BDBM50290461 CHEMBL65468::potassium 3,5-di(trifluoromethyl)benzyl 2-[4-hydroxy-1-{1-[4-(1H-1,2,3,4-tetraazol-5-yl)butyl]-1H-3-indolylcarbonyl}-(2R,4S)-tetrahydro-1H-2-pyrrolylcarboxamido]-3-(1H-3-indolyl)-(2S)-propanoate

SMILES OC1CC(N(C1)C(=O)c1cn(CCCCc2nn[n-]n2)c2ccccc12)C(=O)NC(Cc1c[nH]c2ccccc12)C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F

InChI Key InChIKey=BALUIQVSZLKYRA-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 = 50290461   

TargetSubstance-K receptor(Rabbit)
TBA

Curated by ChEMBL
LigandPNGBDBM50290461(potassium 3,5-di(trifluoromethyl)benzyl 2-[4-hydro...)
Affinity DataKi:  5.20nMAssay 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

TargetNeuromedin-K receptor(Rat)
TBA

Curated by ChEMBL
LigandPNGBDBM50290461(potassium 3,5-di(trifluoromethyl)benzyl 2-[4-hydro...)
Affinity DataKi:  5.5nMAssay 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-P receptor(Human)
TBA

Curated by ChEMBL
LigandPNGBDBM50290461(potassium 3,5-di(trifluoromethyl)benzyl 2-[4-hydro...)
Affinity DataKi:  9nMAssay 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-P receptor(Human)
TBA

Curated by ChEMBL
LigandPNGBDBM50290461(potassium 3,5-di(trifluoromethyl)benzyl 2-[4-hydro...)
Affinity DataKi:  9nMAssay 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
LigandPNGBDBM50290461(potassium 3,5-di(trifluoromethyl)benzyl 2-[4-hydro...)
Affinity DataKi:  4.20E+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