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Evidence-Based Complementary and Alternative Medicine
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Evidence-Based Complementary and Alternative Medicine
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2021
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Article
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Tab 7
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Research Article
Molecular Targets and Mechanisms of
Scutellariae radix
-
Coptidis rhizoma
Drug Pair for the Treatment of Ulcerative Colitis Based on Network Pharmacology and Molecular Docking
Table 7
Binding energy between key ingredients and target proteins.
Key ingredients
Binding energy (kcal/mol)
PTGS2
CASP3
TP53
IL-6
TNF
AKT1
Quercetin
−2.25
−1.94
−1.74
−1.60
−1.73
−2.90
Wogonin
−2.88
−2.57
−3.22
−1.72
−3.10
−2.44
Baicalein
−4.78
−2.33
−2.4
−2.16
−3.38
−2.53
Acacetin
−4.66
−2.59
−2.74
−2.46
−2.78
−2.46
Oroxylin A
−2.95
−2.54
−3.09
−2.11
−2.94
−2.51
Beta-sitosterol
−2.34
−2.23
−1.95
−1.49
−2.80
−3.16