Network Pharmacology and Molecular Docking Study on the Potential Mechanism of Yi-Qi-Huo-Xue-Tong-Luo Formula in Treating Diabetic Peripheral Neuropathy

Table 1

Detailed information of the 86 active compounds from YQHXTLF.

Mol Id	Mol name	Structure	OB (%)	DL
MOL000358	Beta-sitosterol		36.91	0.75
MOL000449	Stigmasterol		43.83	0.76
MOL000392	Formononetin		69.67	0.21
MOL002959	3-Methoxydaidzein		48.57	0.24
MOL003629	Daidzein-4,7-diglucoside		47.27	0.67
MOL000211	Mairin		55.38	0.78
MOL000239	Jaranol		50.83	0.29
MOL000296	Hederagenin		36.91	0.75
MOL000033	(3S,8S,9S,10R,13R,14S,17R)-10,13-Dimethyl-17-[(2R,5S)-5-propan-2-yloctan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol		36.23	0.78
MOL000354	Isorhamnetin		49.6	0.31
MOL000371	3,9-Di-O-methylnissolin		53.74	0.48
MOL000378	7-O-Methylisomucronulatol		74.69	0.3
MOL000379	9,10-Dimethoxypterocarpane -3-O-β-D-glucoside		36.74	0.92
MOL000380	(6aR,11aR)-9,10-Dimethoxy-6a,11a-dihydro-6H-benzofurano[3,2-c]chromen-3-ol		64.26	0.42
MOL000387	Bifendate		31.1	0.67
MOL000417	Calycosin		47.75	0.24
MOL000422	Kaempferol		41.88	0.24
MOL000433	FA		68.96	0.71
MOL000439	Isomucronulatol-7,2-di-O-glucosiole		49.28	0.62
MOL000442	1,7-Dihydroxy-3,9-dimethoxy pterocarpene		39.05	0.48
MOL000098	Quercetin		46.43	0.28
MOL000461	3,7-Dihydroxy-6-methoxy-dihydroflavonol		43.8	0.26
MOL000468	8-O-Methylreyusin		70.32	0.27
MOL000469	3-Hydroxystigmast-5-en-7-one		40.93	0.78
MOL000470	8-C-α-L-Arabinosylluteolin		35.54	0.66
MOL000471	Aloe-emodin		83.38	0.24
MOL000483	(Z)-3-(4-Hydroxy-3-methoxy-phenyl)-N-[2-(4-hydroxyphenyl)ethyl]acrylamide		118.35	0.26
MOL000490	Petunidin		30.05	0.31
MOL000492	(+)-Catechin		54.83	0.24
MOL000493	Campesterol		37.58	0.71
MOL000497	Licochalcone a		40.79	0.29
MOL000500	Vestitol		74.66	0.21
MOL000501	Consume close grain		68.12	0.27
MOL000502	Cajinin		68.8	0.27
MOL000503	Medicagol		57.49	0.6
MOL000506	Lupinidine		61.89	0.21
MOL000507	Psi-baptigenin		70.12	0.31
MOL000006	Luteolin		36.16	0.25
MOL000359	Sitosterol		36.91	0.75
MOL005603	Diheptyl phthalate		42.26	0.31
MOL001454	Berberine		36.86	0.78
MOL001458	Coptisine		30.67	0.86
MOL001460	Cryptopine		78.74	0.72
MOL001461	Dihydrochelerythrine		32.73	0.81
MOL001463	Dihydrosanguinarine		59.31	0.86
MOL001474	Sanguinarine		37.81	0.86
MOL000217	(S)-Scoulerine		32.28	0.54
MOL002670	Cavidine		35.64	0.81
MOL002903	(R)-Canadine		55.37	0.77
MOL004071	Hyndarine		36.91	0.75
MOL004190	(-)-Alpha-N-methylcanadine		73.94	0.64
MOL004191	Capaurine		45.06	0.8
MOL004193	Clarkeanidine		62.91	0.69
MOL004195	CORYDALINE		86.65	0.54
MOL004196	Corydalmine		65.84	0.68
MOL004197	Corydine		52.5	0.59
MOL004198	18797-79-0		37.16	0.55
MOL004199	Corynoloxine		46.06	0.85
MOL004200	Methyl-[2-(3,4,6,7-tetramethoxy-1-phenanthryl)ethyl]amine		38.12	0.6
MOL004202	Dehydrocavidine		61.15	0.44
MOL004203	Dehydrocorybulbine		38.99	0.81
MOL004204	Dehydrocorydaline		46.97	0.63
MOL004205	Dehydrocorydalmine		41.98	0.68
MOL004208	Demethylcorydalmatine		43.9	0.59
MOL004209	13-Methyldehydrocorydalmine		38.99	0.54
MOL004210	(1S,8R)-6,7-Dimethoxy-2-methylspiro[3,4-dihydroisoquinoline-1,7-6,8-dihydrocyclopenta[g][1,3]benzodioxole]-8-ol		35.94	0.63
MOL004763	Izoteolin		43.95	0.72
MOL004214	Isocorybulbine		39.53	0.51
MOL004215	Leonticine		40.18	0.66
MOL004216	13-Methylpalmatrubine		45.79	0.26
MOL004220	N-Methyllaurotetanine		40.97	0.63
MOL004221	Norglaucing		41.62	0.56
MOL004224	Pontevedrine		30.35	0.56
MOL004225	Pseudocoptisine		30.28	0.71
MOL004226	24240-05-9		38.97	0.86
MOL004228	Saulatine		53.75	0.83
MOL004230	Stylopine		42.74	0.79
MOL004231	Tetrahydrocorysamine		48.25	0.85
MOL004232	Tetrahydroprotopapaverine		34.17	0.86
MOL004233	ST057701		36.86	0.78
MOL004234	2,3,9,10-Tetramethoxy-13-methyl-5,6-dihydroisoquinolino[2,1-b]isoquinolin-8-one		30.67	0.86
MOL000785	Palmatine		78.74	0.72
MOL000787	Fumarine		32.73	0.81
MOL000790	Isocorypalmine		59.31	0.86
MOL000791	Bicuculline		37.81	0.86
MOL000793	C09367		32.28	0.54

Mol Id: molecule Id; Mol name: molecule name; OB: oral bioavailability; DL: drug-like.