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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
46
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Target
ATP-binding cassette sub-family C member 9/ATP-sensitive inward rectifier potassium channel 11
(Homo sapiens (Human))
Bristol-Myers Squibb Pharmaceutical Research Institute
Curated by
ChEMBL
Ligand
BDBM50012957
(1-((p-(2-(5-chloro-o-anisamido)ethyl)phenyl)sulfon...)
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Affinity Data
Ki: 130nM
Assay Description:
Binding affinity was determined by displacement of [3H]-P1075 from its binding sites in canine cardiac membranes
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Target
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human))
Seoul National University
Curated by
ChEMBL
Ligand
BDBM50012957
(1-((p-(2-(5-chloro-o-anisamido)ethyl)phenyl)sulfon...)
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Affinity Data
Ki: 660nM
Assay Description:
Binding affinity to PPARgamma (unknown origin) by TR-FRET assay
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Target
Solute carrier family 22 member 6
(Rattus norvegicus)
Kyoto University Hospital
Curated by
ChEMBL
Ligand
BDBM50012957
(1-((p-(2-(5-chloro-o-anisamido)ethyl)phenyl)sulfon...)
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Affinity Data
Ki: 1.60E+3nM
Assay Description:
TP_TRANSPORTER: inhibition of PAH uptake in Xenopus laevis oocytes
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Target
CDGSH iron-sulfur domain-containing protein 1
(Homo sapiens (Human))
West Virginia University
Curated by
ChEMBL
Ligand
BDBM50012957
(1-((p-(2-(5-chloro-o-anisamido)ethyl)phenyl)sulfon...)
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Affinity Data
Ki: 1.67E+3nM
Assay Description:
Displacement of [3H]rosiglitazone from recombinant human C-terminal His-tagged MitoNEET cytosolic domain (32 to 108 residues) expressed in Escherichi...
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Target
Bile salt export pump
(Rattus norvegicus)
University Hospital
Curated by
ChEMBL
Ligand
BDBM50012957
(1-((p-(2-(5-chloro-o-anisamido)ethyl)phenyl)sulfon...)
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Affinity Data
Ki: 6.10E+3nM
Assay Description:
TP_TRANSPORTER: inhibition of Taurocholate uptake in membrane vesicles from Bsep-expressing Sf9 cells
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Target
Solute carrier family 15 member 2
(Rattus norvegicus)
Kyoto University Hospital
Curated by
ChEMBL
Ligand
BDBM50012957
(1-((p-(2-(5-chloro-o-anisamido)ethyl)phenyl)sulfon...)
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Affinity Data
Ki: 7.80E+3nM
Assay Description:
TP_TRANSPORTER: inhibition of Gly-Sar uptake in PEPT2-expressing LLC-PK1 cells
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Target
Solute carrier family 15 member 1
(Rattus norvegicus)
Kyoto University Hospital
Curated by
ChEMBL
Ligand
BDBM50012957
(1-((p-(2-(5-chloro-o-anisamido)ethyl)phenyl)sulfon...)
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Affinity Data
Ki: 2.50E+4nM
Assay Description:
TP_TRANSPORTER: inhibition of Gly-Sar uptake in PEPT1-expressing LLC-PK1 cells
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Target
Bile salt export pump
(Homo sapiens (Human))
King'S College Hospital
Curated by
ChEMBL
Ligand
BDBM50012957
(1-((p-(2-(5-chloro-o-anisamido)ethyl)phenyl)sulfon...)
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Affinity Data
Ki: 2.75E+4nM
Assay Description:
TP_TRANSPORTER: inhibition of Taurocholate uptake(Glibenclamide 30uM, 50 % of control) in membrane vesicles prepared from High Five cells infected wi...
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Target
ATP-binding cassette sub-family C member 8/ATP-sensitive inward rectifier potassium channel 11
(Homo sapiens (Human))
Abbott Laboratories
Curated by
ChEMBL
Ligand
BDBM50012957
(1-((p-(2-(5-chloro-o-anisamido)ethyl)phenyl)sulfon...)
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Affinity Data
IC50: 4.30nM
Assay Description:
Inhibition of human SUR1/Kir6.2 expressed in CHO cells
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Target
Surfeit locus protein 1
(Human)
Shanghai Senhui Medicine
US Patent
Ligand
BDBM50012957
(1-((p-(2-(5-chloro-o-anisamido)ethyl)phenyl)sulfon...)
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Affinity Data
IC50: 6nM
Assay Description:
Procedures:a) 100 μL of reaction buffer was added to each well of a 96-well deep-well plate.b) 5 μL of diluted test compound (1% DMSO) was ...
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Target
Surfeit locus protein 1
(Human)
Shanghai Senhui Medicine
US Patent
Ligand
BDBM50012957
(1-((p-(2-(5-chloro-o-anisamido)ethyl)phenyl)sulfon...)
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Affinity Data
IC50: 9nM
Assay Description:
Procedures:a) 100 μL of reaction buffer was added to each well of a 96-well deep-well plate.b) 5 μL of diluted test compound (1% DMSO) was ...
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Target
Surfeit locus protein 1
(Human)
Shanghai Senhui Medicine
US Patent
Ligand
BDBM50012957
(1-((p-(2-(5-chloro-o-anisamido)ethyl)phenyl)sulfon...)
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Affinity Data
IC50: 9nM
Assay Description:
Procedures:a) 100 μL of reaction buffer was added to each well of a 96-well deep-well plate.b) 5 μL of diluted test compound (1% DMSO) was ...
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Target
ATP-binding cassette sub-family C member 9/ATP-sensitive inward rectifier potassium channel 11
(Homo sapiens (Human))
Bristol-Myers Squibb Pharmaceutical Research Institute
Curated by
ChEMBL
Ligand
BDBM50012957
(1-((p-(2-(5-chloro-o-anisamido)ethyl)phenyl)sulfon...)
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Affinity Data
IC50: 220nM
Assay Description:
Inhibition of human SUR2A/Kir6.2 expressed in Xenopus oocytes
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Target
Solute carrier organic anion transporter family member 1B1
(Homo sapiens (Human))
Bristol-Myers Squibb
Curated by
ChEMBL
Ligand
BDBM50012957
(1-((p-(2-(5-chloro-o-anisamido)ethyl)phenyl)sulfon...)
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Affinity Data
IC50: 1.40E+3nM
Assay Description:
Inhibition of OATP1B1 (unknown origin) expressed in HEK293 cells using estradiol-17beta-glucuronide substrate
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Target
Bile salt export pump
(Homo sapiens (Human))
King'S College Hospital
Curated by
ChEMBL
Ligand
BDBM50012957
(1-((p-(2-(5-chloro-o-anisamido)ethyl)phenyl)sulfon...)
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Affinity Data
IC50: 1.50E+3nM
Assay Description:
Inhibition of recombinant human BSEP expressed in baculovirus infected sf9 cell membrane vesicles assessed as reduction in ATP or AMP-dependent [3H]-...
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Target
Solute carrier organic anion transporter family member 1B1
(Homo sapiens (Human))
Bristol-Myers Squibb
Curated by
ChEMBL
Ligand
BDBM50012957
(1-((p-(2-(5-chloro-o-anisamido)ethyl)phenyl)sulfon...)
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Affinity Data
IC50: 2.20E+3nM
Assay Description:
Inhibition of OATP1B1 (unknown origin) expressed in HEK293 cells using pitavastatin substrate
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Target
Bile salt export pump
(Rattus norvegicus)
University Hospital
Curated by
ChEMBL
Ligand
BDBM50012957
(1-((p-(2-(5-chloro-o-anisamido)ethyl)phenyl)sulfon...)
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Affinity Data
IC50: 2.80E+3nM
Assay Description:
Inhibition of Sprague-Dawley rat Bsep expressed in plasma membrane vesicles of Sf21 cells assessed as inhibition of ATP-dependent [3H]taurocholate up...
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Target
Bile salt export pump
(Homo sapiens (Human))
King'S College Hospital
Curated by
ChEMBL
Ligand
BDBM50012957
(1-((p-(2-(5-chloro-o-anisamido)ethyl)phenyl)sulfon...)
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Affinity Data
IC50: 5.00E+3nM
Assay Description:
Inhibition of human BSEP overexpressed in Sf9 cell membrane vesicles assessed as uptake of [3H]-taurocholate in presence of ATP measured after 15 to ...
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Target
Bile salt export pump
(Homo sapiens (Human))
King'S College Hospital
Curated by
ChEMBL
Ligand
BDBM50012957
(1-((p-(2-(5-chloro-o-anisamido)ethyl)phenyl)sulfon...)
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Affinity Data
IC50: 5.30E+3nM
Assay Description:
Inhibition of human BSEP expressed in HEK293 cell membrane vesicles assessed as reduction in 3H-TCA uptake incubated for 5 mins by radiodetection met...
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Target
Bile salt export pump
(Homo sapiens (Human))
King'S College Hospital
Curated by
ChEMBL
Ligand
BDBM50012957
(1-((p-(2-(5-chloro-o-anisamido)ethyl)phenyl)sulfon...)
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Affinity Data
IC50: 5.30E+3nM
Assay Description:
Inhibition of human BSEP expressed in plasma membrane vesicles of Sf21 cells assessed as inhibition of ATP-dependent [3H]taurocholate uptake
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Target
Bile salt export pump
(Homo sapiens (Human))
King'S College Hospital
Curated by
ChEMBL
Ligand
BDBM50012957
(1-((p-(2-(5-chloro-o-anisamido)ethyl)phenyl)sulfon...)
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Affinity Data
IC50: 6.10E+3nM
Assay Description:
Inhibition of human BSEP expressed in fall armyworm sf9 cell plasma membrane vesicles assessed as reduction in vesicle-associated [3H]-taurocholate t...
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Target
Bile salt export pump
(Rattus norvegicus)
University Hospital
Curated by
ChEMBL
Ligand
BDBM50012957
(1-((p-(2-(5-chloro-o-anisamido)ethyl)phenyl)sulfon...)
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Affinity Data
IC50: 8.60E+3nM
Assay Description:
TP_TRANSPORTER: inhibition of Taurocholate uptake (Taurocholate: 1 uM) in liver canalicular membrane vesicle from male rat
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Target
NACHT, LRR and PYD domains-containing protein 3
(Mus musculus)
Shandong University
Curated by
ChEMBL
Ligand
BDBM50012957
(1-((p-(2-(5-chloro-o-anisamido)ethyl)phenyl)sulfon...)
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Affinity Data
IC50: 1.00E+4nM
Assay Description:
Inhibition of NLRP3 inflammasome activation in LPS-primed mouse bone marrow derived macrophages preincubated for 15 mins followed by addition of ATP ...
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Target
Bile salt export pump
(Homo sapiens (Human))
King'S College Hospital
Curated by
ChEMBL
Ligand
BDBM50012957
(1-((p-(2-(5-chloro-o-anisamido)ethyl)phenyl)sulfon...)
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Affinity Data
IC50: <1.00E+4nM
Assay Description:
Inhibition of human BSEP expressed in baculovirus transfected fall armyworm Sf21 cell membranes vesicles assessed as reduction in ATP-dependent [3H]-...
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Target
ATP-binding cassette sub-family C member 4
(Homo sapiens (Human))
Amgen
Curated by
ChEMBL
Ligand
BDBM50012957
(1-((p-(2-(5-chloro-o-anisamido)ethyl)phenyl)sulfon...)
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Affinity Data
IC50: 1.05E+4nM
Assay Description:
Inhibition of human MRP4 overexpressed in Sf9 cell membrane vesicles assessed as uptake of [3H]-estradiol-17beta-D-glucuronide in presence of ATP and...
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NACHT, LRR and PYD domains-containing protein 3
(Homo sapiens (Human))
The University Of Manchester
Curated by
ChEMBL
Ligand
BDBM50012957
(1-((p-(2-(5-chloro-o-anisamido)ethyl)phenyl)sulfon...)
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Affinity Data
IC50: 1.20E+4nM
Assay Description:
Inhibition of NLRP3 in LPS activated human monocytes after 30 mins by ELISA analysis in presence of ATP
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Cystic fibrosis transmembrane conductance regulator
(Homo sapiens (Human))
University Joseph Fourier-Grenoble 1/Cnrs
Curated by
ChEMBL
Ligand
BDBM50012957
(1-((p-(2-(5-chloro-o-anisamido)ethyl)phenyl)sulfon...)
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Affinity Data
IC50: 1.50E+4nM
Assay Description:
Inhibition of wild type CFTR expressed in CHO cells by [125I]iodide efflux assay
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Bile salt export pump
(Rattus norvegicus)
University Hospital
Curated by
ChEMBL
Ligand
BDBM50012957
(1-((p-(2-(5-chloro-o-anisamido)ethyl)phenyl)sulfon...)
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Affinity Data
IC50: 1.57E+4nM
Assay Description:
TP_TRANSPORTER: inhibition of Taurocholate uptake (Taurocholate: 1 uM) in liver canalicular membrane vesicle from female rat
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Target
Solute carrier organic anion transporter family member 1B1
(Homo sapiens (Human))
Bristol-Myers Squibb
Curated by
ChEMBL
Ligand
BDBM50012957
(1-((p-(2-(5-chloro-o-anisamido)ethyl)phenyl)sulfon...)
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Affinity Data
IC50: 2.10E+4nM
Assay Description:
Inhibition of OATP1B1 (unknown origin) expressed in HEK293 cells using estrone-3-sulfate substrate
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Target
ATP-binding cassette sub-family C member 3
(Homo sapiens (Human))
Amgen
Curated by
ChEMBL
Ligand
BDBM50012957
(1-((p-(2-(5-chloro-o-anisamido)ethyl)phenyl)sulfon...)
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Affinity Data
IC50: 3.30E+4nM
Assay Description:
Inhibition of human MRP3 overexpressed in Sf9 insect cell membrane vesicles assessed as uptake of [3H]-estradiol-17beta-D-glucuronide in presence of ...
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CDGSH iron-sulfur domain-containing protein 1
(Homo sapiens (Human))
West Virginia University
Curated by
ChEMBL
Ligand
BDBM50012957
(1-((p-(2-(5-chloro-o-anisamido)ethyl)phenyl)sulfon...)
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Affinity Data
IC50: 3.91E+4nM
Assay Description:
Displacement of [3H]rosiglitazone from recombinant human C-terminal His-tagged MitoNEET cytosolic domain (32 to 108 residues) expressed in Escherichi...
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Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human))
University Of Bologna
Curated by
ChEMBL
Ligand
BDBM50012957
(1-((p-(2-(5-chloro-o-anisamido)ethyl)phenyl)sulfon...)
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Affinity Data
IC50: 7.40E+4nM
Assay Description:
K+ channel blocking activity in neuroblastoma cells expressing HERG Kv11.1
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Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human))
University Of Bologna
Curated by
ChEMBL
Ligand
BDBM50012957
(1-((p-(2-(5-chloro-o-anisamido)ethyl)phenyl)sulfon...)
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Affinity Data
IC50: 7.40E+4nM
Assay Description:
Inhibition of human ERG potassium channel
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Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human))
University Of Bologna
Curated by
ChEMBL
Ligand
BDBM50012957
(1-((p-(2-(5-chloro-o-anisamido)ethyl)phenyl)sulfon...)
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Affinity Data
IC50: 7.41E+4nM
Assay Description:
Inhibition of human ERG
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Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human))
University Of Bologna
Curated by
ChEMBL
Ligand
BDBM50012957
(1-((p-(2-(5-chloro-o-anisamido)ethyl)phenyl)sulfon...)
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Affinity Data
IC50: 7.41E+4nM
Assay Description:
Inhibition of human ERG in MCF7 cells
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ATP synthase subunit gamma, mitochondrial
(Bos taurus)
The Bristol-Myers Squibb Pharmaceutical Research Institute
Curated by
ChEMBL
Ligand
BDBM50012957
(1-((p-(2-(5-chloro-o-anisamido)ethyl)phenyl)sulfon...)
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Affinity Data
IC50: >1.00E+5nM
Assay Description:
Inhibitory concentration towards rat mitochondrial F1F0 ATP hydrolase using a pyruvate kinase / lactate dehydrogenase system
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Bile salt export pump
(Homo sapiens (Human))
King'S College Hospital
Curated by
ChEMBL
Ligand
BDBM50012957
(1-((p-(2-(5-chloro-o-anisamido)ethyl)phenyl)sulfon...)
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Affinity Data
IC50: 1.47E+5nM
Assay Description:
TP_TRANSPORTER: increase in dihydrofluorescein intracellular accumulation (dihydrofluorescein: 1 uM) in SK-E2 cells (expressing BSEP)
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Broad substrate specificity ATP-binding cassette transporter ABCG2
(Homo sapiens (Human))
Hospital For Sick Children
Curated by
ChEMBL
Ligand
BDBM50012957
(1-((p-(2-(5-chloro-o-anisamido)ethyl)phenyl)sulfon...)
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Affinity Data
IC50: 1.50E+5nM
Assay Description:
TP_TRANSPORTER: inhibition of mitoxantrone efflux in BCRP-expressing MCF7-MX cells
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Broad substrate specificity ATP-binding cassette transporter ABCG2
(Homo sapiens (Human))
Hospital For Sick Children
Curated by
ChEMBL
Ligand
BDBM50012957
(1-((p-(2-(5-chloro-o-anisamido)ethyl)phenyl)sulfon...)
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Affinity Data
IC50: 1.50E+5nM
Assay Description:
Inhibition of ABCG2 (unknown origin) expressed in human MCF7/MX cells mediated mitoxantrone efflux assessed as intracellular mitoxantrone level prein...
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Cholesteryl ester transfer protein
(Oryctolagus cuniculus)
Al-Zaytoonah Private University Of Jordan
Curated by
ChEMBL
Ligand
BDBM50012957
(1-((p-(2-(5-chloro-o-anisamido)ethyl)phenyl)sulfon...)
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Affinity Data
IC50: 2.39E+5nM
Assay Description:
Inhibition of CETP in rabbit serum after 1 hr by fluorescent cholesteryl esters transfer assay
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Bile salt export pump
(Homo sapiens (Human))
King'S College Hospital
Curated by
ChEMBL
Ligand
BDBM50012957
(1-((p-(2-(5-chloro-o-anisamido)ethyl)phenyl)sulfon...)
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Affinity Data
IC50: 2.60E+5nM
Assay Description:
TP_TRANSPORTER: increase in bodipy intracellular accumulation (Bodipy: 0.2 uM) in SK-E2 cells (expressing BSEP)
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Beta-lactamase
(Escherichia coli)
Northwestern University
Curated by
ChEMBL
Ligand
BDBM50012957
(1-((p-(2-(5-chloro-o-anisamido)ethyl)phenyl)sulfon...)
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Affinity Data
IC50: 3.00E+5nM
Assay Description:
Compound was tested for the inhibition of beta-lactamase
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Chymotrypsinogen A
(Bos taurus (bovine))
Northwestern University
Curated by
ChEMBL
Ligand
BDBM50012957
(1-((p-(2-(5-chloro-o-anisamido)ethyl)phenyl)sulfon...)
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IC50: 3.60E+5nM
Assay Description:
Compound was tested for the inhibition of Chymotrypsinogen
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Malate dehydrogenase, cytoplasmic
(Homo sapiens (Human))
Northwestern University
Curated by
ChEMBL
Ligand
BDBM50012957
(1-((p-(2-(5-chloro-o-anisamido)ethyl)phenyl)sulfon...)
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IC50: 4.00E+5nM
Assay Description:
Inhibition of malate dehydrogenase (MDH)
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Potassium channel subfamily K member 2
(Homo sapiens (Human))
Korea Institute of Science and Technology
Ligand
BDBM50012957
(1-((p-(2-(5-chloro-o-anisamido)ethyl)phenyl)sulfon...)
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Affinity Data
EC50: 6.40E+4nM
pH: 7.3 T: 2°C
Assay Description:
The hTREK1 stable cell lines were seeded at a density of 10 000 cells/well in a 12-well plate. Whole-cell membrane currents were amplified using the ...
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Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human))
Seoul National University
Curated by
ChEMBL
Ligand
BDBM50012957
(1-((p-(2-(5-chloro-o-anisamido)ethyl)phenyl)sulfon...)
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Affinity Data
EC50: 2.30E+3nM
Assay Description:
Agonist activity at PPARgamma in human BMMSC cells assessed as promotion of adiponectin secretion by measuring increase in adiponectin level in prese...
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