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Compile Data Set for Download or QSAR
maximum 50k data
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
(change energy unit to
kcal/mol
)
Found
35
hits in this display
Target
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50244809
((2R)-2-[3-[[3-(4-Chlorobenzoyl)-2-methyl-6-(triflu...)
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Affinity Data
IC50: 11nM
Assay Description:
Inhibition of human PPARgamma receptor by scintillation proximity assay
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
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Target
Substance-K receptor
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50244809
((2R)-2-[3-[[3-(4-Chlorobenzoyl)-2-methyl-6-(triflu...)
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Affinity Data
IC50: 530nM
Assay Description:
Displacement of radioligand from tachykinin NK2 receptor
More data for this Ligand-Target Pair
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Target
Alpha-2B adrenergic receptor
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50244809
((2R)-2-[3-[[3-(4-Chlorobenzoyl)-2-methyl-6-(triflu...)
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Affinity Data
IC50: 770nM
Assay Description:
Displacement of radioligand from adrenergic alpha2B receptor
More data for this Ligand-Target Pair
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Target
D(3) dopamine receptor
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50244809
((2R)-2-[3-[[3-(4-Chlorobenzoyl)-2-methyl-6-(triflu...)
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Affinity Data
IC50: 837nM
Assay Description:
Displacement of radioligand from dopamine D3 receptor
More data for this Ligand-Target Pair
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Target
Sodium-dependent serotonin transporter
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50244809
((2R)-2-[3-[[3-(4-Chlorobenzoyl)-2-methyl-6-(triflu...)
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Affinity Data
IC50: 970nM
Assay Description:
Displacement of radioligand from SERT
More data for this Ligand-Target Pair
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Target
5-hydroxytryptamine receptor 2B
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50244809
((2R)-2-[3-[[3-(4-Chlorobenzoyl)-2-methyl-6-(triflu...)
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Affinity Data
IC50: 1.14E+3nM
Assay Description:
Displacement of radioligand from 5HT2B receptor
More data for this Ligand-Target Pair
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Target
Prostaglandin E2 receptor EP3 subtype
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50244809
((2R)-2-[3-[[3-(4-Chlorobenzoyl)-2-methyl-6-(triflu...)
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Affinity Data
IC50: 1.22E+3nM
Assay Description:
Inhibition of prostanoid EP3 receptor
More data for this Ligand-Target Pair
Target Info
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Target
Muscarinic acetylcholine receptor M4
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50244809
((2R)-2-[3-[[3-(4-Chlorobenzoyl)-2-methyl-6-(triflu...)
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Affinity Data
IC50: 1.34E+3nM
Assay Description:
Displacement of radioligand from muscarinic M4 receptor
More data for this Ligand-Target Pair
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Target
D(1A) dopamine receptor
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50244809
((2R)-2-[3-[[3-(4-Chlorobenzoyl)-2-methyl-6-(triflu...)
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Affinity Data
IC50: 1.53E+3nM
Assay Description:
Displacement of radioligand from dopamine D1 receptor
More data for this Ligand-Target Pair
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Target
Muscarinic acetylcholine receptor M3
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50244809
((2R)-2-[3-[[3-(4-Chlorobenzoyl)-2-methyl-6-(triflu...)
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Affinity Data
IC50: 1.56E+3nM
Assay Description:
Displacement of radioligand from muscarinic M3 receptor
More data for this Ligand-Target Pair
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Target
Polyunsaturated fatty acid 5-lipoxygenase
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50244809
((2R)-2-[3-[[3-(4-Chlorobenzoyl)-2-methyl-6-(triflu...)
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Affinity Data
IC50: 1.64E+3nM
Assay Description:
Inhibition of 5-Lipoxygenase
More data for this Ligand-Target Pair
Target Info
PDB
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Target
Alpha-2A adrenergic receptor
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50244809
((2R)-2-[3-[[3-(4-Chlorobenzoyl)-2-methyl-6-(triflu...)
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Affinity Data
IC50: 1.65E+3nM
Assay Description:
Displacement of radioligand from adrenergic alpha2A receptor
More data for this Ligand-Target Pair
Target Info
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Target
Delta-type opioid receptor
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50244809
((2R)-2-[3-[[3-(4-Chlorobenzoyl)-2-methyl-6-(triflu...)
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Affinity Data
IC50: 1.69E+3nM
Assay Description:
Displacement of radioligand from delta opioid receptor
More data for this Ligand-Target Pair
Target Info
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Target
Mu-type opioid receptor
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50244809
((2R)-2-[3-[[3-(4-Chlorobenzoyl)-2-methyl-6-(triflu...)
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Affinity Data
IC50: 1.86E+3nM
Assay Description:
Displacement of radioligand from mu opioid receptor
More data for this Ligand-Target Pair
Target Info
PDB
NCI pathway
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Target
Thromboxane A2 receptor
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50244809
((2R)-2-[3-[[3-(4-Chlorobenzoyl)-2-methyl-6-(triflu...)
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Affinity Data
IC50: 2.03E+3nM
Assay Description:
Displacement of radioligand from TXA2 receptor
More data for this Ligand-Target Pair
Target Info
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Target
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50244809
((2R)-2-[3-[[3-(4-Chlorobenzoyl)-2-methyl-6-(triflu...)
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Affinity Data
IC50: 2.16E+3nM
Assay Description:
Displacement of radioligand from NET
More data for this Ligand-Target Pair
Target Info
Reactome pathway
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Target
Epidermal growth factor receptor
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50244809
((2R)-2-[3-[[3-(4-Chlorobenzoyl)-2-methyl-6-(triflu...)
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Affinity Data
IC50: 2.24E+3nM
Assay Description:
Inhibition of EGFR
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
Reactome pathway
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B.MOAD
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Target
Prostaglandin F2-alpha receptor
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50244809
((2R)-2-[3-[[3-(4-Chlorobenzoyl)-2-methyl-6-(triflu...)
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Affinity Data
IC50: 2.73E+3nM
Assay Description:
Inhibition of prostanoid FP receptor
More data for this Ligand-Target Pair
Target Info
PDB
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Target
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50244809
((2R)-2-[3-[[3-(4-Chlorobenzoyl)-2-methyl-6-(triflu...)
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Affinity Data
IC50: 3.23E+3nM
Assay Description:
Inhibition of human ERG
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
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Target
Sodium-dependent dopamine transporter
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50244809
((2R)-2-[3-[[3-(4-Chlorobenzoyl)-2-methyl-6-(triflu...)
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Affinity Data
IC50: 3.41E+3nM
Assay Description:
Displacement of radioligand from DAT
More data for this Ligand-Target Pair
Target Info
NCI pathway
Reactome pathway
KEGG
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Target
Kappa-type opioid receptor
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50244809
((2R)-2-[3-[[3-(4-Chlorobenzoyl)-2-methyl-6-(triflu...)
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Affinity Data
IC50: 3.48E+3nM
Assay Description:
Displacement of radioligand from kappa opioid receptor
More data for this Ligand-Target Pair
Target Info
PDB
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Target
D(2) dopamine receptor
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50244809
((2R)-2-[3-[[3-(4-Chlorobenzoyl)-2-methyl-6-(triflu...)
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Affinity Data
IC50: 3.55E+3nM
Assay Description:
Displacement of radioligand from dopamine D2S receptor
More data for this Ligand-Target Pair
Target Info
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Target
Prostaglandin E2 receptor EP4 subtype
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50244809
((2R)-2-[3-[[3-(4-Chlorobenzoyl)-2-methyl-6-(triflu...)
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Affinity Data
IC50: 3.70E+3nM
Assay Description:
Inhibition of prostanoid EP4 receptor
More data for this Ligand-Target Pair
Target Info
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Target
Beta-1 adrenergic receptor
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50244809
((2R)-2-[3-[[3-(4-Chlorobenzoyl)-2-methyl-6-(triflu...)
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Affinity Data
IC50: 4.07E+3nM
Assay Description:
Displacement of radioligand from adrenergic beta-1 receptor
More data for this Ligand-Target Pair
Target Info
PDB
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Target
Beta-3 adrenergic receptor
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50244809
((2R)-2-[3-[[3-(4-Chlorobenzoyl)-2-methyl-6-(triflu...)
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Affinity Data
IC50: 4.86E+3nM
Assay Description:
Displacement of radioligand from adrenergic beta3 receptor
More data for this Ligand-Target Pair
Target Info
PDB
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KEGG
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Target
Prostacyclin receptor
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50244809
((2R)-2-[3-[[3-(4-Chlorobenzoyl)-2-methyl-6-(triflu...)
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Affinity Data
IC50: 6.34E+3nM
Assay Description:
Inhibition of prostanoid IP receptor
More data for this Ligand-Target Pair
Target Info
PDB
NCI pathway
Reactome pathway
KEGG
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Target
Prostaglandin D2 receptor
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50244809
((2R)-2-[3-[[3-(4-Chlorobenzoyl)-2-methyl-6-(triflu...)
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Affinity Data
IC50: 8.45E+3nM
Assay Description:
Inhibition of prostanoid DP receptor
More data for this Ligand-Target Pair
Target Info
Reactome pathway
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Target
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50244809
((2R)-2-[3-[[3-(4-Chlorobenzoyl)-2-methyl-6-(triflu...)
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Affinity Data
IC50: >1.50E+4nM
Assay Description:
Inhibition of human PPARalpha receptor by scintillation proximity assay
More data for this Ligand-Target Pair
Target Info
PDB
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Target
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50244809
((2R)-2-[3-[[3-(4-Chlorobenzoyl)-2-methyl-6-(triflu...)
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Affinity Data
EC50: 6nM
Assay Description:
Partial agonist activity at human PPARgamma LBD assessed as activation of CBP1-453 by HTRF assay
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
NCI pathway
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Target
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50244809
((2R)-2-[3-[[3-(4-Chlorobenzoyl)-2-methyl-6-(triflu...)
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Affinity Data
EC50: 5nM
Assay Description:
Partial agonist activity at human PPARgamma LBD assessed as activation of PBP by HTRF assay
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
NCI pathway
Reactome pathway
KEGG
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Article
PubMed
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Target
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50244809
((2R)-2-[3-[[3-(4-Chlorobenzoyl)-2-methyl-6-(triflu...)
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Affinity Data
EC50: >5.00E+4nM
Assay Description:
Partial agonist activity at human PPARgamma LBD assessed as activation of Src-1 by HTRF assay
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
NCI pathway
Reactome pathway
KEGG
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Target
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50244809
((2R)-2-[3-[[3-(4-Chlorobenzoyl)-2-methyl-6-(triflu...)
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Affinity Data
EC50: 320nM
Assay Description:
Agonist activity at human PPARalpha receptor expressed in african green monkey COS1 cells cotransfected with fused yeast Gal4-DBD by transactivation ...
More data for this Ligand-Target Pair
Target Info
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Target
Peroxisome proliferator-activated receptor alpha
(Mus musculus)
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50244809
((2R)-2-[3-[[3-(4-Chlorobenzoyl)-2-methyl-6-(triflu...)
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Affinity Data
EC50: 28nM
Assay Description:
Agonist activity at mouse PPARalpha receptor expressed in african green monkey COS1 cells co-transfected with fused yeast Gal4-DBD by transactivation...
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
Reactome pathway
KEGG
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Target
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50244809
((2R)-2-[3-[[3-(4-Chlorobenzoyl)-2-methyl-6-(triflu...)
Copy SMILES
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Affinity Data
EC50: 5nM
Assay Description:
Partial agonist activity at human PPARgamma LBD assessed as activation of PGC1 by HTRF assay
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
NCI pathway
Reactome pathway
KEGG
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Target
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50244809
((2R)-2-[3-[[3-(4-Chlorobenzoyl)-2-methyl-6-(triflu...)
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Affinity Data
EC50: 4nM
Assay Description:
Agonist activity at human PPARgamma receptor expressed in african green monkey COS1 cells co-transfected with fused yeast Gal4-DBD by transactivation...
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