S1185 |
Ritonavir
|
Ritonavir是Cytochrome P450 3A和HIV蛋白酶抑制剂,用于治疗HIV感染和AIDS。抑制Cytochrome P450 2D6, P-Glycoprotein,诱导Cytochrome P450 2C19, Cytochrome P450 1A2, Cytochrome P450 2C9, Cytochrome P450 2B6和UDP Glucuronosyltransferases。Ritonavir 可诱导凋亡。 |
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Cell Chem Biol, 2024, S2451-9456(24)00396-9
-
Antiviral Res, 2024, 225:105840
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Cancer Drug Resist, 2024, 7:3
|
|
S2476 |
Itraconazole
|
Itraconazole是一种三唑类抗真菌药物,是CYP3A4的有效抑制剂,IC50为6.1 nM。Itraconazole 是一个有效的Hedgehog (Hh)信号通路的拮抗剂。Itraconazole 可通过诱导自噬来抑制恶性胶质瘤的生长。 |
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Front Cell Infect Microbiol, 2023, 13:1128000
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Front Cell Infect Microbiol, 2023, 13:1131641
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Front Cell Infect Microbiol, 2022, 12:864912
|
|
S1123 |
Abiraterone
|
Abiraterone是一种有效CYP17抑制剂,无细胞试验中IC50为2 nM。Abiraterone (CB-7598) 是一种雄性激素 androgen 生物合成抑制剂。 |
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Cancer Res, 2023, 83(8):1361-1380
-
Cancer Cell, 2021, S1535-6108(21)00659-0
-
Cancers (Basel), 2021, 13(16)3959
|
|
S2246 |
Abiraterone Acetate
|
Abiraterone Acetate是Abiraterone的醋酸盐形式,是一种甾体类细胞色素CYP17抑制剂,无细胞试验中IC50为72 nM。Abiraterone acetateis 是一种口服的雄性激素 androgen 生物合成抑制剂。 |
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Cells, 2024, 13(19)1622
-
Cancer Res, 2023, 83(2):219-238
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J Immunother Cancer, 2023, 11(5)e006581
|
|
S2262 |
Apigenin
|
Apigenin是一种有效的CYP2C9抑制剂,Ki为2 μM.。 |
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Antioxidants (Basel), 2024, 13(5)611
-
bioRxiv, 2024, 2024.04.04.588167
-
bioRxiv, 2024, 2024.04.04.588167
|
|
S2268 |
Baicalein
|
Baicalein是CYP2C9和脯氨酰肽链内切酶抑制剂。 |
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SLAS Discov, 2024, S2472-5552(24)00007-8
-
Redox Rep, 2023, 28(1):2152607
-
Microbiol Spectr, 2023, 11(3):e0470222
|
|
S1257 |
Posaconazole
|
Posaconazole是CYP3A4的抑制剂,但不抑制其他CYP酶的活性;同时是sterol C14ɑ demethylase的抑制剂,IC50为0.25 μM。其平均的消除半衰期为15-35小时。 |
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Front Cell Infect Microbiol, 2023, 13:1131641
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Front Cell Infect Microbiol, 2022, 12:1074903
-
Front Cell Infect Microbiol, 2022, 12:864912
|
|
S1442 |
Voriconazole
|
Voriconazole是类似于氟康唑和伊曲康唑的新型三唑衍生物,其作用是通过抑制真菌 cytochrome P-450 依赖性的,14-alpha-sterol demethylase 介导的 麦角固醇的合成。 |
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Pharmaceutics, 2024, 16(7)897
-
Front Cell Infect Microbiol, 2023, 13:1131641
-
Front Cell Infect Microbiol, 2022, 12:864912
|
|
S1331 |
Fluconazole
|
Fluconazole是一种羊毛甾醇14 alpha去甲基化酶 抑制剂,抑制了麦角固醇的形成,用于治疗和预防浅表性和全身性真菌感染。 |
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Front Cell Infect Microbiol, 2024, 14:1296151
-
Front Cell Infect Microbiol, 2023, 13:1131641
-
Nat Commun, 2022, 13(1):1658
|
|
S1353 |
Ketoconazole
|
Ketoconazole能抑制cyclosporine oxidase(环孢素氧化酶)和testosterone 6 beta-hydroxylase(睾丸素6β-羟化酶),IC50分别为0.19 mM和0.22 mM。Ketoconazole 是一种雄性激素 androgen 生物合成抑制剂。 |
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J Med Virol, 2023, 95(6):e28856
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J Med Virol, 2023, 95(6):e28856
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Cell Death Dis, 2023, 14(1):64
|
|
S4202 |
Verapamil HCl
|
Verapamil HCl是L-型钙通道抑制剂,是第四类抗心律失常的药剂。Verapamil 可抑制 permeability-glycoprotein (P-gp) 和 CYP3A4。 |
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NPJ Precis Oncol, 2024, 8(1):94
-
Int J Mol Sci, 2024, 25(18)10162
-
Biomedicines, 2024, 12(4)904
|
|
S2187 |
Avasimibe
|
Avasimibe 抑制ACAT,IC50为3.3 μM,也抑制人P450同工酶CYP2C9, CYP1A2和CYP2C19,IC50分别为2.9 μM, 13.9 μM和26.5 μM, |
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Nat Commun, 2024, 15(1):8301
-
PLoS Pathog, 2023, 19(5):e1011323
-
Hepatol Int, 2023, 10.1007/s12072-023-10490-4
|
|
S1712 |
Deferasirox
|
Deferasirox是一种铁螯合剂,是cytochrome P450 3A4诱导剂,Cytochrome P450 2C8的抑制剂,Cytochrome P450 1A2抑制剂。Deferasirox 引起的铁损耗可促进BclxL下调和细胞死亡。 |
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Elife, 2023, 12RP88745
-
J Transl Med, 2023, 21(1):50
-
Cell Death Discov, 2023, 9(1):97
|
|
S1794 |
Fenofibrate
|
Fenofibrate是一种Fibrate类化合物,是纤维酸衍生物。Fenofibrate 是 PPARα 的选择性激动剂,EC50为30μM。Fenofibrate 可结合并抑制 cytochrome P450 epoxygenase (CYP)2C ,对于CYP2C19、CYP2B6和CYP2C9的IC50分别为0.2 μM、0.7 μM和9.7 μM。Fenofibrate 可诱导自噬。 |
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Heliyon, 2024, 10(11):e31861
-
Cancer Lett, 2023, 10.1016/j.canlet.2023.216427
-
Cell Metab, 2022, 34(2):299-316.e6
|
|
S2900 |
Cobicistat
|
Cobicistat是一种有效的CYP3A选择性抑制剂,IC50为30 - 285 nM。 |
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J Pers Med, 2022, 12(2)258
-
Hum Cell, 2022, 10.1007/s13577-022-00671-y
-
Hum Cell, 2021, 34(6):1911-1918
|
|
S2046 |
Pioglitazone HCl
|
Pioglitazone HCl (AD-4833, U-72107E) 是一种 cytochrome P450 (CYP)2C8 和 CYP3A4 酶的抑制剂。Pioglitazone HCl 抑制CYP2C8、CYP3A4和CYP2C9的Ki值分别为1.7 μM、11.8 μM和32.1 μM。Pioglitazone HCl 也是一种选择性的 peroxisome proliferator-activated receptor-gamma (PPARγ) 激动剂,对人PPARγ和小鼠PPARγ的EC50值分别为0.93 μM和0.99 μM。Pioglitazone HCl 可抑制线粒体内铁的摄取、脂质过氧化和随后的铁死亡。 |
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J Transl Med, 2024, 22(1):593
-
Commun Biol, 2022, 5(1):231
-
J Genet Genomics, 2022, S1673-8527(22)00133-3
|
|
S2394 |
Naringenin
|
Naringenin (NSC 34875, S-Dihydrogenistein, NSC 11855, Salipurol)是来自于食用植物的一种天然的主要黄酮类化合物,有益人体健康,具有生物活性,是一种抗氧化剂,自由基清除剂,抗炎,碳水化合物代谢启动子及免疫系统的调制剂。 |
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J Transl Med, 2024, 22(1):208
-
J Lipid Res, 2024, S0022-2275(24)00044-0
-
Molecules, 2023, 28(13)4947
|
|
S4662 |
Atazanavir
|
Atazanavir (Latazanavir, Zrivada, Reyataz, BMS-232632) 是一种氮杂肽及HIV-蛋白酶抑制剂,常与其他抗HIV药物结合,用于治疗HIV感染以及获得性免疫缺乏综合征。Atazanavir 是 cytochrome P450 isozyme 3A (CYP3A4) 的底物和抑制剂,也是 P-glycoprotein 的抑制剂和诱导剂。 |
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Int J Mol Sci, 2022, 23(23)15380
-
Chemistry, 2022, e202202798.
-
Sci Rep, 2021, 11(1):19443
|
|
S1952 |
Methoxsalen
|
Methoxsalen (Xanthotoxin, NCI-C55903) 是在一些植物中发现的天然存在的呋喃香豆素化合物,包括补骨脂,用于治疗牛皮癣,湿疹,白癜风及一些暴露在阳光下的皮肤淋巴瘤。是CYP2A5/6抑制剂。 |
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J Pers Med, 2022, 12(2)258
-
Hum Cell, 2022, 10.1007/s13577-022-00671-y
-
Hum Cell, 2021, 34(6):1911-1918
|
|
S2803 |
Galeterone
|
Galeterone (TOK-001)是一种选择性CYP17抑制剂,也是androgen receptor (AR)(雄激素受体)拮抗剂,IC50分别为300 nM和384 nM,也有效抑制人类前列腺肿瘤生长。Phase 2。 |
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ChemMedChem, 2022, e202200043
-
Cancer Chemother Pharmacol, 2020, 10.1007/s00280-020-04195-w
-
Steroids, 2020, 153:108534
|
|
S2555 |
Clarithromycin
|
Clarithromycin (A-56268) 是一种大环内酯类抗生素,是CYP3A4抑制剂,用于治疗许多细菌感染。 |
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Microorganisms, 2022, 10(7)1421
-
Cell Biol Toxicol, 2021, 10.1007/s10565-021-09646-5
-
J Ovarian Res, 2019, 12(1):107
|
|
S5658 |
Omeprazole Sodium
|
Omeprazole Sodium is the sodium salt form of omeprazole, which is a proton pump inhibitor and suppresses gastric acid secretion. Omeprazole Sodium is a metabolism-dependent inhibitor (MDI) of CYP2C19. |
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Theranostics, 2021, 11(5):2364-2380
-
Theranostics, 2021, 11(5):2364-2380
-
J Virol, 2021, JVI.00190-21
|
|
S2380 |
Diosmetin
|
Diosmetin (Luteolin 4-methyl ether)是在Spearmint, Oregano, 和许多其他植物中发现的生物类黄酮。 |
-
Mol Med Rep, 2020, 22(2):1335-1341
-
J Med Virol, 2019, 91(8):1440-1447
-
Int J Biol Sci, 2019, 15(11):2497-2508
|
|
S2526 |
Alizarin
|
Alizarin是一种从茜草Rubia tinctorum L的根中提取的红色媒染剂。 Alizarin 能够强烈抑制 P450 同工型 CYP1A1、CYP1A2 和 CYP1B1,酶测定中的 IC50 分别为 6.2 μM、10.0 μM 和 2.7 μM 。 同时,也有文献报道Alizarin可增加 HepG2 细胞中 CYP1A1 酶活性,并作为 AHR 受体的激动剂。 |
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Chem Res Toxicol, 2023, 36(8):1361-1373
-
BMC Med, 2022, 20(1):365
-
Cell Rep, 2020, 14;31(2):107518
|
|
S7456 |
Osilodrostat (LCI699)
|
LCI699 (Osilodrostat) 是有效的11β-hydroxylase (CYP11B)抑制剂,11β-hydroxylase是催化皮质醇合成的最后一步。 |
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Cells, 2022, 11(21)3344
-
Drug Metab Dispos, 2022, 50(2):114-127
-
J Inorg Biochem, 2022, 235:111934
|
|
S1195 |
Orteronel
|
Orteronel(TAK-700)是一种有效的,高度选择性的,人17,20-lyase抑制剂,IC50为38 nM,比作用于其他CYPs(例如11-羟化酶和CYP3A4)选择性高1000倍以上。TAK-700 (Orteronel) 是一种雄性激素 androgen 生物合成抑制剂。Phase 3。 |
-
Toxicol Appl Pharmacol, 2023, 475:116638
-
Drug Metab Dispos, 2017, 45(6):635-645
-
Biochem Biophys Res Commun, 2016, 477(4):1005-10
|
|
S2401 |
Sodium Danshensu
|
Sodium Danshensu是丹参素的单钠盐,是从Salvia miltiorrhiza Bge中分离的天然酚酸,是咖啡酸衍生物。 |
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Molecules, 2023, 28(4)1551
-
Front Pharmacol, 2022, 13:946668
-
Front Pharmacol, 2022, 13:946668
|
|
S3931 |
Ginsenoside Rd
|
Ginsenoside Rd (Panaxoside Rd, Sanchinoside Rd), a minor ginseng saponin, has several pharmacological activities such as immunosuppressive activity, anti-inflammatory activity, immunological adjuvant, anti-cancer activity and wound-healing activity. Ginsenoside Rd inhibits TNFα-induced NF-κB transcriptional activity with an IC50 of 12.05±0.82 μM in HepG2 cells. Ginsenoside Rd inhibits expression of COX-2 and iNOS mRNA. Ginsenoside Rd also inhibits Ca2+ influx. Ginsenoside Rd inhibits CYP2D6, CYP1A2, CYP3A4, and CYP2C9, with IC50s of 58.0±4.5 μM, 78.4±5.3 μM, 81.7±2.6 μM, and 85.1±9.1 μM, respectively. |
-
Drug Des Devel Ther, 2022, 16:2767-2782
-
J Ginseng Res, 2022, 46(5):700-709
-
J Ethnopharmacol, 2021, S0378-8741(21)00169-0
|
|
S3874 |
Curcumenol
|
Curcumenol, a sesquiterpene isolated from Curcuma zedoaria, is known to possess a variety of health and medicinal values which includes neuroprotection, anti-inflammatory, anti-tumor and hepatoprotective activities. It inhibits NF-κB activation by suppressing the nuclear translocation of the NF-κB p65 subunit and blocking IκBα phosphorylation and degradation. |
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Front Pharmacol, 2022, 13:905966
-
J Bone Miner Res, 2021, 10.1002/jbmr.4328
-
Int J Mol Med, 2021, 48(4)192
|
|
S5266 |
Stiripentol
|
Stiripentol (BCX2600) is a third-generation anti-epileptic drug that enhances GABAergic neurotransmission. It is an inhibitor of cytochrome P450. |
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Cell Metab, 2022, 34(1):90-105.e7
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Front Pharmacol, 2021, 12:785586
|
|
S6868 |
Alflutinib (Furmonertinib) mesylate
|
Alflutinib (Furmonertinib) mesylate是第三代 epidermal growth factor receptor (EGFR) 的抑制剂,可抑制EGFR敏感突变和T790M突变。Alflutinib (AST2818) 主要由CYP3A4代谢,也是有效的 CYP3A4 的诱导剂,EC50值为0.25 μM。 |
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Biomedicines, 2024, 12(7)1412
-
Int J Mol Sci, 2023, 24(18)13972
-
Int J Mol Sci, 2023, 24(18)13972
|
|
S3833 |
Amentoflavone
|
Amentoflavone (Didemethyl Ginkgetin) is a biflavonoid originally isolated from Selaginella with antibacterial, antioxidant, antiviral, antidiabetic, and neuroprotective activities. |
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Front Plant Sci, 2021, 12:740923
-
Viruses, 2019, 11(5)E466
|
|
S5967 |
Berberine chloride hydrate
|
Berberine (Natural Yellow 18) chloride hydrate 是属于异喹啉生物碱的季铵盐。Berberine 可激活 caspase 3 和 caspase 8,poly ADP-ribose polymerase (PARP) 的切割和 cytochrome c 的释放。Berberine chloride 可降低 c-IAP1、Bcl-2 和 Bcl-XL 的表达。Berberine chloride 通过 JNK 和 p38 MAPK 的持续磷酸化以及 ROS的生成来诱导凋亡。Berberine chloride 是一种 topoisomerase I 和 II 的双重抑制剂。Berberine chloride 也是一种潜在的自噬调节剂。 |
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Front Biosci (Landmark Ed), 2022, 27(8):242
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Front Pharmacol, 2021, 12:632201
|
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S3673 |
Sulfaphenazole
|
Sulfaphenazole (Depocid, Depotsulfonamide, Plisulfan, Raziosulfa) is an inhibitor of CYP2C9 with Ki value of 0.3 μM and demonstrates at least 100-fold selectivity over other CYP450 isoforms (Ki values of 63 and 29 μM for CYP2C8 and CYP2C18, respectively, and no activity at CYP1A1, CYP1A2, CYP3A4, CYP2C19). |
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UNIVERSITY OF APPLIED SCIENCES, 2023,
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Chem Biol Interact, 2022, 353:109801
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Chem Biol Interact, 2022, 365:110070
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S3917 |
Tetrahydrocurcumin
|
Tetrahydrocurcumin (Tetrahydrodiferuloylmethane, Tetrahydro Curcumin), a major metabolite of curcumin, possesses strong antioxidant and cardioprotective properties. |
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J Gerontol A Biol Sci Med Sci, 2022, 77-8:1485-1493
-
Invest Ophthalmol Vis Sci, 2022, 63(6):26
|
|
S3660 |
Uniconazole (S 3307D)
|
Uniconazole (S 3307D, XE 1019D) is a well known inhibitor of cytochrome P450 monooxygenase that prevents the biosynthesis of trans-zeatin. Uniconazole targets CYP735As with Ki of 22 μM. |
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Nat Microbiol, 2022, 10.1038/s41564-022-01072-5
-
Nat Biotechnol, 2021, 10.1038/s41587-021-00860-4
|
|
S2329 |
Naringin
|
Naringin (Naringoside) 是一种黄酮苷,是葡萄柚中的主要的类黄酮,具有柚子汁的苦味。具有抗氧化,降血脂,抗肿瘤活性,并且对cytochrome P450有抑制作用。 |
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Am J Transl Res, 2021, 13(6):6330-6341
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Int J Mol Sci, 2020, 21(14):5025
|
|
S5416 |
Metyrapone
|
Metyrapone (NSC-25265, SU-4885) is an inhibitor of the enzyme steroid 11-beta-monooxygenase (CYP11B1) that inhibits adrenal steroid synthesis. |
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Cells, 2022, 11(21)3344
|
|
S6790 |
Ellipticine hydrochloride
|
Ellipticine Hydrochloride (NSC 71795, PZE)是一种有效的 DNA topoisomerase II 的抑制剂,并通过其与 cytochromes P450 (CYP) 和 peroxidases 的氧化作用介导形成共价DNA加合物。Ellipticine Hydrochloride 是从澳大利亚的夹竹桃科常绿乔木中分离出来的具有抗肿瘤活性的天然产物。 |
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Viruses, 2022, 15(1)105
|
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S3766 |
Tanshinone IIA sulfonate sodium
|
Sodium tanshinone IIA sulfonate (STS) is a water-soluble derivative of tanshinone IIA isolated as the main pharmacologically active natural compound from a traditional Chinese herbal medicine, the dried root of Salvia miltiorrhiza Bunge known as Danshen. Sodium tanshinone IIA sulfonate (STS) is a potent negative allosteric modulator of the human purinergic receptor P2X7. Sodium tanshinone IIA sulfonate (STS) inhibits the activity of CYP3A4 and store-operated Ca2+ entry (SOCE) through store-operated Ca2+ channels (SOCC) via downregulating the expression of transient receptor potential canonical proteins (TRPC). |
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J Inflamm Res, 2022, 15:6293-6306
|
|
S4221 |
Benzbromarone
|
Benzbromarone(Desuric) 是CYP2C9抑制剂,与CYP2C9 结合,Ki为19.3 nM。 |
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Hum Mol Genet, 2020, ddaa244
|
|
S2344 |
Piperine
|
Piperine (1-Piperoylpiperidine) 是一种生物碱,是造成黑胡椒和长胡椒辛辣的原因,也用于一些传统医学领域,且作为杀虫剂。 |
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Int J Mol Med, 2015, 36(5):1369-76
|
|
S2496 |
Ozagrel
|
Ozagrel (OKY-046)是一种有效的,选择性的血栓素A2合成酶抑制剂,IC50为4 nM。 |
|
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S1739 |
Thiabendazole
|
Thiabendazole 抑制线粒体蠕虫特异性酶,延胡索酸还原酶,具有驱虫药的性能。是一种有效的CYP1A2的抑制剂。 |
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S2067 |
Ozagrel HCl
|
Ozagrel HCl (OKY-046)是选择性血栓素A2合成酶抑制剂,其在兔子血小板中IC50为11 nM, 用作改善手术后脑血管收缩,以及伴随的脑梗塞。 |
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S4155 |
Chlorzoxazone
|
Chlorzoxazone(Chlorzoxazon,Paraflex)是一种肌肉松弛的药物,作为人体肝脏细胞色素P-450IIE1的探针。 |
|
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S5169 |
2,6-Dihydroxyanthraquinone
|
2,6-Dihydroxyanthraquinone (Anthraflavic acid, Anthraflavin) is a potent and specific inhibitor of cytochrome P-448 activity. |
|
|
S0721 |
Ticlopidine
|
Ticlopidine (Yuclid, Ticlopidinum, Ticlopidina,PCR 5332) 是一种 adenosine diphosphate (ADP) 诱导的 platelet aggregation 的口服活性抑制剂。Ticlopidine 也是 CYP2B6 的抑制剂,Ki值为0.2 μM。 |
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S0922 |
Salvianolic acid C
|
Salvianolic acid C是一种非竞争性的细胞色素P4502C8 (Cytochrome P4502C8, CYP2C8)抑制剂和细胞色素P45022J2(Cytochrome P45022J2, CYP2J2)的中度混合抑制剂。 |
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A5216 |
Cytochrome P450 2D6 Rabbit Recombinant mAb
|
|
|
|
S2921 |
PF-4981517
|
PF-4981517 (CYP3cide, PF-04981517) 是一种有效的,选择性的CYP3A4(P450)抑制剂,IC50为0.03 μM,比作用于CYP3A5和CYP3A7选择性高500倍以上。 |
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S3273 |
Hypericin
|
Hypericin (Hyp, HY) 是一种在 common St. John's Wort (Hypericum species) 中发现的天然物质,具有抗抑郁、抗肿瘤和抗病毒 (人类免疫缺陷病毒HIV和丙型肝炎病毒HCV) 活性。Hypericin 对 MAO (monoaminoxidase)、PKC (protein kinase C)、dopamine-beta-hydroxylase、reverse transcriptase、telomerase 和 CYP (cytochrome P450)。 |
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Eur J Pharmacol, 2021, 900:174071
|
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S3291 |
Myristicin
|
Myristicin (Myristicine) 是一种在 Myristica fragrans 的种子 Nutmeg 中的萜烯样活性成分,是 monamine oxidase (MAO) 的弱抑制剂和 CYP1A2 的机理抑制剂。 |
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S5252 |
Ozagrel sodium
|
Ozagrel sodium (KCT-0809, Cataclot, Xanbo) is a thromboxane A2 synthase (CYP5) inhibitor with neuroprotective properties. |
|
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E1650 |
Opevesostat (ODM208)
|
Opevesostat (ODM208) 是一流的选择性非甾体口服 CYP11A1 抑制剂。 ODM208 在体外肾上腺皮质癌细胞模型、成年未去势雄性小鼠和狗以及 CRPC 患者中表现出快速、完全、持久和可逆的类固醇激素生物合成抑制作用。 |
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A5239 |
Alas1 Rabbit Recombinant mAb
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S0541 |
Dazoxiben hydrochloride
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Dazoxiben hydrochloride (HCl) 是一种 thromboxane (TX) synthase.的有效,选择性和口服活性抑制剂。Dazoxiben 可抑制人全血中 TXB2 的产生,其IC50值为0.3 μM,并可平行地增强 PGE2 的产生。 |
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S9250 |
Isosilybin
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Isosilybin (Silymarin, Isosilybinin, Q-100795)是一种在水飞蓟(S. marianum)果实提取物中发现的黄烷醇,具有抗氧化和抗癌活性。Isosilybin 抑制 CYP3A4 诱导,IC50为74 μM。 |
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S6606 |
CDD3505
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CDD3505可通过诱导肝脏细胞色素P450IIIA活性,提高高密度脂蛋白胆固醇(HDL)水平。 |
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S9257 |
Acetylshikonin
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Acetylshikonin is a biologically active compound with anti-cancer and anti-inflammatory activity, which is isolated from the roots of Lithospermum erythrorhizoma. It is a novel general P450 inhibitor with IC50 values of 1.4-4.0 μM for all tested P450s. |
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E0214 |
Pachymic acid
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Pachymic acid(3-O-Acetyltumulosic acid)抑制CYP2C9的活性,IC50为21.25 µM。 |
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S4938 |
Cedrol
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Cedrol是一种天然存在的倍半萜烯醇,是有效的、竞争性的抑制剂,抑制CYP2B6介导的安非他酮羟化酶(bupropion hydroxylase),Ki值为0.9 μM。它还能抑制CYP3A4介导的咪达唑仑羟基化,Ki为3.4 μM。对CYP2C8, CYP2C9和CYP2C19的活性仅有微弱的抑制作用。 |
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S2389 |
Naringin Dihydrochalcone
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Naringin Dihydrochalcone 是一种新型甜味剂,是来自柚皮苷的一种人工甜味剂。也是一种CYP enzymes的抑制剂。 |
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S4741 |
Danshensu
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Danshensu (Salvianic acid A),是一种传统中药中的中草药,具有潜在的抗肿瘤和抗血管生成的效果。Danshensu 可抑制 CYP2E1 和 CYP2C9,对应的IC50值分别为36.63 μm和 75.76 μm。 |
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S2271 |
Berberine chloride
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Berberine chloride是异喹啉类生物碱的季铵盐。Berberine chloride 可激活 caspase 3 和 caspase 8,分裂 poly ADP-ribose polymerase (PARP) 和释放 cytochrome c。Berberine chloride 可降低 c-IAP1,Bcl-2 和 Bcl-XL 的表达。Berberine chloride 可通过 JNK 和 p38 MAPK 的持续磷酸化以及产生 ROS 来诱导凋亡。Berberine chloride 是一个 topoisomerase I 和 II 的双效抑制剂。Berberine chloride 也是一个潜在的自噬调节剂。 |
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Adv Healthc Mater, 2023, e2300591.
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Transl Oncol, 2023, 35:101712
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J Biomol Struct Dyn, 2022, 1-11
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E4855New |
Sertaconazole
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Sertaconazole(FI-7045)是一种咪唑类抗真菌药物,通过抑制细胞色素p450依赖的14α-lanosterol demethylase (Erg11p)抑制麦角甾醇的生物合成。这种抑制破坏了真菌细胞膜的完整性,最终导致真菌细胞死亡,因此可用于表面真菌病的局部治疗。 |
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A5282 |
Aromatase Rabbit Recombinant mAb
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S9299 |
Ginsenoside F1
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Ginsenoside F1 是人参的药物成分,已知具有抗衰老、抗氧化、抗癌和角质形成细胞的保护作用。Ginsenoside F1 对 CYP3A4 活性具有竞争性抑制作用,Ki值为67.8 ± 16.2 μM。Ginsenoside F1 对 CYP2D6 的抑制作用较弱。 |
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S4963 |
Purpurin
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Purpurin (1,2,4-Trihydroxyanthraquinone, Hydroxylizaric acid, Verantin)是从茜草根和其他茜草科植物家族中分离出的天然色素。它具有抗血管生成、抗菌、抗氧化活性。Purpurin 可有效地抑制CYP1A1、CYP1A2 和 CYP1B1。 |
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E0531 |
TMS
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TMS ((E)-2,3',4,5'-tetramethoxystilbene)是一种选择性和竞争性的人细胞色素P450s B1 (human cytochrome P450s B1, CYP1B1)抑制剂,IC50为6 nM。 |
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S3777 |
Gentiopicroside
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Gentiopicroside (GE, Gentiopicrin), a naturally occurring iridoid glycoside, inhibits CYP2A6 and CYP2E1 with IC50 values of 21.8μg/ml and 594μg/ml, respectively in human liver microsomes, and dose not inhibit CYP2C9, CYP2D6, CYP1A2 or CYP3A4 activities. |
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S0110 |
APD597
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APD-597 (JNJ-38431055) 是一种有效的、选择性的 G protein-coupled receptor 119 (GPR119) 的激动剂,对hGPR119的EC50值为46 nM,也是 Cytochrome P450 2C9 (CYP2C9) 的抑制剂,IC50值为5.8 μM。APD-597 (JNJ-38431055) 被开发用于治疗2型糖尿病(T2D)。 |
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S5969 |
Dicloxacillin Sodium hydrate
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Dicloxacillin Sodium hydrate (DLX, Dycill, Dynapen, Pathocil) 是一种青霉素类的窄谱β-内酰胺抗生素,可在临床上水平上诱导药物代谢有关的 CYP enzymes 水平。 |
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S4831 |
Piperonyl butoxide
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Piperonyl butoxide (PBO, Butacide, Ethanol butoxide, Pyrenone 606,ENT-14250)是一种人造的农药增效剂,与杀虫剂一起作用能够增强其有效性。 |
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E1830New |
Baxdrostat
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Baxdrostat(CIN-107)是一种选择性、有效的醛固酮合成酶 (CYP11B2) 抑制剂,醛固酮合成酶是醛固酮合成途径中的限速酶,具有治疗难治性高血压的潜力。它还抑制多药和毒素排出 1 (MATE1) 和 MATE2-K 的功能,IC50 值分别为 1.34 µM 和 2.67 µM。 |
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E2912 |
MEHP
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MEHP (Phthalic acid mono-2-ethylexyl ester) 是一种 CYP2C9 的竞争性抑制剂,IC50 为 6.37 μM。 |
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S0175 |
DMU2105
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DMU2105 是一种有效且特异的 CYP1B1 抑制剂,其IC50值为10 nM。 |
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S0176 |
DMU2139
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DMU2139 是一种有效且特异的 CYP1B1 抑制剂,其IC50值为9 nM。 |
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S0418 |
Ezutromid
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Ezutromid (SMT C1100,BMN 195,VOX-C1100)是一种首创的口服活性苯并恶唑肌营养相关蛋白(utrophin)调节剂,EC50为0.91 μM,可用于杜氏营养不良症(Duchenne muscular dystrophy, DMD),还可抑制人肝微粒体(human liver microsomes, HLM)中CYP1A2的酶活性,IC50为5.4 μM。 |
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S3719 |
Topiroxostat
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Topiroxostat is a xanthine oxidoreductase (XOR) inhibitor and used for treatment of gout and hyperuricemia. Topiroxostat exhibits weak CYP3A4-inhibitory activity (18.6%). Topiroxostat has the potential for hyperuricemia treatment. |
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S2571New |
Quinidine
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Quinidine是I类抗心律失常药。 |
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S6886 |
1-Aminobenzotriazole
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1-Aminobenzotriazole (ABT, 3-Aminobenzotriazole, 1-Benzotriazolylamine, NSC 114498, NSC 656987) 是一种非选择性且不可逆的 cytochrome P450 (CYP) enzymes 的抑制剂。1-Aminobenzotriazole 还是 N-acetyltransferase (NAT) 的底物和抑制剂。 |
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S9442 |
Bergaptol
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Bergaptol (5-Hydroxypsoralen, 5-Hydroxyfuranocoumarin)是在柠檬、佛手柑等柑橘精油中发现的天然呋喃香豆素。Bergaptol 是有效的 CYP3A4 酶脱苄基活性抑制剂,IC50值为24.92 μM。 |
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Molecules, 2024, 29(3)713
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S5380 |
7-Hydroxyflavone
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7-Hydroxyflavone is a potent inhibitor of CYP1A1 with a Ki value of 0.015 μM and exhibits 6-fold greater selectivity for CYP1A1 over CYP1A2. It also has excellent antioxidant properties and great potential to be applied as medicines. |
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S5529 |
Galangin
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Galangin (3,5,7-trihydroxyflavone; Norizalpinin), a naturally occuring flavonoid found in herbs, is a well-known antioxidant and also an inhibitor of CYP1A1 activity and an agonist/antagonist of the aryl hydrocarbon receptor. |
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S4784 |
Phloracetophenone
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Phloracetophenone, or 2,4,6-trihydroxyacetophenone (THA), the aglycone component of phloracetophenone glucoside, is a naturally occurring compound obtained from the rhizome of Curcuma comosa (Family Zingiberaceae). |
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S9241 |
Polygalaxanthone III
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Polygalaxanthone III 是一种天然产物,具有镇静,减轻感冒,消除痰液和消肿的功效。Polygalaxanthone III 抑制 CYP2E1 催化的氯唑沙宗6-羟基化反应,IC50值为50.56 μM。 |
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S6594 |
Liarozole dihydrochloride
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Liarozole Dihydrochloride 是 P450 的温和抑制剂,对 CYP26 和大鼠 CYP17 的 IC50 分别为 2.2–6.0 μM 和 260 nM。 |
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S9163 |
Rhapontigenin
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Rhapontigenin (Protigenin), produced from rhapontin isolated from a methanol extract of Rheum undulatum roots by enzymatic transformation, is a selective inactivator of cytochrome P450 1A1 (IC50 = 400 nM). |
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S0230 |
NVP-VID-400
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NVP-VID-400 (SDZ285428) 是 CYP51 的抑制剂。NVP-VID-400 (SDZ285428) 抑制 T. cruzi 和 T. brucei 的I/E2a(5 min) 值均 <1 而 I/E2(60 min) 值分别为9和35。 |
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S3227 |
5,7-Dimethoxyflavone
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5,7-Dimethoxyflavone (5,7-DMF) 是一种 cytochrome P450 (CYP) 3As 的抑制剂,可显著地降低肝脏中CYP3A11和CYP3A25的表达。5,7-Dimethoxyflavone (5,7-DMF) 也是一种有效的 Breast Cancer Resistance Protein (BCRP, ABCG2) 的抑制剂。5,7-Dimethoxyflavone (5,7-DMF) 是Kaempferia parviflora的主要成分之一,具有抗肥胖、抗炎和抗肿瘤作用。 |
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S6437 |
Oxolamine Citrate
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Oxolamine (SKF-9976, AF-438) citrate 是一种止咳药,是 CYP2B1/2 的抑制剂。Oxolamine citrate 也表现出抗炎作用。 |
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S1185 |
Ritonavir
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Ritonavir是Cytochrome P450 3A和HIV蛋白酶抑制剂,用于治疗HIV感染和AIDS。抑制Cytochrome P450 2D6, P-Glycoprotein,诱导Cytochrome P450 2C19, Cytochrome P450 1A2, Cytochrome P450 2C9, Cytochrome P450 2B6和UDP Glucuronosyltransferases。Ritonavir 可诱导凋亡。 |
- Cell Chem Biol, 2024, S2451-9456(24)00396-9
- Antiviral Res, 2024, 225:105840
- Cancer Drug Resist, 2024, 7:3
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S2476 |
Itraconazole
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Itraconazole是一种三唑类抗真菌药物,是CYP3A4的有效抑制剂,IC50为6.1 nM。Itraconazole 是一个有效的Hedgehog (Hh)信号通路的拮抗剂。Itraconazole 可通过诱导自噬来抑制恶性胶质瘤的生长。 |
- Front Cell Infect Microbiol, 2023, 13:1128000
- Front Cell Infect Microbiol, 2023, 13:1131641
- Front Cell Infect Microbiol, 2022, 12:864912
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S1123 |
Abiraterone
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Abiraterone是一种有效CYP17抑制剂,无细胞试验中IC50为2 nM。Abiraterone (CB-7598) 是一种雄性激素 androgen 生物合成抑制剂。 |
- Cancer Res, 2023, 83(8):1361-1380
- Cancer Cell, 2021, S1535-6108(21)00659-0
- Cancers (Basel), 2021, 13(16)3959
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S2246 |
Abiraterone Acetate
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Abiraterone Acetate是Abiraterone的醋酸盐形式,是一种甾体类细胞色素CYP17抑制剂,无细胞试验中IC50为72 nM。Abiraterone acetateis 是一种口服的雄性激素 androgen 生物合成抑制剂。 |
- Cells, 2024, 13(19)1622
- Cancer Res, 2023, 83(2):219-238
- J Immunother Cancer, 2023, 11(5)e006581
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S2262 |
Apigenin
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Apigenin是一种有效的CYP2C9抑制剂,Ki为2 μM.。 |
- Antioxidants (Basel), 2024, 13(5)611
- bioRxiv, 2024, 2024.04.04.588167
- bioRxiv, 2024, 2024.04.04.588167
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S2268 |
Baicalein
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Baicalein是CYP2C9和脯氨酰肽链内切酶抑制剂。 |
- SLAS Discov, 2024, S2472-5552(24)00007-8
- Redox Rep, 2023, 28(1):2152607
- Microbiol Spectr, 2023, 11(3):e0470222
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S1257 |
Posaconazole
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Posaconazole是CYP3A4的抑制剂,但不抑制其他CYP酶的活性;同时是sterol C14ɑ demethylase的抑制剂,IC50为0.25 μM。其平均的消除半衰期为15-35小时。 |
- Front Cell Infect Microbiol, 2023, 13:1131641
- Front Cell Infect Microbiol, 2022, 12:1074903
- Front Cell Infect Microbiol, 2022, 12:864912
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S1331 |
Fluconazole
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Fluconazole是一种羊毛甾醇14 alpha去甲基化酶 抑制剂,抑制了麦角固醇的形成,用于治疗和预防浅表性和全身性真菌感染。 |
- Front Cell Infect Microbiol, 2024, 14:1296151
- Front Cell Infect Microbiol, 2023, 13:1131641
- Nat Commun, 2022, 13(1):1658
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S1353 |
Ketoconazole
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Ketoconazole能抑制cyclosporine oxidase(环孢素氧化酶)和testosterone 6 beta-hydroxylase(睾丸素6β-羟化酶),IC50分别为0.19 mM和0.22 mM。Ketoconazole 是一种雄性激素 androgen 生物合成抑制剂。 |
- J Med Virol, 2023, 95(6):e28856
- J Med Virol, 2023, 95(6):e28856
- Cell Death Dis, 2023, 14(1):64
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S4202 |
Verapamil HCl
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Verapamil HCl是L-型钙通道抑制剂,是第四类抗心律失常的药剂。Verapamil 可抑制 permeability-glycoprotein (P-gp) 和 CYP3A4。 |
- NPJ Precis Oncol, 2024, 8(1):94
- Int J Mol Sci, 2024, 25(18)10162
- Biomedicines, 2024, 12(4)904
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S2187 |
Avasimibe
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Avasimibe 抑制ACAT,IC50为3.3 μM,也抑制人P450同工酶CYP2C9, CYP1A2和CYP2C19,IC50分别为2.9 μM, 13.9 μM和26.5 μM, |
- Nat Commun, 2024, 15(1):8301
- PLoS Pathog, 2023, 19(5):e1011323
- Hepatol Int, 2023, 10.1007/s12072-023-10490-4
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S1794 |
Fenofibrate
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Fenofibrate是一种Fibrate类化合物,是纤维酸衍生物。Fenofibrate 是 PPARα 的选择性激动剂,EC50为30μM。Fenofibrate 可结合并抑制 cytochrome P450 epoxygenase (CYP)2C ,对于CYP2C19、CYP2B6和CYP2C9的IC50分别为0.2 μM、0.7 μM和9.7 μM。Fenofibrate 可诱导自噬。 |
- Heliyon, 2024, 10(11):e31861
- Cancer Lett, 2023, 10.1016/j.canlet.2023.216427
- Cell Metab, 2022, 34(2):299-316.e6
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S2900 |
Cobicistat
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Cobicistat是一种有效的CYP3A选择性抑制剂,IC50为30 - 285 nM。 |
- J Pers Med, 2022, 12(2)258
- Hum Cell, 2022, 10.1007/s13577-022-00671-y
- Hum Cell, 2021, 34(6):1911-1918
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S2046 |
Pioglitazone HCl
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Pioglitazone HCl (AD-4833, U-72107E) 是一种 cytochrome P450 (CYP)2C8 和 CYP3A4 酶的抑制剂。Pioglitazone HCl 抑制CYP2C8、CYP3A4和CYP2C9的Ki值分别为1.7 μM、11.8 μM和32.1 μM。Pioglitazone HCl 也是一种选择性的 peroxisome proliferator-activated receptor-gamma (PPARγ) 激动剂,对人PPARγ和小鼠PPARγ的EC50值分别为0.93 μM和0.99 μM。Pioglitazone HCl 可抑制线粒体内铁的摄取、脂质过氧化和随后的铁死亡。 |
- J Transl Med, 2024, 22(1):593
- Commun Biol, 2022, 5(1):231
- J Genet Genomics, 2022, S1673-8527(22)00133-3
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S2394 |
Naringenin
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Naringenin (NSC 34875, S-Dihydrogenistein, NSC 11855, Salipurol)是来自于食用植物的一种天然的主要黄酮类化合物,有益人体健康,具有生物活性,是一种抗氧化剂,自由基清除剂,抗炎,碳水化合物代谢启动子及免疫系统的调制剂。 |
- J Transl Med, 2024, 22(1):208
- J Lipid Res, 2024, S0022-2275(24)00044-0
- Molecules, 2023, 28(13)4947
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S4662 |
Atazanavir
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Atazanavir (Latazanavir, Zrivada, Reyataz, BMS-232632) 是一种氮杂肽及HIV-蛋白酶抑制剂,常与其他抗HIV药物结合,用于治疗HIV感染以及获得性免疫缺乏综合征。Atazanavir 是 cytochrome P450 isozyme 3A (CYP3A4) 的底物和抑制剂,也是 P-glycoprotein 的抑制剂和诱导剂。 |
- Int J Mol Sci, 2022, 23(23)15380
- Chemistry, 2022, e202202798.
- Sci Rep, 2021, 11(1):19443
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S1952 |
Methoxsalen
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Methoxsalen (Xanthotoxin, NCI-C55903) 是在一些植物中发现的天然存在的呋喃香豆素化合物,包括补骨脂,用于治疗牛皮癣,湿疹,白癜风及一些暴露在阳光下的皮肤淋巴瘤。是CYP2A5/6抑制剂。 |
- J Pers Med, 2022, 12(2)258
- Hum Cell, 2022, 10.1007/s13577-022-00671-y
- Hum Cell, 2021, 34(6):1911-1918
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S2803 |
Galeterone
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Galeterone (TOK-001)是一种选择性CYP17抑制剂,也是androgen receptor (AR)(雄激素受体)拮抗剂,IC50分别为300 nM和384 nM,也有效抑制人类前列腺肿瘤生长。Phase 2。 |
- ChemMedChem, 2022, e202200043
- Cancer Chemother Pharmacol, 2020, 10.1007/s00280-020-04195-w
- Steroids, 2020, 153:108534
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S2555 |
Clarithromycin
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Clarithromycin (A-56268) 是一种大环内酯类抗生素,是CYP3A4抑制剂,用于治疗许多细菌感染。 |
- Microorganisms, 2022, 10(7)1421
- Cell Biol Toxicol, 2021, 10.1007/s10565-021-09646-5
- J Ovarian Res, 2019, 12(1):107
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S5658 |
Omeprazole Sodium
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Omeprazole Sodium is the sodium salt form of omeprazole, which is a proton pump inhibitor and suppresses gastric acid secretion. Omeprazole Sodium is a metabolism-dependent inhibitor (MDI) of CYP2C19. |
- Theranostics, 2021, 11(5):2364-2380
- Theranostics, 2021, 11(5):2364-2380
- J Virol, 2021, JVI.00190-21
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S2380 |
Diosmetin
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Diosmetin (Luteolin 4-methyl ether)是在Spearmint, Oregano, 和许多其他植物中发现的生物类黄酮。 |
- Mol Med Rep, 2020, 22(2):1335-1341
- J Med Virol, 2019, 91(8):1440-1447
- Int J Biol Sci, 2019, 15(11):2497-2508
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S2526 |
Alizarin
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Alizarin是一种从茜草Rubia tinctorum L的根中提取的红色媒染剂。 Alizarin 能够强烈抑制 P450 同工型 CYP1A1、CYP1A2 和 CYP1B1,酶测定中的 IC50 分别为 6.2 μM、10.0 μM 和 2.7 μM 。 同时,也有文献报道Alizarin可增加 HepG2 细胞中 CYP1A1 酶活性,并作为 AHR 受体的激动剂。 |
- Chem Res Toxicol, 2023, 36(8):1361-1373
- BMC Med, 2022, 20(1):365
- Cell Rep, 2020, 14;31(2):107518
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S7456 |
Osilodrostat (LCI699)
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LCI699 (Osilodrostat) 是有效的11β-hydroxylase (CYP11B)抑制剂,11β-hydroxylase是催化皮质醇合成的最后一步。 |
- Cells, 2022, 11(21)3344
- Drug Metab Dispos, 2022, 50(2):114-127
- J Inorg Biochem, 2022, 235:111934
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S1195 |
Orteronel
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Orteronel(TAK-700)是一种有效的,高度选择性的,人17,20-lyase抑制剂,IC50为38 nM,比作用于其他CYPs(例如11-羟化酶和CYP3A4)选择性高1000倍以上。TAK-700 (Orteronel) 是一种雄性激素 androgen 生物合成抑制剂。Phase 3。 |
- Toxicol Appl Pharmacol, 2023, 475:116638
- Drug Metab Dispos, 2017, 45(6):635-645
- Biochem Biophys Res Commun, 2016, 477(4):1005-10
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S2401 |
Sodium Danshensu
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Sodium Danshensu是丹参素的单钠盐,是从Salvia miltiorrhiza Bge中分离的天然酚酸,是咖啡酸衍生物。 |
- Molecules, 2023, 28(4)1551
- Front Pharmacol, 2022, 13:946668
- Front Pharmacol, 2022, 13:946668
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S3931 |
Ginsenoside Rd
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Ginsenoside Rd (Panaxoside Rd, Sanchinoside Rd), a minor ginseng saponin, has several pharmacological activities such as immunosuppressive activity, anti-inflammatory activity, immunological adjuvant, anti-cancer activity and wound-healing activity. Ginsenoside Rd inhibits TNFα-induced NF-κB transcriptional activity with an IC50 of 12.05±0.82 μM in HepG2 cells. Ginsenoside Rd inhibits expression of COX-2 and iNOS mRNA. Ginsenoside Rd also inhibits Ca2+ influx. Ginsenoside Rd inhibits CYP2D6, CYP1A2, CYP3A4, and CYP2C9, with IC50s of 58.0±4.5 μM, 78.4±5.3 μM, 81.7±2.6 μM, and 85.1±9.1 μM, respectively. |
- Drug Des Devel Ther, 2022, 16:2767-2782
- J Ginseng Res, 2022, 46(5):700-709
- J Ethnopharmacol, 2021, S0378-8741(21)00169-0
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S3874 |
Curcumenol
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Curcumenol, a sesquiterpene isolated from Curcuma zedoaria, is known to possess a variety of health and medicinal values which includes neuroprotection, anti-inflammatory, anti-tumor and hepatoprotective activities. It inhibits NF-κB activation by suppressing the nuclear translocation of the NF-κB p65 subunit and blocking IκBα phosphorylation and degradation. |
- Front Pharmacol, 2022, 13:905966
- J Bone Miner Res, 2021, 10.1002/jbmr.4328
- Int J Mol Med, 2021, 48(4)192
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S5266 |
Stiripentol
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Stiripentol (BCX2600) is a third-generation anti-epileptic drug that enhances GABAergic neurotransmission. It is an inhibitor of cytochrome P450. |
- Cell Metab, 2022, 34(1):90-105.e7
- Front Pharmacol, 2021, 12:785586
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S3673 |
Sulfaphenazole
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Sulfaphenazole (Depocid, Depotsulfonamide, Plisulfan, Raziosulfa) is an inhibitor of CYP2C9 with Ki value of 0.3 μM and demonstrates at least 100-fold selectivity over other CYP450 isoforms (Ki values of 63 and 29 μM for CYP2C8 and CYP2C18, respectively, and no activity at CYP1A1, CYP1A2, CYP3A4, CYP2C19). |
- UNIVERSITY OF APPLIED SCIENCES, 2023,
- Chem Biol Interact, 2022, 353:109801
- Chem Biol Interact, 2022, 365:110070
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S3917 |
Tetrahydrocurcumin
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Tetrahydrocurcumin (Tetrahydrodiferuloylmethane, Tetrahydro Curcumin), a major metabolite of curcumin, possesses strong antioxidant and cardioprotective properties. |
- J Gerontol A Biol Sci Med Sci, 2022, 77-8:1485-1493
- Invest Ophthalmol Vis Sci, 2022, 63(6):26
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S3660 |
Uniconazole (S 3307D)
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Uniconazole (S 3307D, XE 1019D) is a well known inhibitor of cytochrome P450 monooxygenase that prevents the biosynthesis of trans-zeatin. Uniconazole targets CYP735As with Ki of 22 μM. |
- Nat Microbiol, 2022, 10.1038/s41564-022-01072-5
- Nat Biotechnol, 2021, 10.1038/s41587-021-00860-4
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S2329 |
Naringin
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Naringin (Naringoside) 是一种黄酮苷,是葡萄柚中的主要的类黄酮,具有柚子汁的苦味。具有抗氧化,降血脂,抗肿瘤活性,并且对cytochrome P450有抑制作用。 |
- Am J Transl Res, 2021, 13(6):6330-6341
- Int J Mol Sci, 2020, 21(14):5025
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S5416 |
Metyrapone
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Metyrapone (NSC-25265, SU-4885) is an inhibitor of the enzyme steroid 11-beta-monooxygenase (CYP11B1) that inhibits adrenal steroid synthesis. |
- Cells, 2022, 11(21)3344
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S3766 |
Tanshinone IIA sulfonate sodium
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Sodium tanshinone IIA sulfonate (STS) is a water-soluble derivative of tanshinone IIA isolated as the main pharmacologically active natural compound from a traditional Chinese herbal medicine, the dried root of Salvia miltiorrhiza Bunge known as Danshen. Sodium tanshinone IIA sulfonate (STS) is a potent negative allosteric modulator of the human purinergic receptor P2X7. Sodium tanshinone IIA sulfonate (STS) inhibits the activity of CYP3A4 and store-operated Ca2+ entry (SOCE) through store-operated Ca2+ channels (SOCC) via downregulating the expression of transient receptor potential canonical proteins (TRPC). |
- J Inflamm Res, 2022, 15:6293-6306
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S4221 |
Benzbromarone
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Benzbromarone(Desuric) 是CYP2C9抑制剂,与CYP2C9 结合,Ki为19.3 nM。 |
- Hum Mol Genet, 2020, ddaa244
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S2344 |
Piperine
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Piperine (1-Piperoylpiperidine) 是一种生物碱,是造成黑胡椒和长胡椒辛辣的原因,也用于一些传统医学领域,且作为杀虫剂。 |
- Int J Mol Med, 2015, 36(5):1369-76
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S2496 |
Ozagrel
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Ozagrel (OKY-046)是一种有效的,选择性的血栓素A2合成酶抑制剂,IC50为4 nM。 |
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S1739 |
Thiabendazole
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Thiabendazole 抑制线粒体蠕虫特异性酶,延胡索酸还原酶,具有驱虫药的性能。是一种有效的CYP1A2的抑制剂。 |
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S2067 |
Ozagrel HCl
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Ozagrel HCl (OKY-046)是选择性血栓素A2合成酶抑制剂,其在兔子血小板中IC50为11 nM, 用作改善手术后脑血管收缩,以及伴随的脑梗塞。 |
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S5169 |
2,6-Dihydroxyanthraquinone
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2,6-Dihydroxyanthraquinone (Anthraflavic acid, Anthraflavin) is a potent and specific inhibitor of cytochrome P-448 activity. |
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S0721 |
Ticlopidine
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Ticlopidine (Yuclid, Ticlopidinum, Ticlopidina,PCR 5332) 是一种 adenosine diphosphate (ADP) 诱导的 platelet aggregation 的口服活性抑制剂。Ticlopidine 也是 CYP2B6 的抑制剂,Ki值为0.2 μM。 |
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S0922 |
Salvianolic acid C
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Salvianolic acid C是一种非竞争性的细胞色素P4502C8 (Cytochrome P4502C8, CYP2C8)抑制剂和细胞色素P45022J2(Cytochrome P45022J2, CYP2J2)的中度混合抑制剂。 |
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S2921 |
PF-4981517
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PF-4981517 (CYP3cide, PF-04981517) 是一种有效的,选择性的CYP3A4(P450)抑制剂,IC50为0.03 μM,比作用于CYP3A5和CYP3A7选择性高500倍以上。 |
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S3273 |
Hypericin
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Hypericin (Hyp, HY) 是一种在 common St. John's Wort (Hypericum species) 中发现的天然物质,具有抗抑郁、抗肿瘤和抗病毒 (人类免疫缺陷病毒HIV和丙型肝炎病毒HCV) 活性。Hypericin 对 MAO (monoaminoxidase)、PKC (protein kinase C)、dopamine-beta-hydroxylase、reverse transcriptase、telomerase 和 CYP (cytochrome P450)。 |
- Eur J Pharmacol, 2021, 900:174071
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S3291 |
Myristicin
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Myristicin (Myristicine) 是一种在 Myristica fragrans 的种子 Nutmeg 中的萜烯样活性成分,是 monamine oxidase (MAO) 的弱抑制剂和 CYP1A2 的机理抑制剂。 |
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S5252 |
Ozagrel sodium
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Ozagrel sodium (KCT-0809, Cataclot, Xanbo) is a thromboxane A2 synthase (CYP5) inhibitor with neuroprotective properties. |
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E1650 |
Opevesostat (ODM208)
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Opevesostat (ODM208) 是一流的选择性非甾体口服 CYP11A1 抑制剂。 ODM208 在体外肾上腺皮质癌细胞模型、成年未去势雄性小鼠和狗以及 CRPC 患者中表现出快速、完全、持久和可逆的类固醇激素生物合成抑制作用。 |
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S0541 |
Dazoxiben hydrochloride
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Dazoxiben hydrochloride (HCl) 是一种 thromboxane (TX) synthase.的有效,选择性和口服活性抑制剂。Dazoxiben 可抑制人全血中 TXB2 的产生,其IC50值为0.3 μM,并可平行地增强 PGE2 的产生。 |
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S9250 |
Isosilybin
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Isosilybin (Silymarin, Isosilybinin, Q-100795)是一种在水飞蓟(S. marianum)果实提取物中发现的黄烷醇,具有抗氧化和抗癌活性。Isosilybin 抑制 CYP3A4 诱导,IC50为74 μM。 |
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S9257 |
Acetylshikonin
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Acetylshikonin is a biologically active compound with anti-cancer and anti-inflammatory activity, which is isolated from the roots of Lithospermum erythrorhizoma. It is a novel general P450 inhibitor with IC50 values of 1.4-4.0 μM for all tested P450s. |
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E0214 |
Pachymic acid
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Pachymic acid(3-O-Acetyltumulosic acid)抑制CYP2C9的活性,IC50为21.25 µM。 |
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S4938 |
Cedrol
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Cedrol是一种天然存在的倍半萜烯醇,是有效的、竞争性的抑制剂,抑制CYP2B6介导的安非他酮羟化酶(bupropion hydroxylase),Ki值为0.9 μM。它还能抑制CYP3A4介导的咪达唑仑羟基化,Ki为3.4 μM。对CYP2C8, CYP2C9和CYP2C19的活性仅有微弱的抑制作用。 |
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S2389 |
Naringin Dihydrochalcone
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Naringin Dihydrochalcone 是一种新型甜味剂,是来自柚皮苷的一种人工甜味剂。也是一种CYP enzymes的抑制剂。 |
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E4855New |
Sertaconazole
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Sertaconazole(FI-7045)是一种咪唑类抗真菌药物,通过抑制细胞色素p450依赖的14α-lanosterol demethylase (Erg11p)抑制麦角甾醇的生物合成。这种抑制破坏了真菌细胞膜的完整性,最终导致真菌细胞死亡,因此可用于表面真菌病的局部治疗。 |
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S9299 |
Ginsenoside F1
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Ginsenoside F1 是人参的药物成分,已知具有抗衰老、抗氧化、抗癌和角质形成细胞的保护作用。Ginsenoside F1 对 CYP3A4 活性具有竞争性抑制作用,Ki值为67.8 ± 16.2 μM。Ginsenoside F1 对 CYP2D6 的抑制作用较弱。 |
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S4963 |
Purpurin
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Purpurin (1,2,4-Trihydroxyanthraquinone, Hydroxylizaric acid, Verantin)是从茜草根和其他茜草科植物家族中分离出的天然色素。它具有抗血管生成、抗菌、抗氧化活性。Purpurin 可有效地抑制CYP1A1、CYP1A2 和 CYP1B1。 |
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E0531 |
TMS
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TMS ((E)-2,3',4,5'-tetramethoxystilbene)是一种选择性和竞争性的人细胞色素P450s B1 (human cytochrome P450s B1, CYP1B1)抑制剂,IC50为6 nM。 |
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S3777 |
Gentiopicroside
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Gentiopicroside (GE, Gentiopicrin), a naturally occurring iridoid glycoside, inhibits CYP2A6 and CYP2E1 with IC50 values of 21.8μg/ml and 594μg/ml, respectively in human liver microsomes, and dose not inhibit CYP2C9, CYP2D6, CYP1A2 or CYP3A4 activities. |
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S0110 |
APD597
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APD-597 (JNJ-38431055) 是一种有效的、选择性的 G protein-coupled receptor 119 (GPR119) 的激动剂,对hGPR119的EC50值为46 nM,也是 Cytochrome P450 2C9 (CYP2C9) 的抑制剂,IC50值为5.8 μM。APD-597 (JNJ-38431055) 被开发用于治疗2型糖尿病(T2D)。 |
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S4831 |
Piperonyl butoxide
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Piperonyl butoxide (PBO, Butacide, Ethanol butoxide, Pyrenone 606,ENT-14250)是一种人造的农药增效剂,与杀虫剂一起作用能够增强其有效性。 |
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E1830New |
Baxdrostat
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Baxdrostat(CIN-107)是一种选择性、有效的醛固酮合成酶 (CYP11B2) 抑制剂,醛固酮合成酶是醛固酮合成途径中的限速酶,具有治疗难治性高血压的潜力。它还抑制多药和毒素排出 1 (MATE1) 和 MATE2-K 的功能,IC50 值分别为 1.34 µM 和 2.67 µM。 |
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E2912 |
MEHP
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MEHP (Phthalic acid mono-2-ethylexyl ester) 是一种 CYP2C9 的竞争性抑制剂,IC50 为 6.37 μM。 |
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S0175 |
DMU2105
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DMU2105 是一种有效且特异的 CYP1B1 抑制剂,其IC50值为10 nM。 |
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S0176 |
DMU2139
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DMU2139 是一种有效且特异的 CYP1B1 抑制剂,其IC50值为9 nM。 |
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S0418 |
Ezutromid
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Ezutromid (SMT C1100,BMN 195,VOX-C1100)是一种首创的口服活性苯并恶唑肌营养相关蛋白(utrophin)调节剂,EC50为0.91 μM,可用于杜氏营养不良症(Duchenne muscular dystrophy, DMD),还可抑制人肝微粒体(human liver microsomes, HLM)中CYP1A2的酶活性,IC50为5.4 μM。 |
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S3719 |
Topiroxostat
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Topiroxostat is a xanthine oxidoreductase (XOR) inhibitor and used for treatment of gout and hyperuricemia. Topiroxostat exhibits weak CYP3A4-inhibitory activity (18.6%). Topiroxostat has the potential for hyperuricemia treatment. |
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S2571New |
Quinidine
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Quinidine是I类抗心律失常药。 |
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S6886 |
1-Aminobenzotriazole
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1-Aminobenzotriazole (ABT, 3-Aminobenzotriazole, 1-Benzotriazolylamine, NSC 114498, NSC 656987) 是一种非选择性且不可逆的 cytochrome P450 (CYP) enzymes 的抑制剂。1-Aminobenzotriazole 还是 N-acetyltransferase (NAT) 的底物和抑制剂。 |
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S9442 |
Bergaptol
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Bergaptol (5-Hydroxypsoralen, 5-Hydroxyfuranocoumarin)是在柠檬、佛手柑等柑橘精油中发现的天然呋喃香豆素。Bergaptol 是有效的 CYP3A4 酶脱苄基活性抑制剂,IC50值为24.92 μM。 |
- Molecules, 2024, 29(3)713
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S5380 |
7-Hydroxyflavone
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7-Hydroxyflavone is a potent inhibitor of CYP1A1 with a Ki value of 0.015 μM and exhibits 6-fold greater selectivity for CYP1A1 over CYP1A2. It also has excellent antioxidant properties and great potential to be applied as medicines. |
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S5529 |
Galangin
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Galangin (3,5,7-trihydroxyflavone; Norizalpinin), a naturally occuring flavonoid found in herbs, is a well-known antioxidant and also an inhibitor of CYP1A1 activity and an agonist/antagonist of the aryl hydrocarbon receptor. |
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S9241 |
Polygalaxanthone III
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Polygalaxanthone III 是一种天然产物,具有镇静,减轻感冒,消除痰液和消肿的功效。Polygalaxanthone III 抑制 CYP2E1 催化的氯唑沙宗6-羟基化反应,IC50值为50.56 μM。 |
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S6594 |
Liarozole dihydrochloride
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Liarozole Dihydrochloride 是 P450 的温和抑制剂,对 CYP26 和大鼠 CYP17 的 IC50 分别为 2.2–6.0 μM 和 260 nM。 |
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S9163 |
Rhapontigenin
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Rhapontigenin (Protigenin), produced from rhapontin isolated from a methanol extract of Rheum undulatum roots by enzymatic transformation, is a selective inactivator of cytochrome P450 1A1 (IC50 = 400 nM). |
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S0230 |
NVP-VID-400
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NVP-VID-400 (SDZ285428) 是 CYP51 的抑制剂。NVP-VID-400 (SDZ285428) 抑制 T. cruzi 和 T. brucei 的I/E2a(5 min) 值均 <1 而 I/E2(60 min) 值分别为9和35。 |
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S3227 |
5,7-Dimethoxyflavone
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5,7-Dimethoxyflavone (5,7-DMF) 是一种 cytochrome P450 (CYP) 3As 的抑制剂,可显著地降低肝脏中CYP3A11和CYP3A25的表达。5,7-Dimethoxyflavone (5,7-DMF) 也是一种有效的 Breast Cancer Resistance Protein (BCRP, ABCG2) 的抑制剂。5,7-Dimethoxyflavone (5,7-DMF) 是Kaempferia parviflora的主要成分之一,具有抗肥胖、抗炎和抗肿瘤作用。 |
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S6437 |
Oxolamine Citrate
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Oxolamine (SKF-9976, AF-438) citrate 是一种止咳药,是 CYP2B1/2 的抑制剂。Oxolamine citrate 也表现出抗炎作用。 |
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