BDBM121040 US8722896, (+/-)-2-Methyl-3-((2- methoxy)benzylamino)-N-(9- chloro-3,4-dihydro-2H-1,5- benzodioxepin-7-ylmethyl)-N- isobutylpropanamide::US8722896, (-)-(2R)-2-Methyl-3-((2- methoxy)benzylamino)-N-(9- chloro-3,4-dihydro-2H-1,5- benzodioxepin-7-ylmethyl)-N- isobutylpropanamide

SMILES COc1ccccc1CNCC(C)C(=O)N(CC(C)C)Cc1cc(Cl)c2OCCCOc2c1

InChI Key InChIKey=LLALWBCUMKNDNJ-UHFFFAOYSA-N

Data  4 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 121040   

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

US Patent
LigandPNGBDBM121040(US8722896, (+/-)-2-Methyl-3-((2- methoxy)benzylami...)
Affinity DataKi:  0.720nM 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 2(Chinese hamster)
The Regents of The University of California

US Patent
LigandPNGBDBM121040(US8722896, (+/-)-2-Methyl-3-((2- methoxy)benzylami...)
Affinity DataKi:  1.35nM ΔG°:  -12.6kcal/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(Chinese hamster)
The Regents of The University of California

US Patent
LigandPNGBDBM121040(US8722896, (+/-)-2-Methyl-3-((2- methoxy)benzylami...)
Affinity DataKi:  8.76nM ΔG°:  -11.4kcal/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(Chinese hamster)
The Regents of The University of California

US Patent
LigandPNGBDBM121040(US8722896, (+/-)-2-Methyl-3-((2- methoxy)benzylami...)
Affinity DataKi:  25.2nM ΔG°:  -10.8kcal/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