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Compile Data Set for Download or QSAR

Found 120 hits Enz. Inhib. hit(s) with all data for entry = 50014998   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Monoamine transporters; Norepinephrine & serotonin


(Rattus norvegicus (rat))
BDBM50150101
PNG
(CHEMBL419240 | [2-(2,3-Dihydro-benzo[1,4]dioxin-5-...)
Show SMILES Fc1ccc2[nH]cc(CCCNCCOc3cccc4OCCOc34)c2c1
Show InChI InChI=1S/C21H23FN2O3/c22-16-6-7-18-17(13-16)15(14-24-18)3-2-8-23-9-10-25-19-4-1-5-20-21(19)27-12-11-26-20/h1,4-7,13-14,23-24H,2-3,8-12H2
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0.0800n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against serotonin transporter in rat cortical tissues using radioligand [3H]-paroxetine


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
Monoamine transporters; Norepinephrine & serotonin


(Rattus norvegicus (rat))
BDBM50150103
PNG
(CHEMBL338520 | [2-(6-Chloro-1H-benzoimidazol-4-ylo...)
Show SMILES Fc1ccc2[nH]cc(CCCNCCOc3cc(Cl)cc4[nH]cnc34)c2c1
Show InChI InChI=1S/C20H20ClFN4O/c21-14-8-18-20(26-12-25-18)19(9-14)27-7-6-23-5-1-2-13-11-24-17-4-3-15(22)10-16(13)17/h3-4,8-12,23-24H,1-2,5-7H2,(H,25,26)
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0.390n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against serotonin transporter in rat cortical tissues using radioligand [3H]-paroxetine


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
Monoamine transporters; Norepinephrine & serotonin


(Rattus norvegicus (rat))
BDBM50150096
PNG
(CHEMBL330827 | [2-(1H-Benzoimidazol-4-yloxy)-ethyl...)
Show SMILES Fc1ccc2[nH]cc(CCCNCCOc3cccc4nc[nH]c34)c2c1
Show InChI InChI=1S/C20H21FN4O/c21-15-6-7-17-16(11-15)14(12-23-17)3-2-8-22-9-10-26-19-5-1-4-18-20(19)25-13-24-18/h1,4-7,11-13,22-23H,2-3,8-10H2,(H,24,25)
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0.390n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against serotonin transporter in rat cortical tissues using radioligand [3H]-paroxetine


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
Monoamine transporters; Norepinephrine & serotonin


(Rattus norvegicus (rat))
BDBM50150105
PNG
(CHEMBL124069 | [2-(6-Fluoro-chroman-8-yloxy)-ethyl...)
Show SMILES Fc1cc2CCCOc2c(OCCNCCCc2c[nH]c3ccc(F)cc23)c1
Show InChI InChI=1S/C22H24F2N2O2/c23-17-5-6-20-19(12-17)16(14-26-20)3-1-7-25-8-10-27-21-13-18(24)11-15-4-2-9-28-22(15)21/h5-6,11-14,25-26H,1-4,7-10H2
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0.470n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against serotonin transporter in rat cortical tissues using radioligand [3H]-paroxetine


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
Monoamine transporters; Norepinephrine & serotonin


(Rattus norvegicus (rat))
BDBM50150082
PNG
(CHEMBL126484 | [3-(5-Fluoro-1H-indol-3-yl)-propyl]...)
Show SMILES COc1ccccc1OCCNCCCc1c[nH]c2ccc(F)cc12
Show InChI InChI=1S/C20H23FN2O2/c1-24-19-6-2-3-7-20(19)25-12-11-22-10-4-5-15-14-23-18-9-8-16(21)13-17(15)18/h2-3,6-9,13-14,22-23H,4-5,10-12H2,1H3
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0.480n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against serotonin transporter in rat cortical tissues using radioligand [3H]-paroxetine


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
Monoamine transporters; Norepinephrine & serotonin


(Rattus norvegicus (rat))
BDBM50150099
PNG
(CHEMBL339490 | [2-(7-Fluoro-2,3-dihydro-benzo[1,4]...)
Show SMILES Fc1ccc2[nH]cc(CCCNCCOc3cc(F)cc4OCCOc34)c2c1
Show InChI InChI=1S/C21H22F2N2O3/c22-15-3-4-18-17(10-15)14(13-25-18)2-1-5-24-6-7-26-19-11-16(23)12-20-21(19)28-9-8-27-20/h3-4,10-13,24-25H,1-2,5-9H2
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0.490n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against serotonin transporter in rat cortical tissues using radioligand [3H]-paroxetine


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (Human))
BDBM50150107
PNG
(CHEMBL340705 | [3-(1H-Indol-3-yl)-propyl]-[2-(quin...)
Show SMILES C(CNCCOc1cccc2cccnc12)Cc1c[nH]c2ccccc12
Show InChI InChI=1S/C22H23N3O/c1-2-10-20-19(9-1)18(16-25-20)8-4-12-23-14-15-26-21-11-3-6-17-7-5-13-24-22(17)21/h1-3,5-7,9-11,13,16,23,25H,4,8,12,14-15H2
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0.540n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against human 5-hydroxytryptamine 1A receptor in CHO cells labeled with [3H]-8-OH-DPAT radioligand


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (Human))
BDBM50150096
PNG
(CHEMBL330827 | [2-(1H-Benzoimidazol-4-yloxy)-ethyl...)
Show SMILES Fc1ccc2[nH]cc(CCCNCCOc3cccc4nc[nH]c34)c2c1
Show InChI InChI=1S/C20H21FN4O/c21-15-6-7-17-16(11-15)14(12-23-17)3-2-8-22-9-10-26-19-5-1-4-18-20(19)25-13-24-18/h1,4-7,11-13,22-23H,2-3,8-10H2,(H,24,25)
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0.690n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against human 5-hydroxytryptamine 1A receptor in CHO cells labeled with [3H]-8-OH-DPAT radioligand


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (Human))
BDBM50150101
PNG
(CHEMBL419240 | [2-(2,3-Dihydro-benzo[1,4]dioxin-5-...)
Show SMILES Fc1ccc2[nH]cc(CCCNCCOc3cccc4OCCOc34)c2c1
Show InChI InChI=1S/C21H23FN2O3/c22-16-6-7-18-17(13-16)15(14-24-18)3-2-8-23-9-10-25-19-4-1-5-20-21(19)27-12-11-26-20/h1,4-7,13-14,23-24H,2-3,8-12H2
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0.700n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against human 5-hydroxytryptamine 1A receptor in CHO cells labeled with [3H]-8-OH-DPAT radioligand


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (Human))
BDBM50150092
PNG
(CHEMBL331609 | [2-(1H-Benzoimidazol-4-yloxy)-ethyl...)
Show SMILES C(CNCCOc1cccc2nc[nH]c12)Cc1c[nH]c2ccccc12
Show InChI InChI=1S/C20H22N4O/c1-2-7-17-16(6-1)15(13-22-17)5-4-10-21-11-12-25-19-9-3-8-18-20(19)24-14-23-18/h1-3,6-9,13-14,21-22H,4-5,10-12H2,(H,23,24)
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0.870n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against human 5-hydroxytryptamine 1A receptor in CHO cells labeled with [3H]-8-OH-DPAT radioligand


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (Human))
BDBM86708
PNG
(CAS_146714-97-8 | CHEMBL31354 | CHEMBL514874 | CHE...)
Show SMILES COc1ccccc1N1CCN(CCN(C(=O)C2CCCCC2)c2ccccn2)CC1
Show InChI InChI=1S/C25H34N4O2/c1-31-23-12-6-5-11-22(23)28-18-15-27(16-19-28)17-20-29(24-13-7-8-14-26-24)25(30)21-9-3-2-4-10-21/h5-8,11-14,21H,2-4,9-10,15-20H2,1H3
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0.960n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against human 5-hydroxytryptamine 1A receptor in CHO cells labeled with [3H]-8-OH-DPAT radioligand


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
Monoamine transporters; Norepinephrine & serotonin


(Rattus norvegicus (rat))
BDBM50150081
PNG
(CHEMBL126536 | [3-(5-Fluoro-1H-indol-3-yl)-propyl]...)
Show SMILES Fc1ccc2[nH]cc(CCCNCCOc3cccc4ncccc34)c2c1
Show InChI InChI=1S/C22H22FN3O/c23-17-8-9-21-19(14-17)16(15-26-21)4-2-10-24-12-13-27-22-7-1-6-20-18(22)5-3-11-25-20/h1,3,5-9,11,14-15,24,26H,2,4,10,12-13H2
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1.10n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against serotonin transporter in rat cortical tissues using radioligand [3H]-paroxetine


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
Monoamine transporters; Norepinephrine & serotonin


(Rattus norvegicus (rat))
BDBM50150097
PNG
(CHEMBL339810 | [2-(5-Fluoro-2,3-dihydro-benzofuran...)
Show SMILES Fc1cc2CCOc2c(OCCNCCCc2c[nH]c3ccc(F)cc23)c1
Show InChI InChI=1S/C21H22F2N2O2/c22-16-3-4-19-18(11-16)15(13-25-19)2-1-6-24-7-9-26-20-12-17(23)10-14-5-8-27-21(14)20/h3-4,10-13,24-25H,1-2,5-9H2
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1.17n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against serotonin transporter in rat cortical tissues using radioligand [3H]-paroxetine


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
Monoamine transporters; Norepinephrine & serotonin


(Rattus norvegicus (rat))
BDBM50150090
PNG
(CHEMBL125902 | [3-(5-Fluoro-1H-indol-3-yl)-propyl]...)
Show SMILES Fc1ccc2[nH]cc(CCCNCCOc3cccc4nccnc34)c2c1
Show InChI InChI=1S/C21H21FN4O/c22-16-6-7-18-17(13-16)15(14-26-18)3-2-8-23-11-12-27-20-5-1-4-19-21(20)25-10-9-24-19/h1,4-7,9-10,13-14,23,26H,2-3,8,11-12H2
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1.20n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against serotonin transporter in rat cortical tissues using radioligand [3H]-paroxetine


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (Human))
BDBM50150082
PNG
(CHEMBL126484 | [3-(5-Fluoro-1H-indol-3-yl)-propyl]...)
Show SMILES COc1ccccc1OCCNCCCc1c[nH]c2ccc(F)cc12
Show InChI InChI=1S/C20H23FN2O2/c1-24-19-6-2-3-7-20(19)25-12-11-22-10-4-5-15-14-23-18-9-8-16(21)13-17(15)18/h2-3,6-9,13-14,22-23H,4-5,10-12H2,1H3
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1.30n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against human 5-hydroxytryptamine 1A receptor in CHO cells labeled with [3H]-8-OH-DPAT radioligand


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
Monoamine transporters; Norepinephrine & serotonin


(Rattus norvegicus (rat))
BDBM50150086
PNG
(CHEMBL127171 | [3-(5-Fluoro-1H-indol-3-yl)-propyl]...)
Show SMILES COc1ccc(F)cc1OCCNCCCc1c[nH]c2ccc(F)cc12
Show InChI InChI=1S/C20H22F2N2O2/c1-25-19-7-5-16(22)12-20(19)26-10-9-23-8-2-3-14-13-24-18-6-4-15(21)11-17(14)18/h4-7,11-13,23-24H,2-3,8-10H2,1H3
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1.36n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against serotonin transporter in rat cortical tissues using radioligand [3H]-paroxetine


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (Human))
BDBM50150085
PNG
(CHEMBL126424 | [3-(5-Fluoro-1H-indol-3-yl)-propyl]...)
Show SMILES Fc1ccc2[nH]cc(CCCNCCOc3cccc4[nH]ccc34)c2c1
Show InChI InChI=1S/C21H22FN3O/c22-16-6-7-20-18(13-16)15(14-25-20)3-2-9-23-11-12-26-21-5-1-4-19-17(21)8-10-24-19/h1,4-8,10,13-14,23-25H,2-3,9,11-12H2
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1.5n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against human 5-hydroxytryptamine 1A receptor in CHO cells labeled with [3H]-8-OH-DPAT radioligand


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (Human))
BDBM50150094
PNG
(CHEMBL338982 | [2-(2,3-Dihydro-benzofuran-7-yloxy)...)
Show SMILES Fc1ccc2[nH]cc(CCCNCCOc3cccc4CCOc34)c2c1
Show InChI InChI=1S/C21H23FN2O2/c22-17-6-7-19-18(13-17)16(14-24-19)4-2-9-23-10-12-25-20-5-1-3-15-8-11-26-21(15)20/h1,3,5-7,13-14,23-24H,2,4,8-12H2
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1.60n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against human 5-hydroxytryptamine 1A receptor in CHO cells labeled with [3H]-8-OH-DPAT radioligand


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (Human))
BDBM50150098
PNG
(CHEMBL126407 | [2-(Benzofuran-7-yloxy)-ethyl]-[3-(...)
Show SMILES Fc1ccc2[nH]cc(CCCNCCOc3cccc4ccoc34)c2c1
Show InChI InChI=1S/C21H21FN2O2/c22-17-6-7-19-18(13-17)16(14-24-19)4-2-9-23-10-12-25-20-5-1-3-15-8-11-26-21(15)20/h1,3,5-8,11,13-14,23-24H,2,4,9-10,12H2
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1.60n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against human 5-hydroxytryptamine 1A receptor in CHO cells labeled with [3H]-8-OH-DPAT radioligand


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
Monoamine transporters; Norepinephrine & serotonin


(Rattus norvegicus (rat))
BDBM50150094
PNG
(CHEMBL338982 | [2-(2,3-Dihydro-benzofuran-7-yloxy)...)
Show SMILES Fc1ccc2[nH]cc(CCCNCCOc3cccc4CCOc34)c2c1
Show InChI InChI=1S/C21H23FN2O2/c22-17-6-7-19-18(13-17)16(14-24-19)4-2-9-23-10-12-25-20-5-1-3-15-8-11-26-21(15)20/h1,3,5-7,13-14,23-24H,2,4,8-12H2
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1.67n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against serotonin transporter in rat cortical tissues using radioligand [3H]-paroxetine


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
Monoamine transporters; Norepinephrine & serotonin


(Rattus norvegicus (rat))
BDBM50150085
PNG
(CHEMBL126424 | [3-(5-Fluoro-1H-indol-3-yl)-propyl]...)
Show SMILES Fc1ccc2[nH]cc(CCCNCCOc3cccc4[nH]ccc34)c2c1
Show InChI InChI=1S/C21H22FN3O/c22-16-6-7-20-18(13-16)15(14-25-20)3-2-9-23-11-12-26-21-5-1-4-19-17(21)8-10-24-19/h1,4-8,10,13-14,23-25H,2-3,9,11-12H2
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2n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against serotonin transporter in rat cortical tissues using radioligand [3H]-paroxetine


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
Monoamine transporters; Norepinephrine & serotonin


(Rattus norvegicus (rat))
BDBM50150080
PNG
(CHEMBL340895 | [2-(5-Fluoro-benzofuran-7-yloxy)-et...)
Show SMILES Fc1ccc2[nH]cc(CCCNCCOc3cc(F)cc4ccoc34)c2c1
Show InChI InChI=1S/C21H20F2N2O2/c22-16-3-4-19-18(11-16)15(13-25-19)2-1-6-24-7-9-26-20-12-17(23)10-14-5-8-27-21(14)20/h3-5,8,10-13,24-25H,1-2,6-7,9H2
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2.20n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against serotonin transporter in rat cortical tissues using radioligand [3H]-paroxetine


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (Human))
BDBM50150100
PNG
(CHEMBL340301 | [2-(1H-Indol-4-yloxy)-ethyl]-[3-(1H...)
Show SMILES C(CNCCOc1cccc2[nH]ccc12)Cc1c[nH]c2ccccc12
Show InChI InChI=1S/C21H23N3O/c1-2-7-19-17(6-1)16(15-24-19)5-4-11-22-13-14-25-21-9-3-8-20-18(21)10-12-23-20/h1-3,6-10,12,15,22-24H,4-5,11,13-14H2
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2.5n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against human 5-hydroxytryptamine 1A receptor in CHO cells labeled with [3H]-8-OH-DPAT radioligand


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
Monoamine transporters; Norepinephrine & serotonin


(Rattus norvegicus (rat))
BDBM30130
PNG
(CHEMBL1201082 | CHEMBL41 | Fluoxetin | Fluoxetine ...)
Show SMILES CNCCC(Oc1ccc(cc1)C(F)(F)F)c1ccccc1
Show InChI InChI=1S/C17H18F3NO/c1-21-12-11-16(13-5-3-2-4-6-13)22-15-9-7-14(8-10-15)17(18,19)20/h2-10,16,21H,11-12H2,1H3
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2.72n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against serotonin transporter in rat cortical tissues using radioligand [3H]-paroxetine


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (Human))
BDBM50150079
PNG
(CHEMBL338587 | [4-(1H-Indol-3-yl)-butyl]-[2-(1H-in...)
Show SMILES C(CCc1c[nH]c2ccccc12)CNCCOc1cccc2[nH]ccc12
Show InChI InChI=1S/C22H25N3O/c1-2-8-20-18(7-1)17(16-25-20)6-3-4-12-23-14-15-26-22-10-5-9-21-19(22)11-13-24-21/h1-2,5,7-11,13,16,23-25H,3-4,6,12,14-15H2
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4.20n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against human 5-hydroxytryptamine 1A receptor in CHO cells labeled with [3H]-8-OH-DPAT radioligand


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
Monoamine transporters; Norepinephrine & serotonin


(Rattus norvegicus (rat))
BDBM50150093
PNG
(CHEMBL340873 | [2-(6-Fluoro-chroman-8-yloxy)-ethyl...)
Show SMILES Fc1ccc2[nH]cc(CCNCCOc3cc(F)cc4CCCOc34)c2c1
Show InChI InChI=1S/C21H22F2N2O2/c22-16-3-4-19-18(11-16)15(13-25-19)5-6-24-7-9-26-20-12-17(23)10-14-2-1-8-27-21(14)20/h3-4,10-13,24-25H,1-2,5-9H2
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5n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against serotonin transporter in rat cortical tissues using radioligand [3H]-paroxetine


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
Monoamine transporters; Norepinephrine & serotonin


(Rattus norvegicus (rat))
BDBM50150098
PNG
(CHEMBL126407 | [2-(Benzofuran-7-yloxy)-ethyl]-[3-(...)
Show SMILES Fc1ccc2[nH]cc(CCCNCCOc3cccc4ccoc34)c2c1
Show InChI InChI=1S/C21H21FN2O2/c22-17-6-7-19-18(13-17)16(14-24-19)4-2-9-23-10-12-25-20-5-1-3-15-8-11-26-21(15)20/h1,3,5-8,11,13-14,23-24H,2,4,9-10,12H2
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5.80n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against serotonin transporter in rat cortical tissues using radioligand [3H]-paroxetine


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (Human))
BDBM50150084
PNG
(CHEMBL124700 | [2-(2,3-Dihydro-benzo[1,4]dioxin-5-...)
Show SMILES Fc1ccc2[nH]cc(CCNCCOc3cccc4OCCOc34)c2c1
Show InChI InChI=1S/C20H21FN2O3/c21-15-4-5-17-16(12-15)14(13-23-17)6-7-22-8-9-24-18-2-1-3-19-20(18)26-11-10-25-19/h1-5,12-13,22-23H,6-11H2
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5.80n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against human 5-hydroxytryptamine 1A receptor in CHO cells labeled with [3H]-8-OH-DPAT radioligand


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
Monoamine transporters; Norepinephrine & serotonin


(Rattus norvegicus (rat))
BDBM50150106
PNG
(CHEMBL124638 | [2-(6-Fluoro-chroman-8-yloxy)-ethyl...)
Show SMILES Fc1cc2CCCOc2c(OCCNCCc2c[nH]c3ccccc23)c1
Show InChI InChI=1S/C21H23FN2O2/c22-17-12-15-4-3-10-26-21(15)20(13-17)25-11-9-23-8-7-16-14-24-19-6-2-1-5-18(16)19/h1-2,5-6,12-14,23-24H,3-4,7-11H2
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6.80n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against serotonin transporter in rat cortical tissues using radioligand [3H]-paroxetine


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (Human))
BDBM50150088
PNG
(CHEMBL124818 | [4-(1H-Indol-3-yl)-butyl]-[2-(2-met...)
Show SMILES COc1ccccc1OCCNCCCCc1c[nH]c2ccccc12
Show InChI InChI=1S/C21H26N2O2/c1-24-20-11-4-5-12-21(20)25-15-14-22-13-7-6-8-17-16-23-19-10-3-2-9-18(17)19/h2-5,9-12,16,22-23H,6-8,13-15H2,1H3
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7.70n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against human 5-hydroxytryptamine 1A receptor in CHO cells labeled with [3H]-8-OH-DPAT radioligand


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (Human))
BDBM50150106
PNG
(CHEMBL124638 | [2-(6-Fluoro-chroman-8-yloxy)-ethyl...)
Show SMILES Fc1cc2CCCOc2c(OCCNCCc2c[nH]c3ccccc23)c1
Show InChI InChI=1S/C21H23FN2O2/c22-17-12-15-4-3-10-26-21(15)20(13-17)25-11-9-23-8-7-16-14-24-19-6-2-1-5-18(16)19/h1-2,5-6,12-14,23-24H,3-4,7-11H2
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8.5n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against human 5-hydroxytryptamine 1A receptor in CHO cells labeled with [3H]-8-OH-DPAT radioligand


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (Human))
BDBM50150090
PNG
(CHEMBL125902 | [3-(5-Fluoro-1H-indol-3-yl)-propyl]...)
Show SMILES Fc1ccc2[nH]cc(CCCNCCOc3cccc4nccnc34)c2c1
Show InChI InChI=1S/C21H21FN4O/c22-16-6-7-18-17(13-16)15(14-26-18)3-2-8-23-11-12-27-20-5-1-4-19-21(20)25-10-9-24-19/h1,4-7,9-10,13-14,23,26H,2-3,8,11-12H2
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9.80n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against human 5-hydroxytryptamine 1A receptor in CHO cells labeled with [3H]-8-OH-DPAT radioligand


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
Monoamine transporters; Norepinephrine & serotonin


(Rattus norvegicus (rat))
BDBM50150087
PNG
(CHEMBL435612 | [2-(5-Fluoro-2,3-dihydro-benzofuran...)
Show SMILES Fc1ccc2[nH]cc(CCNCCOc3cc(F)cc4CCOc34)c2c1
Show InChI InChI=1S/C20H20F2N2O2/c21-15-1-2-18-17(10-15)14(12-24-18)3-5-23-6-8-25-19-11-16(22)9-13-4-7-26-20(13)19/h1-2,9-12,23-24H,3-8H2
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10.5n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against serotonin transporter in rat cortical tissues using radioligand [3H]-paroxetine


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (Human))
BDBM50150103
PNG
(CHEMBL338520 | [2-(6-Chloro-1H-benzoimidazol-4-ylo...)
Show SMILES Fc1ccc2[nH]cc(CCCNCCOc3cc(Cl)cc4[nH]cnc34)c2c1
Show InChI InChI=1S/C20H20ClFN4O/c21-14-8-18-20(26-12-25-18)19(9-14)27-7-6-23-5-1-2-13-11-24-17-4-3-15(22)10-16(13)17/h3-4,8-12,23-24H,1-2,5-7H2,(H,25,26)
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10.7n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against human 5-hydroxytryptamine 1A receptor in CHO cells labeled with [3H]-8-OH-DPAT radioligand


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (Human))
BDBM50150080
PNG
(CHEMBL340895 | [2-(5-Fluoro-benzofuran-7-yloxy)-et...)
Show SMILES Fc1ccc2[nH]cc(CCCNCCOc3cc(F)cc4ccoc34)c2c1
Show InChI InChI=1S/C21H20F2N2O2/c22-16-3-4-19-18(11-16)15(13-25-19)2-1-6-24-7-9-26-20-12-17(23)10-14-5-8-27-21(14)20/h3-5,8,10-13,24-25H,1-2,6-7,9H2
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13n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against human 5-hydroxytryptamine 1A receptor in CHO cells labeled with [3H]-8-OH-DPAT radioligand


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
Monoamine transporters; Norepinephrine & serotonin


(Rattus norvegicus (rat))
BDBM50150084
PNG
(CHEMBL124700 | [2-(2,3-Dihydro-benzo[1,4]dioxin-5-...)
Show SMILES Fc1ccc2[nH]cc(CCNCCOc3cccc4OCCOc34)c2c1
Show InChI InChI=1S/C20H21FN2O3/c21-15-4-5-17-16(12-15)14(13-23-17)6-7-22-8-9-24-18-2-1-3-19-20(18)26-11-10-25-19/h1-5,12-13,22-23H,6-11H2
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13.5n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against serotonin transporter in rat cortical tissues using radioligand [3H]-paroxetine


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
Monoamine transporters; Norepinephrine & serotonin


(Rattus norvegicus (rat))
BDBM50150092
PNG
(CHEMBL331609 | [2-(1H-Benzoimidazol-4-yloxy)-ethyl...)
Show SMILES C(CNCCOc1cccc2nc[nH]c12)Cc1c[nH]c2ccccc12
Show InChI InChI=1S/C20H22N4O/c1-2-7-17-16(6-1)15(13-22-17)5-4-10-21-11-12-25-19-9-3-8-18-20(19)24-14-23-18/h1-3,6-9,13-14,21-22H,4-5,10-12H2,(H,23,24)
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15.5n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against serotonin transporter in rat cortical tissues using radioligand [3H]-paroxetine


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (Human))
BDBM50150102
PNG
(CHEMBL126253 | [3-(1H-Indol-3-yl)-propyl]-[2-(naph...)
Show SMILES C(CNCCOc1cccc2ccccc12)Cc1c[nH]c2ccccc12
Show InChI InChI=1S/C23H24N2O/c1-2-11-21-18(7-1)8-5-13-23(21)26-16-15-24-14-6-9-19-17-25-22-12-4-3-10-20(19)22/h1-5,7-8,10-13,17,24-25H,6,9,14-16H2
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16.8n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against human 5-hydroxytryptamine 1A receptor in CHO cells labeled with [3H]-8-OH-DPAT radioligand


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (Human))
BDBM50150097
PNG
(CHEMBL339810 | [2-(5-Fluoro-2,3-dihydro-benzofuran...)
Show SMILES Fc1cc2CCOc2c(OCCNCCCc2c[nH]c3ccc(F)cc23)c1
Show InChI InChI=1S/C21H22F2N2O2/c22-16-3-4-19-18(11-16)15(13-25-19)2-1-6-24-7-9-26-20-12-17(23)10-14-5-8-27-21(14)20/h3-4,10-13,24-25H,1-2,5-9H2
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17.1n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against human 5-hydroxytryptamine 1A receptor in CHO cells labeled with [3H]-8-OH-DPAT radioligand


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
Monoamine transporters; Norepinephrine & serotonin


(Rattus norvegicus (rat))
BDBM50150107
PNG
(CHEMBL340705 | [3-(1H-Indol-3-yl)-propyl]-[2-(quin...)
Show SMILES C(CNCCOc1cccc2cccnc12)Cc1c[nH]c2ccccc12
Show InChI InChI=1S/C22H23N3O/c1-2-10-20-19(9-1)18(16-25-20)8-4-12-23-14-15-26-21-11-3-6-17-7-5-13-24-22(17)21/h1-3,5-7,9-11,13,16,23,25H,4,8,12,14-15H2
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18n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against serotonin transporter in rat cortical tissues using radioligand [3H]-paroxetine


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
Monoamine transporters; Norepinephrine & serotonin


(Rattus norvegicus (rat))
BDBM50150079
PNG
(CHEMBL338587 | [4-(1H-Indol-3-yl)-butyl]-[2-(1H-in...)
Show SMILES C(CCc1c[nH]c2ccccc12)CNCCOc1cccc2[nH]ccc12
Show InChI InChI=1S/C22H25N3O/c1-2-8-20-18(7-1)17(16-25-20)6-3-4-12-23-14-15-26-22-10-5-9-21-19(22)11-13-24-21/h1-2,5,7-11,13,16,23-25H,3-4,6,12,14-15H2
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19.5n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against serotonin transporter in rat cortical tissues using radioligand [3H]-paroxetine


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
Monoamine transporters; Norepinephrine & serotonin


(Rattus norvegicus (rat))
BDBM50150100
PNG
(CHEMBL340301 | [2-(1H-Indol-4-yloxy)-ethyl]-[3-(1H...)
Show SMILES C(CNCCOc1cccc2[nH]ccc12)Cc1c[nH]c2ccccc12
Show InChI InChI=1S/C21H23N3O/c1-2-7-19-17(6-1)16(15-24-19)5-4-11-22-13-14-25-21-9-3-8-20-18(21)10-12-23-20/h1-3,6-10,12,15,22-24H,4-5,11,13-14H2
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20n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against serotonin transporter in rat cortical tissues using radioligand [3H]-paroxetine


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (Human))
BDBM50150099
PNG
(CHEMBL339490 | [2-(7-Fluoro-2,3-dihydro-benzo[1,4]...)
Show SMILES Fc1ccc2[nH]cc(CCCNCCOc3cc(F)cc4OCCOc34)c2c1
Show InChI InChI=1S/C21H22F2N2O3/c22-15-3-4-18-17(10-15)14(13-25-18)2-1-5-24-6-7-26-19-11-16(23)12-20-21(19)28-9-8-27-20/h3-4,10-13,24-25H,1-2,5-9H2
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22.4n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against human 5-hydroxytryptamine 1A receptor in CHO cells labeled with [3H]-8-OH-DPAT radioligand


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
Monoamine transporters; Norepinephrine & serotonin


(Rattus norvegicus (rat))
BDBM50150091
PNG
(CHEMBL332589 | [2-(5-Fluoro-1H-indol-3-yl)-ethyl]-...)
Show SMILES COc1ccc(F)cc1OCCNCCc1c[nH]c2ccc(F)cc12
Show InChI InChI=1S/C19H20F2N2O2/c1-24-18-5-3-15(21)11-19(18)25-9-8-22-7-6-13-12-23-17-4-2-14(20)10-16(13)17/h2-5,10-12,22-23H,6-9H2,1H3
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23.5n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against serotonin transporter in rat cortical tissues using radioligand [3H]-paroxetine


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (Human))
BDBM50150105
PNG
(CHEMBL124069 | [2-(6-Fluoro-chroman-8-yloxy)-ethyl...)
Show SMILES Fc1cc2CCCOc2c(OCCNCCCc2c[nH]c3ccc(F)cc23)c1
Show InChI InChI=1S/C22H24F2N2O2/c23-17-5-6-20-19(12-17)16(14-26-20)3-1-7-25-8-10-27-21-13-18(24)11-15-4-2-9-28-22(15)21/h5-6,11-14,25-26H,1-4,7-10H2
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26.6n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against human 5-hydroxytryptamine 1A receptor in CHO cells labeled with [3H]-8-OH-DPAT radioligand


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (Human))
BDBM50150093
PNG
(CHEMBL340873 | [2-(6-Fluoro-chroman-8-yloxy)-ethyl...)
Show SMILES Fc1ccc2[nH]cc(CCNCCOc3cc(F)cc4CCCOc34)c2c1
Show InChI InChI=1S/C21H22F2N2O2/c22-16-3-4-19-18(11-16)15(13-25-19)5-6-24-7-9-26-20-12-17(23)10-14-2-1-8-27-21(14)20/h3-4,10-13,24-25H,1-2,5-9H2
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29.2n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against human 5-hydroxytryptamine 1A receptor in CHO cells labeled with [3H]-8-OH-DPAT radioligand


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
Monoamine transporters; Norepinephrine & serotonin


(Rattus norvegicus (rat))
BDBM50150088
PNG
(CHEMBL124818 | [4-(1H-Indol-3-yl)-butyl]-[2-(2-met...)
Show SMILES COc1ccccc1OCCNCCCCc1c[nH]c2ccccc12
Show InChI InChI=1S/C21H26N2O2/c1-24-20-11-4-5-12-21(20)25-15-14-22-13-7-6-8-17-16-23-19-10-3-2-9-18(17)19/h2-5,9-12,16,22-23H,6-8,13-15H2,1H3
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31.5n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against serotonin transporter in rat cortical tissues using radioligand [3H]-paroxetine


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
Monoamine transporters; Norepinephrine & serotonin


(Rattus norvegicus (rat))
BDBM50150104
PNG
(CHEMBL339559 | [3-(5-Fluoro-1H-indol-3-yl)-propyl]...)
Show SMILES Fc1ccc2[nH]cc(CCCNCCOc3cccc4CCCCc34)c2c1
Show InChI InChI=1S/C23H27FN2O/c24-19-10-11-22-21(15-19)18(16-26-22)7-4-12-25-13-14-27-23-9-3-6-17-5-1-2-8-20(17)23/h3,6,9-11,15-16,25-26H,1-2,4-5,7-8,12-14H2
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33.5n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against serotonin transporter in rat cortical tissues using radioligand [3H]-paroxetine


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (Human))
BDBM50150086
PNG
(CHEMBL127171 | [3-(5-Fluoro-1H-indol-3-yl)-propyl]...)
Show SMILES COc1ccc(F)cc1OCCNCCCc1c[nH]c2ccc(F)cc12
Show InChI InChI=1S/C20H22F2N2O2/c1-25-19-7-5-16(22)12-20(19)26-10-9-23-8-2-3-14-13-24-18-6-4-15(21)11-17(14)18/h4-7,11-13,23-24H,2-3,8-10H2,1H3
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35n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against human 5-hydroxytryptamine 1A receptor in CHO cells labeled with [3H]-8-OH-DPAT radioligand


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (Human))
BDBM50150087
PNG
(CHEMBL435612 | [2-(5-Fluoro-2,3-dihydro-benzofuran...)
Show SMILES Fc1ccc2[nH]cc(CCNCCOc3cc(F)cc4CCOc34)c2c1
Show InChI InChI=1S/C20H20F2N2O2/c21-15-1-2-18-17(10-15)14(12-24-18)3-5-23-6-8-25-19-11-16(22)9-13-4-7-26-20(13)19/h1-2,9-12,23-24H,3-8H2
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35.1n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against human 5-hydroxytryptamine 1A receptor in CHO cells labeled with [3H]-8-OH-DPAT radioligand


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
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