BDBM121116 US8722896, (-)-(3R)-N-(9-chloro-3,4- dihydro-2H-1,5-benzodioxepin- 7-ylmethyl)-N-isobutyl-1-[(2- methoxypyridin-3- ylmethyl)pyrrolidine-3- carboxamide

SMILES COc1ncccc1CN1CC[C@H](C1)C(=O)N(CC(C)C)Cc1cc(Cl)c2OCCCOc2c1

InChI Key InChIKey=LZHHPZAUVGQCSX-OAQYLSRUSA-N

Data  3 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 3 hits for monomerid = 121116   

TargetProkineticin receptor 2(Cricetulus griseus (Chinese hamster))
The Regents of The University of California

US Patent
LigandPNGBDBM121116(US8722896, (-)-(3R)-N-(9-chloro-3,4- dihydro-2H-1,...)
Affinity DataKi:  0.710nM ΔG°:  -13.0kcal/moleT: 2°CAssay Description:An aequorin-based luminescent assay for calcium mobilization was used to measure mobilization of intracellular Ca2+ (Bullock et al., Mol Pharmacol 65...More data for this Ligand-Target Pair
In DepthDetails US Patent
TargetProkineticin receptor 1(Cricetulus griseus (Chinese hamster))
The Regents of The University of California

US Patent
LigandPNGBDBM121116(US8722896, (-)-(3R)-N-(9-chloro-3,4- dihydro-2H-1,...)
Affinity DataKi:  2.82nM ΔG°:  -12.1kcal/moleT: 2°CAssay Description:An aequorin-based luminescent assay for calcium mobilization was used to measure mobilization of intracellular Ca2+ (Bullock et al., Mol Pharmacol 65...More data for this Ligand-Target Pair
In DepthDetails US Patent
TargetProkineticin receptor 1(Cricetulus griseus (Chinese hamster))
The Regents of The University of California

US Patent
LigandPNGBDBM121116(US8722896, (-)-(3R)-N-(9-chloro-3,4- dihydro-2H-1,...)
Affinity DataKi:  5.34nM ΔG°:  -11.7kcal/moleT: 2°CAssay Description:An aequorin-based luminescent assay for calcium mobilization was used to measure mobilization of intracellular Ca2+ (Bullock et al., Mol Pharmacol 65...More data for this Ligand-Target Pair
In DepthDetails US Patent