Compile Data Set for Download or QSAR

Found 36 hits of Enzyme Inhibition Constant Data   

TargetPotassium voltage-gated channel subfamily H member 2(Homo sapiens (Human))
Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50194575(CHEMBL219162 | N'-(3-methoxy-2-phenyl-quinoline-4-...)copy SMILEScopy InChI
Affinity DataKi: >8.00E+3nMAssay Description:Inhibition of hERGMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66MK3PubMed
TargetNeuromedin-K receptor(Homo sapiens (Human))
Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50194591(3-methoxy-N',N',2-triphenylquinoline-4-carbohydraz...)copy SMILEScopy InChI
Affinity DataIC50: 0.850nMAssay Description:Displacement of [125I]neurokinin B from cloned human NK3 receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66MK3PubMed
TargetNeuromedin-K receptor(Homo sapiens (Human))
Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50051293((S)-(-)-N-(R-ethylbenzyl)-3-hydroxy-2-phenylquinol...)copy SMILEScopy InChI
Affinity DataIC50: 2.40nMAssay Description:Displacement of [125I]neurokinin B from cloned human NK3 receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66MK3PubMed
TargetNeuromedin-K receptor(Homo sapiens (Human))
Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50194588(CHEMBL218421 | N'-(8-fluoro-3-methoxy-2-phenyl-qui...)copy SMILEScopy InChI
Affinity DataIC50: 4.10nMAssay Description:Displacement of [125I]neurokinin B from cloned human NK3 receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66MK3PubMed
TargetNeuromedin-K receptor(Homo sapiens (Human))
Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50194575(CHEMBL219162 | N'-(3-methoxy-2-phenyl-quinoline-4-...)copy SMILEScopy InChI
Affinity DataIC50: 4.5nMAssay Description:Binding affinity to gerbil NK3 receptorMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66MK3PubMed
TargetNeuromedin-K receptor(Homo sapiens (Human))
Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50194577(CHEMBL221016 | N-(3-fluoro-phenyl)-N'-(3-methoxy-2...)copy SMILEScopy InChI
Affinity DataIC50: 7.40nMAssay Description:Displacement of [125I]neurokinin B from cloned human NK3 receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66MK3PubMed
TargetNeuromedin-K receptor(Homo sapiens (Human))
Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50194585(CHEMBL221443 | N'-(3-methyl-2-phenyl-quinoline-4-c...)copy SMILEScopy InChI
Affinity DataIC50: 8.40nMAssay Description:Displacement of [125I]neurokinin B from cloned human NK3 receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66MK3PubMed
TargetNeuromedin-K receptor(Homo sapiens (Human))
Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50194575(CHEMBL219162 | N'-(3-methoxy-2-phenyl-quinoline-4-...)copy SMILEScopy InChI
Affinity DataIC50: 8.80nMAssay Description:Displacement of [125I]neurokinin B from cloned human NK3 receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66MK3PubMed
TargetNeuromedin-K receptor(Homo sapiens (Human))
Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50194587(CHEMBL374067 | N'-(3-amino-2-phenyl-quinoline-4-ca...)copy SMILEScopy InChI
Affinity DataIC50: 10nMAssay Description:Displacement of [125I]neurokinin B from cloned human NK3 receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66MK3PubMed
TargetNeuromedin-K receptor(Homo sapiens (Human))
Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50194582(CHEMBL375538 | N'-(5-fluoro-3-methoxy-2-phenyl-qui...)copy SMILEScopy InChI
Affinity DataIC50: 11nMAssay Description:Displacement of [125I]neurokinin B from cloned human NK3 receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66MK3PubMed
TargetNeuromedin-K receptor(Homo sapiens (Human))
Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50194576(CHEMBL221197 | N'-ethyl-3-methoxy-N',2-diphenylqui...)copy SMILEScopy InChI
Affinity DataIC50: 16nMAssay Description:Displacement of [125I]neurokinin B from cloned human NK3 receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66MK3PubMed
TargetNeuromedin-K receptor(Homo sapiens (Human))
Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50194598(CHEMBL375640 | N'-[2-(3-fluoro-phenyl)-3-methoxy-q...)copy SMILEScopy InChI
Affinity DataIC50: 22nMAssay Description:Displacement of [125I]neurokinin B from cloned human NK3 receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66MK3PubMed
TargetNeuromedin-K receptor(Homo sapiens (Human))
Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50194579(3-methoxy-N',2-diphenyl-N'-propionylquinoline-4-ca...)copy SMILEScopy InChI
Affinity DataIC50: 22nMAssay Description:Displacement of [125I]neurokinin B from cloned human NK3 receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66MK3PubMed
TargetNeuromedin-K receptor(Homo sapiens (Human))
Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50194592(CHEMBL221307 | N'-[2-(4-fluoro-phenyl)-3-methoxy-q...)copy SMILEScopy InChI
Affinity DataIC50: 24nMAssay Description:Displacement of [125I]neurokinin B from cloned human NK3 receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66MK3PubMed
TargetNeuromedin-K receptor(Homo sapiens (Human))
Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50194590(CHEMBL221145 | N'-(7-fluoro-3-methoxy-2-phenyl-qui...)copy SMILEScopy InChI
Affinity DataIC50: 28nMAssay Description:Displacement of [125I]neurokinin B from cloned human NK3 receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66MK3PubMed
TargetNeuromedin-K receptor(Homo sapiens (Human))
Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50194575(CHEMBL219162 | N'-(3-methoxy-2-phenyl-quinoline-4-...)copy SMILEScopy InChI
Affinity DataIC50: 28nMAssay Description:Activity at human NK3 receptor assessed as inhibition of senktide-stimulated inositol phosphate generation in CHO cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66MK3PubMed
TargetNeuromedin-K receptor(Homo sapiens (Human))
Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50194575(CHEMBL219162 | N'-(3-methoxy-2-phenyl-quinoline-4-...)copy SMILEScopy InChI
Affinity DataIC50: 30nMAssay Description:Activity at human NK3 receptor assessed as inhibition of senktide-induced calcium mobilization in CHO cells at 2.8 uMMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66MK3PubMed
TargetNeuromedin-K receptor(Homo sapiens (Human))
Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50194593(3-methoxy-N',2-diphenylquinoline-4-carbohydrazide ...)copy SMILEScopy InChI
Affinity DataIC50: 32nMAssay Description:Displacement of [125I]neurokinin B from cloned human NK3 receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66MK3PubMed
TargetNeuromedin-K receptor(Homo sapiens (Human))
Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50194584(CHEMBL221070 | N-(4-fluoro-phenyl)-N'-(3-methoxy-2...)copy SMILEScopy InChI
Affinity DataIC50: 33nMAssay Description:Displacement of [125I]neurokinin B from cloned human NK3 receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66MK3PubMed
TargetNeuromedin-K receptor(Homo sapiens (Human))
Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50194580(CHEMBL221094 | N'-(6-fluoro-3-methoxy-2-phenyl-qui...)copy SMILEScopy InChI
Affinity DataIC50: 38nMAssay Description:Displacement of [125I]neurokinin B from cloned human NK3 receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66MK3PubMed
TargetNeuromedin-K receptor(Homo sapiens (Human))
Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50194578(CHEMBL218694 | N'-(3-hydroxy-2-phenyl-quinoline-4-...)copy SMILEScopy InChI
Affinity DataIC50: 39nMAssay Description:Displacement of [125I]neurokinin B from cloned human NK3 receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66MK3PubMed
TargetNeuromedin-K receptor(Homo sapiens (Human))
Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50194595(CHEMBL218695 | N-(2-fluoro-phenyl)-N'-(3-methoxy-2...)copy SMILEScopy InChI
Affinity DataIC50: 53nMAssay Description:Displacement of [125I]neurokinin B from cloned human NK3 receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66MK3PubMed
TargetNeuromedin-K receptor(Homo sapiens (Human))
Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50194596(3-methoxy-N'-methyl-N',2-diphenylquinoline-4-carbo...)copy SMILEScopy InChI
Affinity DataIC50: 57nMAssay Description:Displacement of [125I]neurokinin B from cloned human NK3 receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66MK3PubMed
TargetNeuromedin-K receptor(Homo sapiens (Human))
Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50194597(CHEMBL220581 | N'-(3-methoxy-2-phenyl-quinoline-4-...)copy SMILEScopy InChI
Affinity DataIC50: 60nMAssay Description:Displacement of [125I]neurokinin B from cloned human NK3 receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66MK3PubMed
TargetNeuromedin-K receptor(Rattus norvegicus)
Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50194575(CHEMBL219162 | N'-(3-methoxy-2-phenyl-quinoline-4-...)copy SMILEScopy InChI
Affinity DataIC50: 66nMAssay Description:Binding affinity to rat NK3 receptorMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66MK3PubMed
TargetNeuromedin-K receptor(Homo sapiens (Human))
Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50194599(CHEMBL220857 | N-phenyl-N'-(2-phenyl-quinoline-4-c...)copy SMILEScopy InChI
Affinity DataIC50: 91nMAssay Description:Displacement of [125I]neurokinin B from cloned human NK3 receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66MK3PubMed
TargetNeuromedin-K receptor(Homo sapiens (Human))
Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50194583(CHEMBL221493 | N'-[2-(2-fluoro-phenyl)-3-methoxy-q...)copy SMILEScopy InChI
Affinity DataIC50: 110nMAssay Description:Displacement of [125I]neurokinin B from cloned human NK3 receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66MK3PubMed
TargetNeuromedin-K receptor(Homo sapiens (Human))
Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50194589(CHEMBL375879 | N'-(3-methoxy-2-phenyl-quinoline-4-...)copy SMILEScopy InChI
Affinity DataIC50: 190nMAssay Description:Displacement of [125I]neurokinin B from cloned human NK3 receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66MK3PubMed
TargetNeuromedin-K receptor(Homo sapiens (Human))
Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50194586(CHEMBL220907 | N'-acetyl-3-methoxy-N',2-diphenylqu...)copy SMILEScopy InChI
Affinity DataIC50: 210nMAssay Description:Displacement of [125I]neurokinin B from cloned human NK3 receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66MK3PubMed
TargetNeuromedin-K receptor(Homo sapiens (Human))
Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50194594(CHEMBL218422 | N'-(8-bromo-3-methoxy-2-phenyl-quin...)copy SMILEScopy InChI
Affinity DataIC50: 430nMAssay Description:Displacement of [125I]neurokinin B from cloned human NK3 receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66MK3PubMed
TargetSubstance-P receptor(Homo sapiens (Human))
Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50194575(CHEMBL219162 | N'-(3-methoxy-2-phenyl-quinoline-4-...)copy SMILEScopy InChI
Affinity DataIC50: 1.00E+3nMAssay Description:Inhibition of human NK1 receptorMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66MK3PubMed
TargetSubstance-K receptor(Homo sapiens (Human))
Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50194575(CHEMBL219162 | N'-(3-methoxy-2-phenyl-quinoline-4-...)copy SMILEScopy InChI
Affinity DataIC50: 1.00E+3nMAssay Description:Inhibition of human NK2 receptorMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66MK3PubMed
TargetCytochrome P450 3A4(Homo sapiens (Human))
Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50194575(CHEMBL219162 | N'-(3-methoxy-2-phenyl-quinoline-4-...)copy SMILEScopy InChI
Affinity DataIC50: 1.20E+4nMAssay Description:Inhibition of CYP3A4 in human liver microsomesMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66MK3PubMed
TargetCytochrome P450 2D6(Homo sapiens (Human))
Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50194575(CHEMBL219162 | N'-(3-methoxy-2-phenyl-quinoline-4-...)copy SMILEScopy InChI
Affinity DataIC50: 3.00E+4nMAssay Description:Inhibition of CYP2D6 in human liver microsomesMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66MK3PubMed
TargetCytochrome P450 2C9(Homo sapiens (Human))
Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50194575(CHEMBL219162 | N'-(3-methoxy-2-phenyl-quinoline-4-...)copy SMILEScopy InChI
Affinity DataIC50: 3.00E+4nMAssay Description:Inhibition of CYP2C9 in human liver microsomesMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66MK3PubMed
TargetNeuromedin-K receptor(Homo sapiens (Human))
Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50194558(CHEMBL373569 | ELEDOISIN)copy SMILEScopy InChI
Affinity DataEC50:  5.70nMAssay Description:Activity at human NK3 receptor assessed as stimulation of inositol phosphate generation in CHO cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2W66MK3PubMed
* indicates data uncertainty>20%