| Compound | BA | H-Bond | Π-Bond | VdW Interactions | Others |
| Nrf2 | 9-Oxabicyclo[3.3.1]nonane-2,6-diol | −4.5 | Arg501 | Lys500, Arg501, Ala495 | Pro453, Gln496, Asn497, Arg499 | Cys498a | 1,2,3-Benzenetriol | −4.3 | His437 | Val454 | Glu435, Leu438, Thr439, Glu442, Pro453, Glu455 | Arg433a | Glibenclamide | −7.2 | Asn505, Arg501b | Lys500, Leu503, Pro453, Val454 | Glu435, Leu438, Glu442, Ala445, Lys446, Ile450, Phe452, Glu455, Val507 | — | Metformin | −4.2 | Glu435, His437 | — | Arg433, Leu438, Thr439, Pro453, Val454, Glu455, Arg501, Leu503, Asn505 | Glu442c |
| IL-6 | 9-Oxabicyclo[3.3.1]nonane-2,6-diol | −4.7 | Glu99, Asn144 | Val96, Pro141 | Lue92, Glu95, Pro139, Leu148 | — | 1,2,3-Benzenetriol | −5.3 | Leu39, Ser108 | Leu39, Leu101, Ala112 | Glu42, Thr43, Arg104, Thr163, Leu167 | — | Glibenclamide | −7.6 | Thr43, Arg104, Gln156 | Leu39, Tyr100, Leu101, Ala112 | Glu42, Lys46, Asn103, Ser107, Gln152, Gln159, Asp160, Thr163, Leu167 | — | Metformin | −4.6 | Leu39, Glu42b, Thr43b, Arg104 | — | Arg40, Leu101, Ser107, Ser108, Ala112, Thr163, Leu167 | Glu42d |
| TNF-α | 9-Oxabicyclo[3.3.1]nonane-2,6-diol | −5.0 | Ala145, Glu146, Ser147b | Val17, Ala18, Pro20, Val150 | Asp143, Phe144, Gly148, Gln149 | — | 1,2,3-Benzenetriol | −5.6 | Ala18, Gly148 | Ala18, Pro20, Val150 | Val17, Phe144, Ala145, Ser147, Gln149, Tyr151 | Val150a, Glu146a | Glibenclamide | −6.4 | Glu146, Gly148, Gln149, Val150 | Val17, Pro20 | Ala18, Leu29, Arg32, Ala33, Asn34, Phe144, Ala145, Ser147 | — | Metformin | −4.3 | Ala18, Asn34, Ser147b, Gly148 | — | Val17, Pro20, Leu29, Phe144, Gln149, Val150 | — |
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