BDBM50290462 CHEMBL305119::potassium 2N-[1-benzyl(methyl)carbamoyl-2-(2-naphthyl)-(1S)-ethyl]-4-hydroxy-1-{1-[4-(1H-1,2,3,4-tetraazol-5-yl)butyl]-1H-3-indolylcarbonyl}-(2R,4S)-tetrahydro-1H-2-pyrrolecarboxamide

SMILES CN(Cc1ccccc1)C(=O)C(Cc1ccc2ccccc2c1)NC(=O)C1CC(O)CN1C(=O)c1cn(CCCCc2nn[n-]n2)c2ccccc12

InChI Key InChIKey=UGMIRFUUVLTOEI-UHFFFAOYSA-M

Data  5 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 5 hits for monomerid = 50290462   

TargetSubstance-P receptor(Human)
TBA

Curated by ChEMBL
LigandPNGBDBM50290462(potassium 2N-[1-benzyl(methyl)carbamoyl-2-(2-napht...)
Affinity DataKi:  1.5nMAssay Description:Binding affinity for NK-1 receptor was determined in a radioligand binding assay using IM9 human lymphoblastoma cell line.More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/22/2010
Entry Details Article

TargetNeuromedin-K receptor(Rat)
TBA

Curated by ChEMBL
LigandPNGBDBM50290462(potassium 2N-[1-benzyl(methyl)carbamoyl-2-(2-napht...)
Affinity DataKi:  5nMAssay Description:Binding affinity for NK-3 receptor was determined in vitro using isolated rat portal vein.More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/22/2010
Entry Details Article

TargetSubstance-K receptor(Rabbit)
TBA

Curated by ChEMBL
LigandPNGBDBM50290462(potassium 2N-[1-benzyl(methyl)carbamoyl-2-(2-napht...)
Affinity DataKi:  5.60nMAssay Description:Binding affinity for NK-2 receptor was determined in vitro using isolated rabbit pulmonary artery.More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/22/2010
Entry Details Article

TargetSubstance-P receptor(Human)
TBA

Curated by ChEMBL
LigandPNGBDBM50290462(potassium 2N-[1-benzyl(methyl)carbamoyl-2-(2-napht...)
Affinity DataKi:  9.60nMAssay Description:Binding affinity for NK-1 receptor was determined in vitro using isolated rabbit vena cava.More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/22/2010
Entry Details Article

TargetSubstance-K receptor(Human)
TBA

Curated by ChEMBL
LigandPNGBDBM50290462(potassium 2N-[1-benzyl(methyl)carbamoyl-2-(2-napht...)
Affinity DataKi:  2.40E+3nMAssay Description:Binding affinity for NK-2 receptor was determined in a radioligand binding assay using chinese hamster ovary cells.More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/22/2010
Entry Details Article