Title : Generation of pharmacophore and atom based 3D-QSAR model of novel isoquinolin-1-one and quinazolin-4-one-type inhibitors of TNFα.

Pub. Date : 2012 May

PMID : 22530913






2 Functional Relationships(s)
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Compound Name
Protein Name
Organism
1 Docking study revealed the important amino acid residues (His 15, Tyr 59, Tyr 151, Gly 121 and Gly 122) in the active site of TNFalpha that are involved in binding of the active ligand. Glycine tumor necrosis factor Homo sapiens
2 Docking study revealed the important amino acid residues (His 15, Tyr 59, Tyr 151, Gly 121 and Gly 122) in the active site of TNFalpha that are involved in binding of the active ligand. Glycine tumor necrosis factor Homo sapiens