BDBM260841 US9540323, 27::US9540323, example 27

SMILES CCc1ccc(NC(=O)Nc2ccccc2N2CC(CC)(CC)c3c2c(O)ccc3F)cc1

InChI Key InChIKey=MTGWMQMKLUODDL-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
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 260841   

TargetP2Y purinoceptor 1(Human)
Bristol-Myers Squibb

US Patent
LigandPNGBDBM260841(US9540323, 27 | US9540323, example 27)
Affinity DataKi:  3.10nM ΔG°:  -11.6kcal/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