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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
71
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Target
Arachidonate 5-lipoxygenase-activating protein
(Homo sapiens (Human))
Amira Pharmaceuticals
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
IC50: 2.20nM
Assay Description:
Inhibition of FLAP in human peripheral leukocytes assessed as inhibition of calcium ionophore A23187-induced LTB4 production after 5 mins by ELISA in...
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Target
Arachidonate 5-lipoxygenase-activating protein
(Homo sapiens (Human))
Amira Pharmaceuticals
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
IC50: 2.5nM
Assay Description:
Antagonist activity at FLAP in human PMNC assessed as inhibition of A23187-induced LTB4 biosynthesis pre-incubated for 2 mins followed by addition of...
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Target
Arachidonate 5-lipoxygenase-activating protein
(Homo sapiens (Human))
Amira Pharmaceuticals
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 2.5nM
Assay Description:
Antagonist activity at FLAP in human PMNC assessed as inhibition of A23187-induced LTB4 biosynthesis pre-incubated for 2 mins followed by addition of...
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Target
Prostaglandin E synthase
(Homo sapiens (Human))
Peking University
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
IC50: 3nM
Assay Description:
Inhibition of microsomal PGES-1 (unknown origin)
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Target
Polyunsaturated fatty acid 5-lipoxygenase
(Rattus norvegicus)
Wyeth-Ayerst Research
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
IC50: 5nM
Assay Description:
The compound was tested for inhibitory activity against 5-lipoxygenase translocation inhibitor in rat RBL-2H3 cells
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Target
Arachidonate 5-lipoxygenase-activating protein
(Homo sapiens (Human))
Amira Pharmaceuticals
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
IC50: 5.70nM
Assay Description:
Inhibition of FLAP in human peripheral leukocytes assessed as inhibition of calcium ionophore A23187-induced LTB4 production after 1 hr by ELISA in a...
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Target
Prostaglandin G/H synthase 1
(Ovis aries (Sheep))
Eberhard Karls University Tuebingen
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
IC50: >10nM
Assay Description:
Inhibition of ovine COX1
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Target
Prostaglandin G/H synthase 2
(Homo sapiens (Human))
Eberhard Karls University Tuebingen
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
IC50: >10nM
Assay Description:
Inhibition of human recombinant COX2
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Target
Polyunsaturated fatty acid 5-lipoxygenase
(Homo sapiens (Human))
Merck Frosst Centre For Therapeutic Research
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
IC50: >10nM
Assay Description:
Inhibition of Human 5-lipoxygenase
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Target
Arachidonate 5-lipoxygenase-activating protein
(Homo sapiens (Human))
Amira Pharmaceuticals
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
IC50: 17nM
Assay Description:
Inhibition of FLAP in A23187-stimulated human neutrophils assessed as 5-LO product formation preincubated for 15 mins measured after 10 mins
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Target
Arachidonate 5-lipoxygenase-activating protein
(Homo sapiens (Human))
Amira Pharmaceuticals
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 19nM
Assay Description:
Inhibition of FLAP in human peripheral leukocytes assessed as inhibition of calcium ionophore A23187-induced LTB4 production after 10 mins by ELISA i...
More data for this Ligand-Target Pair
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Target
Arachidonate 5-lipoxygenase-activating protein
(Homo sapiens (Human))
Amira Pharmaceuticals
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
Copy SMILES
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Affinity Data
IC50: 23nM
Assay Description:
Inhibition of 5-lipoxygenase activating protein using human leukocyte membrane preparations
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Target
Arachidonate 5-lipoxygenase-activating protein
(Homo sapiens (Human))
Amira Pharmaceuticals
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
IC50: 23nM
Assay Description:
The compound was tested for the inhibition of binding of [125I]- L- 691,831 binding to 5-lipoxygenase activating protein (FLAP)
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Target
Arachidonate 5-lipoxygenase-activating protein
(Homo sapiens (Human))
Amira Pharmaceuticals
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
Copy SMILES
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Affinity Data
IC50: 23nM
Assay Description:
Binding affinity of compound for 5-lipoxygenase activating protein protein by FLAP binding assay
More data for this Ligand-Target Pair
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Target
Arachidonate 5-lipoxygenase-activating protein
(Homo sapiens (Human))
Amira Pharmaceuticals
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
Copy SMILES
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Affinity Data
IC50: 23nM
Assay Description:
Displacement of [125I]-L-691831 from FLAP in human Leucocyte membrane incubated for 20 mins by radioactivity based gamma-scintillation counter assay
More data for this Ligand-Target Pair
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Target
Arachidonate 5-lipoxygenase-activating protein
(Homo sapiens (Human))
Amira Pharmaceuticals
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 26nM
Assay Description:
Inhibition of FLAP
More data for this Ligand-Target Pair
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Target
Arachidonate 5-lipoxygenase-activating protein
(Homo sapiens (Human))
Amira Pharmaceuticals
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 26nM
Assay Description:
Inhibition of FLAP
More data for this Ligand-Target Pair
Target Info
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Target
Arachidonate 5-lipoxygenase-activating protein
(Homo sapiens (Human))
Amira Pharmaceuticals
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 26nM
Assay Description:
Inhibition of FLAP (unknown origin)
More data for this Ligand-Target Pair
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Target
Arachidonate 5-lipoxygenase-activating protein
(Homo sapiens (Human))
Amira Pharmaceuticals
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 26nM
Assay Description:
Binding affinity to FLAP
More data for this Ligand-Target Pair
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Target
Arachidonate 5-lipoxygenase-activating protein
(Homo sapiens (Human))
Amira Pharmaceuticals
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 27nM
Assay Description:
Inhibition of FLAP in human peripheral leukocytes assessed as inhibition of calcium ionophore A23187-induced LTB4 production after 3 hr by ELISA in p...
More data for this Ligand-Target Pair
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Target
Arachidonate 5-lipoxygenase-activating protein/Polyunsaturated fatty acid 5-lipoxygenase
(Homo sapiens (Human))
TBA
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
IC50: 30nM
Assay Description:
Human whole blood was stimulated with calcium ionophore (A23187) and LTB 4 measured by enzyme immunoassay
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Target
Polyunsaturated fatty acid 5-lipoxygenase
(Homo sapiens (Human))
Merck Frosst Centre For Therapeutic Research
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
IC50: 60nM
Assay Description:
The compound was tested for inhibitory activity against LT synthesis in human polymorphonuclear leukocytes[PMNS]
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Target
Polyunsaturated fatty acid 5-lipoxygenase
(Homo sapiens (Human))
Merck Frosst Centre For Therapeutic Research
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
IC50: 90nM
Assay Description:
Inhibition of 5-lipoxygenase-mediated 5(S)-H(p)ETE formation in fMLP-stimulated human PMNL incubated 10 mins prior to fMLP challenge
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Target
Polyunsaturated fatty acid 5-lipoxygenase
(Homo sapiens (Human))
Merck Frosst Centre For Therapeutic Research
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
IC50: 90nM
Assay Description:
Inhibition of 5-lipoxygenase in A23187-stimulated human polymorphonuclear leukocytes using arachidonic acid as substrate incubated 15 mins prior to s...
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Target
Polyunsaturated fatty acid 5-lipoxygenase
(Homo sapiens (Human))
Merck Frosst Centre For Therapeutic Research
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
IC50: 90nM
Assay Description:
Inhibition of 5-lipoxygenase in A23187-stimulated human PMNL assessed as enzyme product formation preincubated 15 mins by RP-HPLC analysis in presenc...
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Target
Polyunsaturated fatty acid 5-lipoxygenase
(Homo sapiens (Human))
Merck Frosst Centre For Therapeutic Research
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
IC50: 90nM
Assay Description:
Inhibition of 5-LO in PMNL cells
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Target
Arachidonate 5-lipoxygenase-activating protein/Polyunsaturated fatty acid 5-lipoxygenase
(Homo sapiens (Human))
TBA
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
IC50: 340nM
Assay Description:
Human whole blood was stimulated with calcium ionophore (A23187) and LTB 4 measured by enzyme immunoassay
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Target
Arachidonate 5-lipoxygenase-activating protein
(Homo sapiens (Human))
Amira Pharmaceuticals
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
IC50: 1.00E+3nM
Assay Description:
Inhibition of FLAP in human whole blood assessed as inhibition of calcium ionophore A23187-induced LTB4 production preincubated for 11 hrs by ELISA
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Target
Arachidonate 5-lipoxygenase-activating protein
(Homo sapiens (Human))
Amira Pharmaceuticals
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
Copy SMILES
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Affinity Data
IC50: 1.10E+3nM
Assay Description:
Inhibition of FLAP in human whole blood assessed as inhibition of calcium ionophore A23187-induced LTB4 production preincubated for 5 hrs by ELISA
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Target
Polyunsaturated fatty acid 5-lipoxygenase
(Homo sapiens (Human))
Merck Frosst Centre For Therapeutic Research
Curated by
ChEMBL
Ligand
BDBM50000838
(CHEMBL416657 | Sodium; 3-[3-tert-butylsulfanyl-1-(...)
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Affinity Data
IC50: 1.10E+3nM
Assay Description:
In vitro inhibition of leukotriene B4 synthesis in human whole blood by inhibiting 5-LPO (5-lipoxygenase)
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Target
Prostaglandin E synthase
(Homo sapiens (Human))
Peking University
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
IC50: 1.30E+3nM
Assay Description:
Inhibition of human recombinant mPGES-1 in assessed as conversion of PGH2 into PGE2 at 20 degC after 5 mins by HPLC-UV analysis
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Target
Arachidonate 5-lipoxygenase-activating protein
(Homo sapiens (Human))
Amira Pharmaceuticals
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
IC50: 1.40E+3nM
Assay Description:
Inhibition of FLAP in human whole blood assessed as inhibition of calcium ionophore A23187-induced LTB4 production preincubated for 15 mins by ELISA
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Target
Prostaglandin E synthase 2
(Homo sapiens (Human))
Merck Frosst Centre For Therapeutic Research
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
IC50: 1.60E+3nM
Assay Description:
Inhibitory concentration against human prostaglandin E2 synthase (mPGES-1)
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Target
Prostaglandin E synthase
(Homo sapiens (Human))
Peking University
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
IC50: 1.60E+3nM
Assay Description:
Inhibition of human mPGES1
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Target
Prostaglandin E synthase
(Homo sapiens (Human))
Peking University
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
IC50: 1.60E+3nM
Assay Description:
Inhibition of human recombinant mPGES-1 using PGH2 as substrate incubated 20 mins prior to substrate addition measured after 30 secs by EIA
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Target
Prostaglandin E synthase
(Homo sapiens (Human))
Peking University
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
IC50: 1.60E+3nM
Assay Description:
Inhibition of mPGES-1
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Target
Prostaglandin E synthase
(Homo sapiens (Human))
Peking University
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
IC50: 1.91E+3nM
pH: 7.0 T: 2°C
Assay Description:
The assay buffer contained 100 mM KHPO4 (pH 7.0), 2 mM EDTA and 2.5 mM reduced GSH. 100 µL of reaction buffer containing human recombinant mPGES...
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Target
Prostaglandin E synthase
(Homo sapiens (Human))
Peking University
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
IC50: 2.00E+3nM
Assay Description:
Inhibition of mPGES1 in IL1beta induced human A549 cell microsomal membrane assessed as blockade of conversion of PGH2 to PGE2
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Target
Prostaglandin E synthase
(Homo sapiens (Human))
Peking University
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
IC50: 2.00E+3nM
Assay Description:
Inhibition of PGES-1 in human A549 cell microsomes using PGH2 as substrate assessed as suppression of interleukin-1beta-stimulated PGE2 production in...
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Target
Thromboxane-A synthase
(Homo sapiens (Human))
Roche Research Center
Curated by
ChEMBL
Ligand
BDBM50000838
(CHEMBL416657 | Sodium; 3-[3-tert-butylsulfanyl-1-(...)
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Affinity Data
IC50: 2.00E+3nM
Assay Description:
Inhibitory activity of the compound to inhibit Inophore-induced arachidonic acid metabolism (inhibition of TXB2 formation) in rat
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Target
Prostaglandin E synthase
(Homo sapiens (Human))
Peking University
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
IC50: 2.10E+3nM
Assay Description:
Inhibition of mPGES1 in human A549 cell microsomes
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Target
Prostaglandin E synthase
(Homo sapiens (Human))
Peking University
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Copy InChI
Affinity Data
IC50: 2.10E+3nM
Assay Description:
Inhibition of mPGES-1 activity in IL-1beta stimulated human A549 cells microsomes assessed as reduction in PGE2 production preincubated for 15 mins f...
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Target
Prostaglandin E synthase
(Homo sapiens (Human))
Peking University
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
IC50: 2.10E+3nM
Assay Description:
Inhibition of PGES-1 in IL-1beta stimulated human A549 cell microsomes using PGH2 as substrate assessed as suppression of PGE2 formation preincubated...
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Target
Prostaglandin E synthase
(Homo sapiens (Human))
Peking University
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Copy InChI
Affinity Data
IC50: 2.10E+3nM
Assay Description:
Inhibition of mPGES1 in IL-1beta treated human A549 cell microsomal membrane assessed as inhibition of PGE2 formation incubated for 15 mins before ad...
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Target
Prostaglandin E synthase
(Homo sapiens (Human))
Peking University
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
IC50: 2.10E+3nM
Assay Description:
Inhibition of mPGES1 in human A549 cell microsomal membrane using pGH2 as substrate pretreated for 15 mins followed by substrate addition and measure...
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Target
Prostaglandin E synthase
(Homo sapiens (Human))
Peking University
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
IC50: 2.10E+3nM
Assay Description:
Inhibition of PGES1 in human A549 cell microsome assessed as PGE2 formation by cell-free assay
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Target
Prostaglandin E synthase
(Homo sapiens (Human))
Peking University
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
IC50: 2.11E+3nM
Assay Description:
Inhibition of mPGES1 in IL-1beta treated human A549 cell microsomal membrane assessed as residual enzyme activity after 1 min by measuring PGE2 level...
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Target
Macrophage-expressed gene 1 protein
(Homo sapiens (Human))
University Of Naples
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
IC50: 2.20E+3nM
Assay Description:
Inhibition of mPGES1 in IL-1beta stimulated human A549 cell microsomal membranes assessed as reduction in PGE2 synthase activity after 15 mins using ...
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Target
Prostaglandin E synthase
(Homo sapiens (Human))
Peking University
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
IC50: 2.30E+3nM
Assay Description:
Inhibition of mPGES-1 in human IL-1beta-stimulated A549 cell microsomes assessed as inhibition of PGE2 formation from PGH2 after 15 mins by RP-HPLC a...
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Target
Prostaglandin E synthase
(Homo sapiens (Human))
Peking University
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
IC50: 2.40E+3nM
Assay Description:
Inhibition of microsomal PGES1 isolated from IL-1beta-stimulated human A549 cells preincubated for 15 mins followed by substrate addition measured af...
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Target
Prostaglandin E synthase
(Homo sapiens (Human))
Peking University
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 2.40E+3nM
Assay Description:
Inhibition of mPGES-1 from human A549 cell microsomal membranes using PGH2 as substrate incubated 15 mins prior to substrate addition measured after ...
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Target
Prostaglandin E synthase
(Homo sapiens (Human))
Peking University
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Copy InChI
Affinity Data
IC50: 2.40E+3nM
Assay Description:
Inhibition of mPGES-1 in human IL-1beta-stimulated A549 cell microsomes assessed as reduction of PGE2 formation from PGH2 after 15 mins by RP-HPLC an...
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Target
Prostaglandin E synthase
(Homo sapiens (Human))
Peking University
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 2.40E+3nM
Assay Description:
Inhibition of mPGES-1 in IL-1beta-stimulated human A549 cell microsomal membranes assessed as reduction in PGE2 formation incubated for 15 mins using...
More data for this Ligand-Target Pair
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Target
Prostaglandin E synthase
(Homo sapiens (Human))
Peking University
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 2.40E+3nM
Assay Description:
Inhibition of mPGES-1 in human IL-1beta-stimulated A549 cell microsomes assessed as reduction of PGE2 formation from PGH2 after 15 mins
More data for this Ligand-Target Pair
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Target
Prostaglandin E synthase
(Homo sapiens (Human))
Peking University
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
IC50: 2.40E+3nM
Assay Description:
Inhibition of mPGES1
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Target
Prostaglandin E synthase
(Homo sapiens (Human))
Peking University
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
IC50: 2.50E+3nM
Assay Description:
Inhibition of human A549 cell microsomal membrane-derived mPGES-1 assessed as reduction in conversion of PGH2 to PGE2 preincubated for 15 mins follow...
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Target
Prostaglandin E synthase
(Homo sapiens (Human))
Peking University
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
IC50: 2.70E+3nM
Assay Description:
Inhibition of mPGES-1 in interleukin-1 beta-stimulated human A549 cells microsomal membranes assessed as reduction in conversion of PGH2 to PGE2 pre-...
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Target
Prostaglandin E synthase
(Homo sapiens (Human))
Peking University
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
IC50: 3.00E+3nM
Assay Description:
Inhibition of mPGES-1 expressed in LPS-stimulated human A549 cells mitochondrial fraction assessed as conversion of PGH2 to PGE2
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Target
Polyunsaturated fatty acid 5-lipoxygenase
(Homo sapiens (Human))
Merck Frosst Centre For Therapeutic Research
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
IC50: 3.00E+3nM
Assay Description:
Inhibition of recombinant human 5-LO expressed in Escherichia coli BL21 incubated for 15 mins prior to prewarming for 30 secs followed by CaCl2+ and ...
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Target
Leukotriene C4 synthase
(Homo sapiens (Human))
Gazi University
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
IC50: 3.00E+3nM
Assay Description:
Inhibition of recombinant LTC4S (unknown origin) expressed in COS cells
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Target
Prostaglandin E synthase
(Homo sapiens (Human))
Peking University
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
IC50: 3.20E+3nM
Assay Description:
Inhibition of microsomal PGES1 using PGH2 as substrate by RP-HPLC method
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Target
Prostaglandin E synthase
(Homo sapiens (Human))
Peking University
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
IC50: 3.90E+3nM
Assay Description:
Inhibition of mPGES1 (unknown origin) using PGH2 as substrate incubated for 30 mins prior to substrate addition by PGH2-coupled spectrophotometric an...
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Target
Prostaglandin E synthase
(Homo sapiens (Human))
Peking University
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
IC50: 3.90E+3nM
Assay Description:
Inhibition of mPGES-1 activity in IL-1beta stimulated human A549 cells by cell-free assay
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Target
Prostaglandin G/H synthase 1
(Ovis aries (Sheep))
Eberhard Karls University Tuebingen
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
IC50: 8.00E+3nM
Assay Description:
Inhibition of ovine COX-1 assessed as 12-HHT formation preincubated for 5 mins followed by addition of arachidonic acid as substrate measured after 5...
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Target
Prostaglandin G/H synthase 1
(Ovis aries (Sheep))
Eberhard Karls University Tuebingen
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
IC50: 8.00E+3nM
Assay Description:
Inhibition of ovine COX1 using arachidonic acid as substrate pretreated for 5 mins followed by substrate addition and measured after 5 mins by HPLC a...
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Target
Prostaglandin G/H synthase 1
(Ovis aries (Sheep))
Eberhard Karls University Tuebingen
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
IC50: 8.00E+3nM
Assay Description:
Inhibition of ovine COX-1 assessed as 12-HHT formation preincubated for 5 mins followed by addition of arachidonic acid as substrate measured after 5...
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Target
Replicase polyprotein 1ab
(2019-nCoV)
Michigan State University
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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IC50: 2.15E+4nM
Assay Description:
This is a review article. Please point to the original journal.
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Target
Replicase polyprotein 1ab
(2019-nCoV)
Michigan State University
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
IC50: 2.15E+4nM
Assay Description:
The 3CLpro enzyme assay was developed in 384-well black, medium binding microplates (Greiner Bio-One, Monroe, NC, USA) with a total volume of 20 _...
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Prostaglandin G/H synthase 2
(Homo sapiens (Human))
Eberhard Karls University Tuebingen
Curated by
ChEMBL
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
IC50: 5.80E+4nM
Assay Description:
Inhibition of human recombinant COX2 in cell-free system by enzyme immunoassay
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Streptokinase A
(Streptococcus pyogenes M1 GAS)
Broad Institute
Curated by
PubChem BioAssay
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
EC50: 1.24E+3nM
Assay Description:
Keywords: Group A streptococcus, GAS, streptokinase, expression, virulence, inhibition, dose response, EC50 Assay Overview: The goal of this assa...
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Target
Replicase polyprotein 1ab
(2019-nCoV)
Michigan State University
Ligand
BDBM50006805
(3-(1-(4-chlorobenzyl)-3-(tert-butylthio)-5-isoprop...)
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Affinity Data
EC50: 1.12E+4nM
Assay Description:
SARS-CoV-2 CPE assay was conducted at Southern Research Institute (Birmingham, AL) as described in previous reports30, 31. In brief, high ACE2 expres...
More data for this Ligand-Target Pair
Target Info
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