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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
40
hits in this display
Target
5-hydroxytryptamine receptor 2A
(Rattus norvegicus (rat))
University of Turku
Curated by
PDSP K
i
Database
Ligand
BDBM22870
(13-chloro-10-(piperazin-1-yl)-2-oxa-9-azatricyclo[...)
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Affinity Data
Ki: 1nM
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Target
5-hydroxytryptamine receptor 2A
(Homo sapiens (Human))
University Of Li£Ge
Curated by
ChEMBL
Ligand
BDBM22870
(13-chloro-10-(piperazin-1-yl)-2-oxa-9-azatricyclo[...)
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Affinity Data
Ki: 1.77nM
Assay Description:
Displacement of [3H]ketanserin from human recombinant 5HT2A receptor expressed in CHO cells after 60 mins by liquid scintillation counting
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Target
5-hydroxytryptamine receptor 2C
(Rattus norvegicus (Rat))
Case Western Reserve University
Curated by
PDSP K
i
Database
Ligand
BDBM22870
(13-chloro-10-(piperazin-1-yl)-2-oxa-9-azatricyclo[...)
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Affinity Data
Ki: 1.99nM
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Target
5-hydroxytryptamine receptor 2C
(Rattus norvegicus (Rat))
Case Western Reserve University
Curated by
PDSP K
i
Database
Ligand
BDBM22870
(13-chloro-10-(piperazin-1-yl)-2-oxa-9-azatricyclo[...)
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Affinity Data
Ki: 2nM
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Target
D(4) dopamine receptor
(Homo sapiens (Human))
University of Toronto
Curated by
PDSP K
i
Database
Ligand
BDBM22870
(13-chloro-10-(piperazin-1-yl)-2-oxa-9-azatricyclo[...)
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Affinity Data
Ki: 2nM
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Target
D(2) dopamine receptor
(Homo sapiens (Human))
Acadia Pharmaceuticals
Curated by
PDSP K
i
Database
Ligand
BDBM22870
(13-chloro-10-(piperazin-1-yl)-2-oxa-9-azatricyclo[...)
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Affinity Data
Ki: 3.60nM
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Target
5-hydroxytryptamine receptor 6
(RAT)
Case Western Reserve University
Curated by
PDSP K
i
Database
Ligand
BDBM22870
(13-chloro-10-(piperazin-1-yl)-2-oxa-9-azatricyclo[...)
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Affinity Data
Ki: 6nM
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Target
5-hydroxytryptamine receptor 6
(RAT)
Case Western Reserve University
Curated by
PDSP K
i
Database
Ligand
BDBM22870
(13-chloro-10-(piperazin-1-yl)-2-oxa-9-azatricyclo[...)
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Affinity Data
Ki: 6.31nM
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Target
D(3) dopamine receptor
(Homo sapiens (Human))
Acadia Pharmaceuticals
Curated by
PDSP K
i
Database
Ligand
BDBM22870
(13-chloro-10-(piperazin-1-yl)-2-oxa-9-azatricyclo[...)
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Affinity Data
Ki: 11nM
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Target
D(2) dopamine receptor
(Homo sapiens (Human))
Acadia Pharmaceuticals
Curated by
PDSP K
i
Database
Ligand
BDBM22870
(13-chloro-10-(piperazin-1-yl)-2-oxa-9-azatricyclo[...)
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Affinity Data
Ki: 16nM
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Target
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human))
Mayo Clinic
Curated by
PDSP K
i
Database
Ligand
BDBM22870
(13-chloro-10-(piperazin-1-yl)-2-oxa-9-azatricyclo[...)
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Affinity Data
Ki: 16nM
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Target
D(2) dopamine receptor
(Rattus norvegicus (rat))
Case Western Reserve University
Curated by
PDSP K
i
Database
Ligand
BDBM22870
(13-chloro-10-(piperazin-1-yl)-2-oxa-9-azatricyclo[...)
Copy SMILES
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Affinity Data
Ki: 20nM
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Target
5-hydroxytryptamine receptor 6
(RAT)
Case Western Reserve University
Curated by
PDSP K
i
Database
Ligand
BDBM22870
(13-chloro-10-(piperazin-1-yl)-2-oxa-9-azatricyclo[...)
Copy SMILES
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Affinity Data
Ki: 30.2nM
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Target
5-hydroxytryptamine receptor 6
(RAT)
Case Western Reserve University
Curated by
PDSP K
i
Database
Ligand
BDBM22870
(13-chloro-10-(piperazin-1-yl)-2-oxa-9-azatricyclo[...)
Copy SMILES
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Affinity Data
Ki: 30.4nM
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Target
D(3) dopamine receptor
(Homo sapiens (Human))
Acadia Pharmaceuticals
Curated by
PDSP K
i
Database
Ligand
BDBM22870
(13-chloro-10-(piperazin-1-yl)-2-oxa-9-azatricyclo[...)
Copy SMILES
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Affinity Data
Ki: 31nM
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Target
D(4) dopamine receptor
(Homo sapiens (Human))
University of Toronto
Curated by
PDSP K
i
Database
Ligand
BDBM22870
(13-chloro-10-(piperazin-1-yl)-2-oxa-9-azatricyclo[...)
Copy SMILES
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Affinity Data
Ki: 34nM
Assay Description:
Displacement of [3H]-YM09151-2 from human cloned dopamine D4 receptor expressed in insect Sf9 cells after 60 mins by liquid scintillation counting
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Target
D(2) dopamine receptor
(Homo sapiens (Human))
Acadia Pharmaceuticals
Curated by
PDSP K
i
Database
Ligand
BDBM22870
(13-chloro-10-(piperazin-1-yl)-2-oxa-9-azatricyclo[...)
Copy SMILES
Copy InChI
Affinity Data
Ki: 38nM
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Target
5-hydroxytryptamine receptor 7
(Rattus norvegicus (rat))
Friedrich-Schiller-University Jena
Curated by
PDSP K
i
Database
Ligand
BDBM22870
(13-chloro-10-(piperazin-1-yl)-2-oxa-9-azatricyclo[...)
Copy SMILES
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Affinity Data
Ki: 39.8nM
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Target
D(4) dopamine receptor
(Homo sapiens (Human))
University of Toronto
Curated by
PDSP K
i
Database
Ligand
BDBM22870
(13-chloro-10-(piperazin-1-yl)-2-oxa-9-azatricyclo[...)
Copy SMILES
Copy InChI
Affinity Data
Ki: 40nM
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Target
5-hydroxytryptamine receptor 7
(Rattus norvegicus (rat))
Friedrich-Schiller-University Jena
Curated by
PDSP K
i
Database
Ligand
BDBM22870
(13-chloro-10-(piperazin-1-yl)-2-oxa-9-azatricyclo[...)
Copy SMILES
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Affinity Data
Ki: 40.6nM
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Target
5-hydroxytryptamine receptor 6
(Homo sapiens (Human))
University of Washington
Curated by
PDSP K
i
Database
Ligand
BDBM22870
(13-chloro-10-(piperazin-1-yl)-2-oxa-9-azatricyclo[...)
Copy SMILES
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Affinity Data
Ki: 50nM
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Target
Sodium-dependent serotonin transporter
(Homo sapiens (Human))
Mayo Clinic
Curated by
PDSP K
i
Database
Ligand
BDBM22870
(13-chloro-10-(piperazin-1-yl)-2-oxa-9-azatricyclo[...)
Copy SMILES
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Affinity Data
Ki: 58nM
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Target
D(4) dopamine receptor
(RAT)
Case Western Reserve University
Curated by
PDSP K
i
Database
Ligand
BDBM22870
(13-chloro-10-(piperazin-1-yl)-2-oxa-9-azatricyclo[...)
Copy SMILES
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Affinity Data
Ki: 92nM
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Target
5-hydroxytryptamine receptor 7
(GUINEA PIG)
Syntex Discovery Research
Curated by
PDSP K
i
Database
Ligand
BDBM22870
(13-chloro-10-(piperazin-1-yl)-2-oxa-9-azatricyclo[...)
Copy SMILES
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Affinity Data
Ki: 186nM
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Target
5-hydroxytryptamine receptor 1A
(Homo sapiens (Human))
University Of Li£Ge
Curated by
ChEMBL
Ligand
BDBM22870
(13-chloro-10-(piperazin-1-yl)-2-oxa-9-azatricyclo[...)
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Affinity Data
Ki: 221nM
Assay Description:
Displacement of [3H]8-OH-DPAT from human recombinant 5HT1A receptor expressed in CHO cells after 60 mins by liquid scintillation counting
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Target
Sodium-dependent serotonin transporter
(Rattus norvegicus (rat))
University of Turku
Curated by
PDSP K
i
Database
Ligand
BDBM22870
(13-chloro-10-(piperazin-1-yl)-2-oxa-9-azatricyclo[...)
Copy SMILES
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Affinity Data
Ki: 290nM
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Target
Sodium-dependent serotonin transporter
(Rattus norvegicus (rat))
University of Turku
Curated by
PDSP K
i
Database
Ligand
BDBM22870
(13-chloro-10-(piperazin-1-yl)-2-oxa-9-azatricyclo[...)
Copy SMILES
Copy InChI
Affinity Data
Ki: 290nM
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Target
Sodium-dependent serotonin transporter
(Rattus norvegicus (rat))
University of Turku
Curated by
PDSP K
i
Database
Ligand
BDBM22870
(13-chloro-10-(piperazin-1-yl)-2-oxa-9-azatricyclo[...)
Copy SMILES
Copy InChI
Affinity Data
Ki: 409nM
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Target
5-hydroxytryptamine receptor 7
(Homo sapiens (Human))
Virginia Commonwealth University
Curated by
ChEMBL
Ligand
BDBM22870
(13-chloro-10-(piperazin-1-yl)-2-oxa-9-azatricyclo[...)
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Affinity Data
Ki: 500nM
Assay Description:
Binding affinity towards human 5-hydroxytryptamine 7 receptor
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Target
5-hydroxytryptamine receptor 7
(GUINEA PIG)
Syntex Discovery Research
Curated by
PDSP K
i
Database
Ligand
BDBM22870
(13-chloro-10-(piperazin-1-yl)-2-oxa-9-azatricyclo[...)
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Affinity Data
Ki: 1.41E+3nM
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Target
Sodium-dependent dopamine transporter
(Homo sapiens (Human))
Mayo Clinic
Curated by
PDSP K
i
Database
Ligand
BDBM22870
(13-chloro-10-(piperazin-1-yl)-2-oxa-9-azatricyclo[...)
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Affinity Data
Ki: 4.31E+3nM
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Target
Histamine H4 receptor
(Homo sapiens (Human))
Vrije Universiteit Amsterdam
Ligand
BDBM22870
(13-chloro-10-(piperazin-1-yl)-2-oxa-9-azatricyclo[...)
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Affinity Data
Ki: 5.01E+3nM ΔG°: -31.5kJ/mole
pH: 7.4 T: 2°C
Assay Description:
Ligand displacement assays were performed on The SK-N-MC/hH4R cell homogenates. Retained radioactivity was determined by liquid scintillation countin...
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Target
Sulfotransferase 1A1
(Homo sapiens (Human))
Albert Einstein College of Medicine
Ligand
BDBM22870
(13-chloro-10-(piperazin-1-yl)-2-oxa-9-azatricyclo[...)
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Affinity Data
Ki: 3.50E+4nM ΔG°: -23.5kJ/mole
pH: 7.5 T: 2°C
Assay Description:
Reaction conditions were as follows: SULT1A1 or 2A1 (50 nM), PnP (3.0 or 100 uM, respectively; 2 x Km PnP), amoxipine or protriptyline (0, 50, 100, o...
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Target
Sulfotransferase 2A1
(Homo sapiens (Human))
Albert Einstein College of Medicine
Ligand
BDBM22870
(13-chloro-10-(piperazin-1-yl)-2-oxa-9-azatricyclo[...)
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Affinity Data
Ki: 1.25E+5nM ΔG°: -20.6kJ/mole
pH: 7.5 T: 2°C
Assay Description:
Reaction conditions were as follows: SULT1A1 or 2A1 (50 nM), PnP (3.0 or 100 uM, respectively; 2 x Km PnP), amoxipine or protriptyline (0, 50, 100, o...
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Voltage-dependent N-type calcium channel subunit alpha-1B
(Homo sapiens (Human))
The University Of Queensland
Curated by
ChEMBL
Ligand
BDBM22870
(13-chloro-10-(piperazin-1-yl)-2-oxa-9-azatricyclo[...)
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Affinity Data
IC50: 2.70E+4nM
Assay Description:
Inhibition of endogenous human CaV2.2 in human SH-SY5Y cells in presence of nifedipine by Calcium 4 dye based calcium influx fluorescence-imaging ass...
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Bile salt export pump
(Homo sapiens (Human))
Amgen
Curated by
ChEMBL
Ligand
BDBM22870
(13-chloro-10-(piperazin-1-yl)-2-oxa-9-azatricyclo[...)
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IC50: >1.33E+5nM
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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ATP-binding cassette sub-family C member 2
(Homo sapiens (Human))
Amgen
Curated by
ChEMBL
Ligand
BDBM22870
(13-chloro-10-(piperazin-1-yl)-2-oxa-9-azatricyclo[...)
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IC50: >1.33E+5nM
Assay Description:
Inhibition of human MRP2 overexpressed in Sf9 cell membrane vesicles assessed as uptake of [3H]-estradiol-17beta-D-glucuronide in presence of ATP and...
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ATP-binding cassette sub-family C member 3
(Homo sapiens (Human))
Amgen
Curated by
ChEMBL
Ligand
BDBM22870
(13-chloro-10-(piperazin-1-yl)-2-oxa-9-azatricyclo[...)
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IC50: >1.33E+5nM
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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ATP-binding cassette sub-family C member 4
(Homo sapiens (Human))
Amgen
Curated by
ChEMBL
Ligand
BDBM22870
(13-chloro-10-(piperazin-1-yl)-2-oxa-9-azatricyclo[...)
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Affinity Data
IC50: >1.33E+5nM
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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Bile salt export pump
(Homo sapiens (Human))
Amgen
Curated by
ChEMBL
Ligand
BDBM22870
(13-chloro-10-(piperazin-1-yl)-2-oxa-9-azatricyclo[...)
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Affinity Data
IC50: 2.30E+5nM
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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