BDBM50030140 CHEMBL281804::[(S)-1-(3,5-Dimethyl-benzyloxycarbonyl)-2-(1H-indol-3-yl)-ethyl]-trimethyl-ammonium::[1-(3,5-Dimethyl-benzyloxycarbonyl)-2-(1H-indol-3-yl)-ethyl]-trimethyl-ammonium

SMILES Cc1cc(C)cc(COC(=O)[C@H](Cc2c[nH]c3ccccc23)[N+](C)(C)C)c1

InChI Key InChIKey=QEQMAEXQVGXASS-QFIPXVFZSA-N

Data  4 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 4 hits for monomerid = 50030140   

TargetSubstance-P receptor(Human)
Merck Sharp and Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50030140(CHEMBL281804 | [(S)-1-(3,5-Dimethyl-benzyloxycarbo...)
Affinity DataIC50:  125nMAssay Description:Binding affinity towards cloned neurokinin 1 receptor, based on the displacement of [125I]-labeled substance PMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetSubstance-P receptor(Human)
Merck Sharp and Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50030140(CHEMBL281804 | [(S)-1-(3,5-Dimethyl-benzyloxycarbo...)
Affinity DataIC50:  125nMAssay Description:Tested against cloned human NK1 receptor by displacement of 125 I -labeled substance P expressed in CHO cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetSubstance-K receptor(Human)
Merck Sharp and Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50030140(CHEMBL281804 | [(S)-1-(3,5-Dimethyl-benzyloxycarbo...)
Affinity DataIC50: >5.00E+3nMAssay Description:Binding affinity to the NK2 receptor assayed by displacement of [125I]-Neurokinin AMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetNeuromedin-K receptor(Human)
Merck Sharp and Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50030140(CHEMBL281804 | [(S)-1-(3,5-Dimethyl-benzyloxycarbo...)
Affinity DataIC50: >5.00E+3nMAssay Description:Affinity to NK3 receptors assayed by displacement of [125I]-Bolton-Hunter labeled eledoisin radioligandMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed