Network Pharmacology Reveals the Molecular Mechanism of Cuyuxunxi Prescription in Promoting Wound Healing in Patients with Anal Fistula

Table 1

The active compounds in the five main herbal medicines of Cuyuxunxi prescription.

Herbs	Mol ID	Molecule name	MW		OB (%)	Caco‐2	BBB	DL
Sophorae Flavescentis Radix	MOL001040	(2R)-5,7-Dihydroxy-2-(4-hydroxyphenyl)chroman-4-one	272.27	2.3	42.36	0.38	−0.48	0.21
	MOL001484	Inermine	284.28	2.44	75.18	0.89	0.4	0.54
	MOL003627	Sophocarpine	246.39	1.39	64.26	0.99	1	0.25
	MOL003648	Inermin	284.28	2.44	65.83	0.91	0.36	0.54
	MOL003673	Wighteone	338.38	3.92	42.8	0.64	−0.16	0.36
	MOL003676	Sophoramine	244.37	1.15	42.16	1.43	1.53	0.25
	MOL003680	Sophoridine	248.41	1.42	60.07	1.13	1.14	0.25
	MOL000392	Formononetin	268.28	2.58	69.67	0.78	0.02	0.21
	MOL004580	cis-Dihydroquercetin	304.27	1.49	66.44	−0.34	−1.11	0.27
	MOL005100	5,7-Dihydroxy-2-(3-hydroxy-4-methoxyphenyl)chroman-4-one	302.3	2.28	47.74	0.28	−0.3	0.27
	MOL005944	Matrine	248.41	1.42	63.77	1.39	1.52	0.25
	MOL006562	(+)-7,11-Dehydromatrine, (leontalbinine)	246.39	1.42	62.08	1.06	1.12	0.25
	MOL006564	(+)-Allomatrine	248.41	1.42	58.87	1.08	1.13	0.25
	MOL006565	AIDS211310	248.41	1.42	68.68	1.15	1.38	0.25
	MOL006566	(+)-Lehmannine	246.39	1.11	58.34	1.21	1.36	0.25
	MOL006568	Isosophocarpine	246.39	1.39	61.57	1.39	1.45	0.25
	MOL006571	Anagyrine	244.37	1.15	62.01	1.16	1.13	0.24
	MOL006573	13,14-Dehydrosophoridine	246.39	1.39	65.34	1.06	1.11	0.25
	MOL006582	5α,9α-Dihydroxymatrine	280.41	−0.3	40.93	0.04	−0.43	0.32
	MOL006583	7,11-Dehydromatrine	246.39	1.42	44.43	1.11	1.13	0.25
	MOL006596	Glyceollin	338.38	2.85	97.27	0.53	−0.19	0.76
	MOL003347	Hyperforin	536.87	8.62	44.03	0.87	0.4	0.6
	MOL006604	(2S)-7-Hydroxy-2-(4-hydroxyphenyl)-5-methoxy-8-(3-methylbut-2-enyl)chroman-4-one	354.43	4.41	48.09	0.8	0	0.39
	MOL006613	Kushenin	286.3	2.39	47.62	0.71	0.35	0.38
	MOL006619	Kushenol J	580.59	−0.87	51.39	−2.2	−3.12	0.74
	MOL006620	Kushenol J_qt	286.3	2.27	50.86	0.24	−0.27	0.24
	MOL006622	Kushenol O	562.57	−0.56	42.41	−1.67	−2.25	0.76
	MOL006623	Kushenol T	442.55	4.46	51.28	−0.05	−0.95	0.64
	MOL006626	Leachianone G	356.4	3.89	60.97	0.33	−0.36	0.4
	MOL006627	Lehmanine	246.39	1.11	62.23	1.18	1.25	0.25
	MOL006628	(+)-Lupanine	248.41	1.42	52.71	1.16	1.19	0.24
	MOL006630	Norartocarpetin	286.25	2.07	54.93	0.14	−0.74	0.24
	MOL000456	Phaseolin	322.38	3.46	78.2	1.09	0.39	0.73
	MOL006649	Sophranol	264.41	0.67	55.42	0.6	0.68	0.28
	MOL006650	(−)-Maackiain-3-O-glucosyl-6′-O-malonate	532.49	0.7	48.69	−1.45	−2.14	0.52
	MOL006652	Trifolrhizin	462.44	0.95	48.53	−0.85	−1.65	0.74
	MOL000098	Quercetin	302.25	1.5	46.43	0.05	−0.77	0.28
Polygoni Cuspidati Rhizoma et Radix	MOL013288	Picralinal	366.45	1.8	58.01	0.23	−0.21	0.75
	MOL002259	Physcion diglucoside	608.6	−0.91	41.65	−2.64	−3.43	0.63
	MOL002268	Rhein	284.23	1.88	47.07	−0.2	−0.99	0.28
	MOL002280	Torachrysone-8-O-beta-D-(6′-oxayl)-glucoside	480.46	0.64	43.02	−1.23	−1.84	0.74
	MOL000492	(+)-Catechin	290.29	1.92	54.83	−0.03	−0.73	0.24
	MOL000098	Quercetin	302.25	1.5	46.43	0.05	−0.77	0.28
Angelicae Sinensis Radix	MOL000449	Stigmasterol	412.77	7.64	43.83	1.44	1	0.76
Galla Chinensis	MOL000569	Digallate	322.24	1.53	61.85	−0.76	−1.52	0.26
Taraxacum mongolicum	1	Calcium
	2	Choline
	3	Copper
	4	Inulin
	5	Iron
	6	Manganese
	7	Myristic acid
	8	Palmitic acid
	9	Potassium
	10	Quercetin
	11	Rutin
	12	Stearic acid
	13	Vitamin C
	14	Zinc

MW, molecular weight; , water partition coefficient; OB, human oral bioavailability; Caco-2, Caco-2 permeability; BBB, blood-brain barrier; DL, drug-likeness.