A Network Pharmacology Approach to Explore the Potential Mechanisms of Huangqin-Baishao Herb Pair in Treatment of Cancer

Tian Xu; Qingguo Wang; Min Liu

doi:10.12659/MSM.923199

01 July 2020: Clinical Research

A Network Pharmacology Approach to Explore the Potential Mechanisms of Huangqin-Baishao Herb Pair in Treatment of Cancer

Tian Xu ^ABCEF , Qingguo Wang ^E , Min Liu ^AEG*

DOI: 10.12659/MSM.923199

Med Sci Monit 2020; 26:e923199

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Table 1 Detailed information on active ingredients in HQ-BS herb pair.

Mol ID	Molecule Name	Pubchem Cid	MW	OB (%)	DL	Herb
MOL001689	Acacetin	5280442	284.28	34.97	0.24	Huangqin
MOL000173	Wogonin	5281703	284.28	30.68	0.23	Huangqin
MOL000228	(2R)-7-hydroxy-5-methoxy-2-phenylchroman-4-one	821279	270.3	55.23	0.2	Huangqin
MOL002714	Baicalein	5281605	270.25	33.52	0.21	Huangqin
MOL002908	5,8,2′-Trihydroxy-7-methoxyflavone	156992	300.28	37.01	0.27	Huangqin
MOL002909	5,7,2,5-tetrahydroxy-8,6-dimethoxyflavone	44258628	376.34	33.82	0.45	Huangqin
MOL002910	Carthamidin	188308	288.27	41.15	0.24	Huangqin
MOL002911	2,6,2′,4′-tetrahydroxy-6′-methoxychaleone	N/A	302.3	69.04	0.22	Huangqin
MOL002913	Dihydrobaicalin_qt	14135323	272.27	40.04	0.21	Huangqin
MOL002914	Eriodyctiol (flavanone)	373261	288.27	41.35	0.24	Huangqin
MOL002915	Salvigenin	161271	328.34	49.07	0.33	Huangqin
MOL002917	5,2′,6′-Trihydroxy-7,8-dimethoxyflavone	5322059	330.31	45.05	0.33	Huangqin
MOL002925	5,7,2′,6′-Tetrahydroxyflavone	5321865	286.25	37.01	0.24	Huangqin
MOL002926	Dihydrooroxylin A	5316733	286.3	38.72	0.23	Huangqin
MOL002927	Skullcapflavone II	124211	374.37	69.51	0.44	Huangqin
MOL002928	Oroxylin a	5320315	284.28	41.37	0.23	Huangqin
MOL002932	Panicolin	5320399	314.31	76.26	0.29	Huangqin
MOL002933	5,7,4′-Trihydroxy-8-methoxyflavone	5322078	300.28	36.56	0.27	Huangqin
MOL002934	Neobaicalein	124211	374.37	104.34	0.44	Huangqin
MOL002937	Dihydrooroxylin	25721350	286.3	66.06	0.23	Huangqin
MOL000525	Norwogonin	5281674	270.25	39.4	0.21	Huangqin
MOL000552	5,2′-Dihydroxy-6,7,8-trimethoxyflavone	159029	344.34	31.71	0.35	Huangqin
MOL000073	Ent-Epicatechin	182232	290.29	48.96	0.24	Huangqin
MOL000449	Stigmasterol	5280794	412.77	43.83	0.76	Huangqin
MOL001458	Coptisine	72322	320.34	30.67	0.86	Huangqin
MOL001490	Bis[(2S)-2-ethylhexyl] benzene-1,2-dicarboxylate	7057920	390.62	43.59	0.35	Huangqin
MOL001506	Supraene	638072	410.8	33.55	0.42	Huangqin
MOL002879	Diop	33934	390.62	43.59	0.39	Huangqin
MOL002897	Epiberberine	160876	336.39	43.09	0.78	Huangqin
MOL008206	Moslosooflavone	188316	298.31	44.09	0.25	Huangqin
MOL010415	11,13-Eicosadienoic acid, methyl ester	5365674	322.59	39.28	0.23	Huangqin
MOL012245	5,7,4′-trihydroxy-6-methoxyflavanone	26213330	302.3	36.63	0.27	Huangqin
MOL012246	5,7,4′-trihydroxy-8-methoxyflavanone	42608119	302.3	74.24	0.26	Huangqin
MOL012266	Rivularin	13889022	344.34	37.94	0.37	Huangqin
MOL001910	11alpha,12alpha-epoxy-3beta-23-dihydroxy-30-norolean-20-en-28,12beta-olide	N/A	470.71	64.77	0.38	Baishao
MOL001918	Paeoniflorgenone	70698143	318.35	87.59	0.37	Baishao
MOL001919	(3S,5R,8R,9R,10S,14S)-3,17-dihydroxy-4,4,8,10,14-pentamethyl-2,3,5,6,7,9-hexahydro-1H-cyclopenta[a]phenanthrene-15,16-dione	9841735	358.52	43.56	0.53	Baishao
MOL001921	Lactiflorin	14605198	462.49	49.12	0.8	Baishao
MOL001924	Paeoniflorin	442534	480.51	53.87	0.79	Baishao
MOL001925	Paeoniflorin_qt	11973336	318.35	68.18	0.4	Baishao
MOL001928	Albiflorin_qt	134761887	318.35	66.64	0.33	Baishao
MOL001930	Benzoylpaeoniflorin	21631106	584.62	31.27	0.75	Baishao
MOL000211	Mairin	64971	456.78	55.38	0.78	Baishao
MOL000422	Kaempferol	5280863	286.25	41.88	0.24	Baishao
MOL000492	(+)-catechin	9064	290.29	54.83	0.24	Baishao
MOL000358	Beta-sitosterol	222284	414.79	36.91	0.75	Huangqin and Baishao
MOL000359	Sitosterol	12303645	414.79	36.91	0.75	Huangqin and Baishao

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A Network Pharmacology Approach to Explore the Potential Mechanisms of Huangqin-Baishao Herb Pair in Treatment of Cancer

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