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Compile Data Set for Download or QSAR
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
(change energy unit to
kcal/mol
)
Found
25
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Target
Extracellular calcium-sensing receptor
(Homo sapiens (Human))
Glaxosmithkline
Curated by
ChEMBL
Ligand
BDBM50161093
((R)-2-chloro-6-(2-hydroxy-3-(2-methyl-1-(naphthale...)
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Affinity Data
IC50: 0.00300nM
Assay Description:
Displacement of [3H](2-(2-hydroxyphenyl)-6-methyl-5-(2-methylpropyl)-3-(2-phenylethyl)-4(3H)-pyrimidinone) from human calcium receptor expressed in h...
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Target
Cytochrome P450 2D6
(Homo sapiens (Human))
Glaxosmithkline
Curated by
ChEMBL
Ligand
BDBM50161093
((R)-2-chloro-6-(2-hydroxy-3-(2-methyl-1-(naphthale...)
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Affinity Data
IC50: 0.0450nM
Assay Description:
Inhibition of CYP2D6
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Target
Extracellular calcium-sensing receptor
(Homo sapiens (Human))
Glaxosmithkline
Curated by
ChEMBL
Ligand
BDBM50161093
((R)-2-chloro-6-(2-hydroxy-3-(2-methyl-1-(naphthale...)
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Affinity Data
IC50: 0.0580nM
Assay Description:
Antagonist activity at human calcium receptor expressed in HEK293 4.0-7 cells assessed as inhibition of intracellular calcium release by FLIPR assay
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Target
Sodium-dependent serotonin transporter
(Homo sapiens (Human))
Glaxosmithkline
Curated by
ChEMBL
Ligand
BDBM50161093
((R)-2-chloro-6-(2-hydroxy-3-(2-methyl-1-(naphthale...)
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Affinity Data
IC50: 2nM
Assay Description:
Binding affinity to serotonin transporter
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Target
Sodium-dependent serotonin transporter
(Homo sapiens (Human))
Glaxosmithkline
Curated by
ChEMBL
Ligand
BDBM50161093
((R)-2-chloro-6-(2-hydroxy-3-(2-methyl-1-(naphthale...)
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Affinity Data
IC50: 2nM
Assay Description:
Inhibition of SERT
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Target
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human))
Glaxosmithkline
Curated by
ChEMBL
Ligand
BDBM50161093
((R)-2-chloro-6-(2-hydroxy-3-(2-methyl-1-(naphthale...)
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Affinity Data
IC50: 3nM
Assay Description:
Inhibition of human ERG
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Target
Extracellular calcium-sensing receptor
(Homo sapiens (Human))
Glaxosmithkline
Curated by
ChEMBL
Ligand
BDBM50161093
((R)-2-chloro-6-(2-hydroxy-3-(2-methyl-1-(naphthale...)
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Affinity Data
IC50: 3nM
Assay Description:
Binding affinity to human parathyroid calcium receptor 1 expressed in HEK293 4.0-7 cells by radioligand binding assay
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Target
Beta-2 adrenergic receptor
(Homo sapiens (Human))
Glaxosmithkline
Curated by
ChEMBL
Ligand
BDBM50161093
((R)-2-chloro-6-(2-hydroxy-3-(2-methyl-1-(naphthale...)
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Affinity Data
IC50: 4.30nM
Assay Description:
Inhibition of beta2 adrenergic receptor
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Target
Extracellular calcium-sensing receptor
(Homo sapiens (Human))
Glaxosmithkline
Curated by
ChEMBL
Ligand
BDBM50161093
((R)-2-chloro-6-(2-hydroxy-3-(2-methyl-1-(naphthale...)
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Affinity Data
IC50: 23nM
Assay Description:
Negative allosteric modulator activity at human recombinant calcium sensing receptor expressed in HEK cells
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Target
Extracellular calcium-sensing receptor
(Homo sapiens (Human))
Glaxosmithkline
Curated by
ChEMBL
Ligand
BDBM50161093
((R)-2-chloro-6-(2-hydroxy-3-(2-methyl-1-(naphthale...)
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Affinity Data
IC50: 26nM
Assay Description:
Antagonist activity at human CaSR expressed in rat PC12 cells transfected with zif promoter/luciferase by reporter gene assay
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Target
Extracellular calcium-sensing receptor
(Homo sapiens (Human))
Glaxosmithkline
Curated by
ChEMBL
Ligand
BDBM50161093
((R)-2-chloro-6-(2-hydroxy-3-(2-methyl-1-(naphthale...)
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Affinity Data
IC50: 43nM
Assay Description:
Inhibitory concentration was evaluated for in vitro calcilytic activity against human calcium receptor
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Target
Extracellular calcium-sensing receptor
(Homo sapiens (Human))
Glaxosmithkline
Curated by
ChEMBL
Ligand
BDBM50161093
((R)-2-chloro-6-(2-hydroxy-3-(2-methyl-1-(naphthale...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 43nM
Assay Description:
Inhibitory concentration against human calcium receptor expressed in HEK 293 cells
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Target
Extracellular calcium-sensing receptor
(Homo sapiens (Human))
Glaxosmithkline
Curated by
ChEMBL
Ligand
BDBM50161093
((R)-2-chloro-6-(2-hydroxy-3-(2-methyl-1-(naphthale...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 43nM
Assay Description:
Inhibition of human CaSR expressed in HEK293 cells
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Target
Cytochrome P450 2D6
(Homo sapiens (Human))
Glaxosmithkline
Curated by
ChEMBL
Ligand
BDBM50161093
((R)-2-chloro-6-(2-hydroxy-3-(2-methyl-1-(naphthale...)
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Affinity Data
IC50: 45nM
Assay Description:
Binding affinity to CYP2D6
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Target
Extracellular calcium-sensing receptor
(Homo sapiens (Human))
Glaxosmithkline
Curated by
ChEMBL
Ligand
BDBM50161093
((R)-2-chloro-6-(2-hydroxy-3-(2-methyl-1-(naphthale...)
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Affinity Data
IC50: 50nM
Assay Description:
Inhibition of intracellular calcium release in human TT cells containing calcium-sensing receptor by FLIPR
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Target
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human))
Glaxosmithkline
Curated by
ChEMBL
Ligand
BDBM50161093
((R)-2-chloro-6-(2-hydroxy-3-(2-methyl-1-(naphthale...)
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Affinity Data
IC50: 194nM
Assay Description:
Inhibitory concentration against human Kv11.1 ERG potassium channel
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Target
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human))
Glaxosmithkline
Curated by
ChEMBL
Ligand
BDBM50161093
((R)-2-chloro-6-(2-hydroxy-3-(2-methyl-1-(naphthale...)
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Affinity Data
IC50: 200nM
Assay Description:
Inhibition of NET
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Target
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human))
Glaxosmithkline
Curated by
ChEMBL
Ligand
BDBM50161093
((R)-2-chloro-6-(2-hydroxy-3-(2-methyl-1-(naphthale...)
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Affinity Data
IC50: 200nM
Assay Description:
Binding affinity to norepinephrine transporter
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Target
Sodium-dependent dopamine transporter
(Homo sapiens (Human))
Glaxosmithkline
Curated by
ChEMBL
Ligand
BDBM50161093
((R)-2-chloro-6-(2-hydroxy-3-(2-methyl-1-(naphthale...)
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Affinity Data
IC50: 200nM
Assay Description:
Inhibition of DAT
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Target Info
NCI pathway
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Target
Sodium-dependent dopamine transporter
(Homo sapiens (Human))
Glaxosmithkline
Curated by
ChEMBL
Ligand
BDBM50161093
((R)-2-chloro-6-(2-hydroxy-3-(2-methyl-1-(naphthale...)
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Affinity Data
IC50: 200nM
Assay Description:
Binding affinity to dopamine transporter
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Target
Extracellular calcium-sensing receptor
(Rattus norvegicus)
Cnrs
Curated by
ChEMBL
Ligand
BDBM50161093
((R)-2-chloro-6-(2-hydroxy-3-(2-methyl-1-(naphthale...)
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Affinity Data
IC50: 460nM
Assay Description:
Activity at rat CaSR in CHO cells assessed as inhibition of calcium ion-induced [3H]inositol phosphate accumulation
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Target
Extracellular calcium-sensing receptor
(Rattus norvegicus)
Cnrs
Curated by
ChEMBL
Ligand
BDBM50161093
((R)-2-chloro-6-(2-hydroxy-3-(2-methyl-1-(naphthale...)
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Affinity Data
IC50: 530nM
Assay Description:
Inhibition of extracellular calcium-induced inositol triphosphate generation in rat MTC cells expressing calcium-sensing receptor
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Target
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human))
Glaxosmithkline
Curated by
ChEMBL
Ligand
BDBM50161093
((R)-2-chloro-6-(2-hydroxy-3-(2-methyl-1-(naphthale...)
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Affinity Data
IC50: 3.00E+3nM
Assay Description:
Binding affinity to human ERG
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Target
Beta-2 adrenergic receptor
(Homo sapiens (Human))
Glaxosmithkline
Curated by
ChEMBL
Ligand
BDBM50161093
((R)-2-chloro-6-(2-hydroxy-3-(2-methyl-1-(naphthale...)
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Affinity Data
IC50: 4.30E+3nM
Assay Description:
Binding affinity to beta2 adrenoceptor
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Target
Extracellular calcium-sensing receptor
(Bos taurus)
Amgen
Curated by
ChEMBL
Ligand
BDBM50161093
((R)-2-chloro-6-(2-hydroxy-3-(2-methyl-1-(naphthale...)
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Affinity Data
EC50: 41nM
Assay Description:
Inhibition of CaSR in bovine parathyroid cells assessed as increase in PTH level
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