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. 2025 Feb 11;16:1546062. doi: 10.3389/fphar.2025.1546062

TABLE 7.

Type of bonding and amino acid residues of target proteins that interact with drug compounds.

S.No Receptors Compounds Binding affinity Bonding type Bond category Amino acid residues
1 PD-L1 THC −8.2 Hydrogen Conventional ASN131
Hydrophobic Alkyl ALA137, VAL29,LYS129, ALA132, LEU106
Pi-Alkyl LYS129
2 PD1 THC −6 Hydrogen Conventional ASP117
Hydrophobic Pi-Sigma ARG69
Pi-Alkyl PHE95
Alkyl PRO72
3 MMP9 THC −8.2 Hydrogen Conventional PRO430
Carbon GLU416
Hydrophobic Pi-Alkyl HIS401
4 IL-6 THC −6.8 Hydrophobic Alkyl ARG182, LEU178, LEU33, ILE36, LYS171
Pi-Alkyl LEU33, LEU178
5 TNF-a CBD −7.7 Hydrogen Conventional GLN102
6 AGEs THC −6.9 Hydrogen Conventional ARG69
Carbon GLY75
Hydrophobic Amide-Pi Stacked VAL95
Alkyl ARG94, PRO101, PRO104, ARG96
Pi-Alkyl ARG96
CBD −6.4 Hydrophobic Alkyl ILE100, PRO101, ARG94, ARG96
Pi-Alkyl ARG96
7 AKT1 THC −9.6 Hydrophobic Pi-Pi Stacked TYR272
Alkyl LYS268, VAL270, LEU264
Pi-Alkyl TRP80