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13

抑制剂 & 化合物

3

天然产物

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Cat. No.	Product Name	Target	Signaling Pathways
T9704	1-Ethynylpyrene	P450	Metabolism
	1-Ethynylpyrene 是有效的细胞色素P450 1A1, 1A2和2B1抑制剂，抑制的IC50分别为 0.18，0.32 和 0.04 μM。
T39675	ALDH1A2-IN-1 ALDH1A2-IN-1
	ALDH1A2-IN-1 is a reversible inhibitor of the active site of ALDH1A2, showing a significant affinity for the enzyme with an IC50 value of 0.91 μM and a Kd value of 0.26 μM. This compound interacts hydrophobically with the enzyme, contributing to its inhibitory properties.
T29468	61A2 61-A-2,61 A 2
	61A2, known as a stabilizer of the active LPL dimer can prevents LPL inactivation.
T7410	Furafylline 呋拉茶碱,呋喃茶碱	P450	Metabolism
	Furafylline 是有选择性的人细胞色素P450IA2抑制剂(IC50:0.07 μM)。
T23533	WIN 18446	Dehydrogenase	Metabolism
	Win 18446 是口服有效的睾丸特异性的ALDH1a2的抑制剂，IC50为 0.3 μM。Win 18446 抑制睾丸内视黄醇合成视黄酸，可逆的抑制多个物种的精子形成，。
T2753	Avasimibe PD-148515,阿伐麦布,CI-1011	P450; Acyltransferase	Metabolism
	Avasimibe (PD-148515) 是一种口服有效的酰基辅酶 A: 胆固醇酰基转移酶 (ACAT) 抑制剂，对 ACAT1和 ACAT2的 IC50分别为 24 和 9.2 µM。Avasimibe 在前列腺癌中有研究的价值。
T3215	JNJ-42165279 JNJ42165279	FAAH; Autophagy	Autophagy; Metabolism; Neuroscience
	JNJ-42165279 是一种 FAAH 抑制剂，抑制 hFAAH 和 rFAAH，IC50分别为70 ± 8 nM 和 313 ± 28 nM。它对其他酶、离子通道、转运蛋白和受体具有高度选择性。
T1540	Doxepin hydrochloride Toruan,Doxepin HCl,Aponal,Novoxapin,盐酸多塞平	P450; Dopamine Receptor; 5-HT Receptor; Adrenergic Receptor; AChR; Norepinephrine; Histamine Receptor	GPCR/G Protein; Immunology/Inflammation; Metabolism; Neuroscience
	Doxepin hydrochloride (Aponal) 是一种可口服的三环抗抑郁剂，是选择性组胺受体 H1拮抗剂。它也是 CYP450抑制剂，抑制 CYP450 2C19和 CYP450 1A2。
T1415	Gemfibrozil 吉非罗齐,CI-719,Jezil,Decrelip,Lopid	P450; Adrenergic Receptor; PPAR	DNA Damage/DNA Repair; GPCR/G Protein; Metabolism; Neuroscience
	Gemfibrozil (CI-719) 是一种PPAR-α激活剂，可作为降脂药。它也是P450非选择性抑制剂，对 CYP2C9、2C19、2C8 和 1A2 的Ki 值分别为 5.8、24、69 和 82 μM。
T24988	7ETMC 7 ETMC,7-ETMC
	7ETMC is a selective Human Cytochrome P450s 1A1 and 1A2 inhibitor. 7ETMC showed IC50s of 0.46 μM and 0.50 μM for P450s 1A1 and 1A2 in the first six minutes, respectively, and did not show any inhibition activity for P450s 2A6 and 2B1 even at the dose of 5
T39371	LKY-047
	LKY-047, a derivative of Decursin, is a highly effective and specific reversible competitive inhibitor of cytochrome P45022J2 (CYP2J2), with an IC 50 value of 1.7 μM. LKY-047 does not display inhibitory activity against other human P450 enzymes including CYPs 1A2, 2A6, 2B6, 2C8, 2C9, 2C19, 2D6, 2E1, and 3A.
T11088	Doxepin D3 Hydrochloride	Histamine Receptor	GPCR/G Protein; Immunology/Inflammation; Neuroscience
	Doxepin D3 Hydrochloride is a deuterium-labeled doxepin hydrochloride.Doxepin hydrochloride is an oral active tricyclic antidepressant used as a sedative.Doxepin hydrochloride is also an effective CYP450 inhibitor, significantly inhibiting CYP450 2C19 and
T70782	PF-05139962
	PF-05139962 is a novel potent mTOR inhibitor with excellent mTOR biochemical inhibition, cellular potency, kinase selectivity and in vitro ADME properties. PF-05139962 has pS473 and pS6 cellular IC50 = 48 and 6 nM respectively. PF-05139962 has great selectivity against other receptors and kinases. No genotoxicity was observed on this compound and no more than 25% inhibiton was observed for major CYP enzymes (3A4, 1A2, 2C9, 2D6) at 3 uM. This compound has LE = 0.35 and LipE up to 6.8 which is in ...

化合物

1-Ethynylpyrene

Cat.No: T9704

Target: P450

Cat.No: T39675

Synonym: ALDH1A2-IN-1

Cat.No: T29468

Synonym: 61-A-2,61 A 2

Cat.No: T7410

Synonym: 呋拉茶碱,呋喃茶碱

Target: P450

Cat.No: T23533

Target: Dehydrogenase

Cat.No: T2753

Synonym: PD-148515,阿伐麦布,CI-1011

Target: P450, Acyltransferase

Cat.No: T3215

Synonym: JNJ42165279

Target: FAAH, Autophagy

Doxepin hydrochloride

Cat.No: T1540

Synonym: Toruan,Doxepin HCl,Aponal,Novoxapin,盐酸多塞平

Target: P450, Dopamine Receptor, 5-HT Receptor, Adrenergic Receptor, AChR, Norepinephrine, Histamine Receptor

Cat.No: T1415

Synonym: 吉非罗齐,CI-719,Jezil,Decrelip,Lopid

Target: P450, Adrenergic Receptor, PPAR

Cat.No: T24988

Synonym: 7 ETMC,7-ETMC

Cat.No: T39371

Doxepin D3 Hydrochloride

Cat.No: T11088

Target: Histamine Receptor

Cat.No: T70782

Cat. No.	Product Name	Target	Signaling Pathways
T0671	2-Naphthol Betanaphthol,β-萘酚,乙萘酚	Others; Endogenous Metabolite	Metabolism; Others
	2-Naphthol (Betanaphthol) 是一种 naphthalene 的代谢物，由细胞色素 P450 亚型 (CYP 1A1，CYP 1A2，CYP 2A1，CYP 2E1 和 CYP 2F2) 催化而成。
T13520	6-Hydroxymelatonin	Others	Others
	6-Hydroxymelatonin is a primary metabolic of Melatonin, which is metabolized by CYP 1A2.
TN5133	3',5,5',7-Tetrahydroxy-4',6-dimethoxyflavone	HIV Protease; Topoisomerase	DNA Damage/DNA Repair; Microbiology/Virology; Proteases/Proteasome
	5,7,3',5'-tetrahydroxy-6,4'-dimethoxyflavone exhibits anti-HIV-1 activity in the anti-syncytium assay using (∆Tat/rev)MC99 virus and 1A2 cell line system, it shows considerably activity against HIV-1 reverse transcriptase. It exhibits cytotoxic activity against P-388 cell lines, it can inhibit DNA topoisomerase IIα activity, which may be responsible for the observed cytotoxicity.

天然产物

Cat.No: T0671

Synonym: Betanaphthol,β-萘酚,乙萘酚

Target: Others, Endogenous Metabolite

6-Hydroxymelatonin

Cat.No: T13520

Target: Others

3',5,5',7-Tetrahydroxy-4',6-dimethoxyflavone

Cat.No: TN5133

Target: HIV Protease, Topoisomerase

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