BDBM260858 US9540323, 45::US9540323, example 45

SMILES CCC1(CC)CN(c2c1c(ccc2O)C#N)c1ccccc1NC(=O)Nc1ccc(cc1)C1CCN(CC(C)(C)C)CC1

InChI Key InChIKey=VVYRSQTWSQLONC-UHFFFAOYSA-N

Data  1 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 260858   

TargetP2Y purinoceptor 1(Human)
Bristol-Myers Squibb

US Patent
LigandPNGBDBM260858(US9540323, 45 | US9540323, example 45)
Affinity DataKi:  6.70nM ΔG°:  -11.1kcal/molepH: 7.4 T: 2°CAssay Description:A SPA membrane binding assay was used to identify inhibitors of [33P] 2MeS-ADP binding to cloned human P2Y1 receptors (The P2Y1 receptor membranes we...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/16/2018
Entry Details
US Patent