Table 4.
PROTEIN TARGETS | AFFINITY (kcal/mol) | HYDROGEN BONDS | HYDROPHOBIC INTERACTING RESIDUES |
---|---|---|---|
ACE2 | −6.2 | Glu 208 | Gln 102, Tyr 196, Gln 98, Leu 95, Pro 565, Asp 206, Ala 396 |
α7 nAChR | −6.2 | Ser 77, Asp 87 | Trp 145, Ile 80, Val 85, Tyr 116 |
α1D-AR | −6.4 | Asp 80, Cys 150 | Lys 289, Phe 288, Asp 80, Trp 76, Ala 77, Phe 292, Ser 283 |
TOP 3β | −6.1 | Asp 185, Phe 214 | Arg 181, Gly 189, Gln 182, Ala 512, Gln 218, Arg 524, His 517 |