BDBM388478 US9944618, Compound ID No. 12

SMILES CNC[C@@H]([C@H](O)c1ccncc1)c1ccc2ccccc2c1

InChI Key InChIKey=ZCQPZBAAOWWMGM-RTBURBONSA-N

Data  3 KI  3 IC50

  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 = 388478   

TargetCytochrome P450 2D6(Homo sapiens (Human))
Mayo Foundation

US Patent
LigandPNGBDBM388478(US9944618, Compound ID No. 12)
Affinity DataIC50:  880nMAssay Description:Cytochrome P450 3A4 and 2D6:Recombinant enzymes, 3A4 and 2D6, generated using the ABL yeast expression system were used. For CYP3A4, the enzyme amou...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails US Patent