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. 2021 Aug 5;41(8):BSR20204211. doi: 10.1042/BSR20204211

Table 4. Results of the molecular docking of the six core genes with compounds of SXXTDP.

Number Core genes PDB ID Compound Docking affinity (kcal/mol)
1 MAPK1 5lck Quercetin -8.4
2 MAPK14 2qd9 Myricanone -7.2
3 MMP9 2ow1 Quercetin -7.9
4 NFKBIA 6y1j Quercetin -7.7
5 CASP8 3kjq Quercetin -7.7
6 PTGS2 5f19 Perlolyrine -8.0
Myricanone -7.6
Mandenol -6.1
Kaempferol -9.3
(+)-catechin -8.5
Wallichilide -6.2