BDBM85114 AANAT bisubstrate analog, 7

SMILES CC(C)(COP(O)(=O)OP(O)(=O)OC[C@H]1OC([C@@H](O)[C@@H]1OP(O)(O)=O)n1cnc2c(N)ncnc12)[C@@H](O)C(=O)NCCC(=O)NCCSCCC[NH2+]CCc1c[nH]c2ccccc12

InChI Key InChIKey=XZYAFEJEMIMQGA-UHFFFAOYSA-O

Data  1 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 85114   

TargetSerotonin N-acetyltransferase(Human)
Johns Hopkins University School of Medicine

LigandPNGBDBM85114(AANAT bisubstrate analog, 7)
Affinity DataKi:  5.84E+3nM ΔG°:  -7.25kcal/molepH: 6.8 T: 2°CAssay Description:AANAT activity was measured using a spectrophotometric assay in which the enzymatic product CoASH concentration were determined indirectly by monitor...More data for this Ligand-Target Pair
In DepthDetails Article
PubMed