,6-Methoxybaicalein,Baicalein 6-methyl ether

Target: Virus Protease, HIF/HIF Prolyl-Hydroxylase, Autophagy

Cat.No: TN1387

Target: Others

Cat.No: TN1386

Synonym: 当归酚A,当归醇A

Target: Others

Cat.No: TN6645

6',7'-Epoxybergamottin

Cat.No: T37810

Cat.No: TN2190

Target: Apoptosis, Beta-Secretase, BACE, Parasite

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