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5-Amino-1MQ was developed as a selective NNMT inhibitor to help researchers better understand the biological significance of NNMT activity

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Molecular Docking The 3D structure of THC (SDF format) was obtained from PubChem ( while receptor protein structures (PDB format) were downloaded from RCSB PDB ( Using AutoDock, we prepared the receptor by removing water molecules and adding hydrogens, converted THC to PDB format using OpenBabel (with added hydrogens), and performed docking with AutoGrid to generate 3D scoring grids covering active sites, followed by binding energy and hydrogen bond calculation with AutoDock

evaluated the effectiveness of capmatinib and the PD-1 antibody, either singly or together, in treating subcutaneously transplanted hepatocellular carcinoma in HCA-1 cell mouse models [137]