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Compile Data Set for Download or QSAR

Found 20 hits with Last Name = 'antane' and Initial = 'sa'   
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
5-Hydroxytryptamine receptor 6 (5-HT6)


(Homo sapiens (human))
BDBM50303164
PNG
(1-(1-(2-(dimethylamino)ethyl)-3-(naphthalen-1-ylsu...)
Show SMILES CN(C)CCn1cc(c2nc(ccc12)C(C)=O)S(=O)(=O)c1cccc2ccccc12
Show InChI InChI=1S/C23H23N3O3S/c1-16(27)19-11-12-20-23(24-19)22(15-26(20)14-13-25(2)3)30(28,29)21-10-6-8-17-7-4-5-9-18(17)21/h4-12,15H,13-14H2,1-3H3
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1.70n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Displacement of [3H]LSD from human HT6 receptor expressed in human HeLa cells


Bioorg Med Chem Lett 19: 6935-8 (2009)

More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 6 (5-HT6)


(Homo sapiens (human))
BDBM50303163
PNG
(1-(3-(4-bromophenylsulfonyl)-1-(2-(dimethylamino)e...)
Show SMILES CN(C)CCn1cc(c2nc(ccc12)C(C)=O)S(=O)(=O)c1ccc(Br)cc1
Show InChI InChI=1S/C19H20BrN3O3S/c1-13(24)16-8-9-17-19(21-16)18(12-23(17)11-10-22(2)3)27(25,26)15-6-4-14(20)5-7-15/h4-9,12H,10-11H2,1-3H3
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3.90n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Displacement of [3H]LSD from human HT6 receptor expressed in human HeLa cells


Bioorg Med Chem Lett 19: 6935-8 (2009)

More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 6 (5-HT6)


(Homo sapiens (human))
BDBM50300828
PNG
(2-(3-(3-fluorophenylsulfonyl)-1H-pyrrolo[2,3-b]pyr...)
Show SMILES CN(C)CCn1cc(c2cccnc12)S(=O)(=O)c1cccc(F)c1
Show InChI InChI=1S/C17H18FN3O2S/c1-20(2)9-10-21-12-16(15-7-4-8-19-17(15)21)24(22,23)14-6-3-5-13(18)11-14/h3-8,11-12H,9-10H2,1-2H3
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4.90n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Displacement of [3H]LSD from human HT6 receptor expressed in human HeLa cells


Bioorg Med Chem Lett 19: 6935-8 (2009)

More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 6 (5-HT6)


(Homo sapiens (human))
BDBM50303162
PNG
(1-(1-(2-(dimethylamino)ethyl)-3-(3-fluorophenylsul...)
Show SMILES CN(C)CCn1cc(c2nc(ccc12)C(C)=O)S(=O)(=O)c1cccc(F)c1
Show InChI InChI=1S/C19H20FN3O3S/c1-13(24)16-7-8-17-19(21-16)18(12-23(17)10-9-22(2)3)27(25,26)15-6-4-5-14(20)11-15/h4-8,11-12H,9-10H2,1-3H3
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11.3n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Displacement of [3H]LSD from human HT6 receptor expressed in human HeLa cells


Bioorg Med Chem Lett 19: 6935-8 (2009)

More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 6 (5-HT6)


(Homo sapiens (human))
BDBM50300832
PNG
(CHEMBL578826 | N,N-Dimethyl-N-{2-[3-(phenylsulfony...)
Show SMILES CN(C)CCn1cc(c2cccnc12)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C17H19N3O2S/c1-19(2)11-12-20-13-16(15-9-6-10-18-17(15)20)23(21,22)14-7-4-3-5-8-14/h3-10,13H,11-12H2,1-2H3
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23n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Displacement of [3H]LSD from human HT6 receptor expressed in human HeLa cells


Bioorg Med Chem Lett 19: 6935-8 (2009)

More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 6 (5-HT6)


(Homo sapiens (human))
BDBM50303166
PNG
(2-(3-(3-chlorophenylsulfonyl)-1H-pyrrolo[3,2-b]pyr...)
Show SMILES NCCn1cc(c2ncccc12)S(=O)(=O)c1cccc(Cl)c1
Show InChI InChI=1S/C15H14ClN3O2S/c16-11-3-1-4-12(9-11)22(20,21)14-10-19(8-6-17)13-5-2-7-18-15(13)14/h1-5,7,9-10H,6,8,17H2
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35n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Displacement of [3H]LSD from human HT6 receptor expressed in human HeLa cells


Bioorg Med Chem Lett 19: 6935-8 (2009)

More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 6 (5-HT6)


(Homo sapiens (human))
BDBM50303168
PNG
(2-(3-(6-chloroimidazo[2,1-b]thiazol-5-ylsulfonyl)-...)
Show SMILES NCCn1cc(c2ncccc12)S(=O)(=O)c1c(Cl)nc2sccn12
Show InChI InChI=1S/C14H12ClN5O2S2/c15-12-13(20-6-7-23-14(20)18-12)24(21,22)10-8-19(5-3-16)9-2-1-4-17-11(9)10/h1-2,4,6-8H,3,5,16H2
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42n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Displacement of [3H]LSD from human HT6 receptor expressed in human HeLa cells


Bioorg Med Chem Lett 19: 6935-8 (2009)

More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 6 (5-HT6)


(Homo sapiens (human))
BDBM50303167
PNG
(2-(3-(m-tolylsulfonyl)-1H-pyrrolo[3,2-b]pyridin-1-...)
Show SMILES Cc1cccc(c1)S(=O)(=O)c1cn(CCN)c2cccnc12
Show InChI InChI=1S/C16H17N3O2S/c1-12-4-2-5-13(10-12)22(20,21)15-11-19(9-7-17)14-6-3-8-18-16(14)15/h2-6,8,10-11H,7,9,17H2,1H3
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46n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Displacement of [3H]LSD from human HT6 receptor expressed in human HeLa cells


Bioorg Med Chem Lett 19: 6935-8 (2009)

More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 6 (5-HT6)


(Homo sapiens (human))
BDBM50303161
PNG
(1-(1-(2-(dimethylamino)ethyl)-3-(phenylsulfonyl)-1...)
Show SMILES CN(C)CCn1cc(c2nc(ccc12)C(C)=O)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C19H21N3O3S/c1-14(23)16-9-10-17-19(20-16)18(13-22(17)12-11-21(2)3)26(24,25)15-7-5-4-6-8-15/h4-10,13H,11-12H2,1-3H3
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56n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Displacement of [3H]LSD from human HT6 receptor expressed in human HeLa cells


Bioorg Med Chem Lett 19: 6935-8 (2009)

More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 6 (5-HT6)


(Homo sapiens (human))
BDBM50303165
PNG
(2-(3-(3-fluorophenylsulfonyl)-1H-pyrrolo[3,2-b]pyr...)
Show SMILES NCCn1cc(c2ncccc12)S(=O)(=O)c1cccc(F)c1
Show InChI InChI=1S/C15H14FN3O2S/c16-11-3-1-4-12(9-11)22(20,21)14-10-19(8-6-17)13-5-2-7-18-15(13)14/h1-5,7,9-10H,6,8,17H2
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76n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Displacement of [3H]LSD from human HT6 receptor expressed in human HeLa cells


Bioorg Med Chem Lett 19: 6935-8 (2009)

More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 6 (5-HT6)


(Homo sapiens (human))
BDBM50303159
PNG
(2-(3-(3-fluorophenylsulfonyl)-1H-pyrrolo[3,2-b]pyr...)
Show SMILES CN(C)CCn1cc(c2ncccc12)S(=O)(=O)c1cccc(F)c1
Show InChI InChI=1S/C17H18FN3O2S/c1-20(2)9-10-21-12-16(17-15(21)7-4-8-19-17)24(22,23)14-6-3-5-13(18)11-14/h3-8,11-12H,9-10H2,1-2H3
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200n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Displacement of [3H]LSD from human HT6 receptor expressed in human HeLa cells


Bioorg Med Chem Lett 19: 6935-8 (2009)

More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 6 (5-HT6)


(Homo sapiens (human))
BDBM50303160
PNG
(2-(5-chloro-3-(phenylsulfonyl)-1H-pyrrolo[3,2-b]py...)
Show SMILES CN(C)CCn1cc(c2nc(Cl)ccc12)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C17H18ClN3O2S/c1-20(2)10-11-21-12-15(17-14(21)8-9-16(18)19-17)24(22,23)13-6-4-3-5-7-13/h3-9,12H,10-11H2,1-2H3
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214n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Displacement of [3H]LSD from human HT6 receptor expressed in human HeLa cells


Bioorg Med Chem Lett 19: 6935-8 (2009)

More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 6 (5-HT6)


(Homo sapiens (human))
BDBM50303158
PNG
(CHEMBL576312 | N,N-dimethyl-2-(3-(phenylsulfonyl)-...)
Show SMILES CN(C)CCn1cc(c2ncccc12)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C17H19N3O2S/c1-19(2)11-12-20-13-16(17-15(20)9-6-10-18-17)23(21,22)14-7-4-3-5-8-14/h3-10,13H,11-12H2,1-2H3
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368n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Displacement of [3H]LSD from human HT6 receptor expressed in human HeLa cells


Bioorg Med Chem Lett 19: 6935-8 (2009)

More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 6 (5-HT6)


(Homo sapiens (human))
BDBM50303162
PNG
(1-(1-(2-(dimethylamino)ethyl)-3-(3-fluorophenylsul...)
Show SMILES CN(C)CCn1cc(c2nc(ccc12)C(C)=O)S(=O)(=O)c1cccc(F)c1
Show InChI InChI=1S/C19H20FN3O3S/c1-13(24)16-7-8-17-19(21-16)18(12-23(17)10-9-22(2)3)27(25,26)15-6-4-5-14(20)11-15/h4-8,11-12H,9-10H2,1-3H3
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n/an/a 41n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Antagonistic activity at human HT6 receptor expressed in HeLa cells assessed as intracellular cAMP level by radioimmunoassay


Bioorg Med Chem Lett 19: 6935-8 (2009)

More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 6 (5-HT6)


(Homo sapiens (human))
BDBM50303166
PNG
(2-(3-(3-chlorophenylsulfonyl)-1H-pyrrolo[3,2-b]pyr...)
Show SMILES NCCn1cc(c2ncccc12)S(=O)(=O)c1cccc(Cl)c1
Show InChI InChI=1S/C15H14ClN3O2S/c16-11-3-1-4-12(9-11)22(20,21)14-10-19(8-6-17)13-5-2-7-18-15(13)14/h1-5,7,9-10H,6,8,17H2
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n/an/a 197n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Antagonistic activity at human HT6 receptor expressed in HeLa cells assessed as intracellular cAMP level by radioimmunoassay


Bioorg Med Chem Lett 19: 6935-8 (2009)

More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 6 (5-HT6)


(Homo sapiens (human))
BDBM50303164
PNG
(1-(1-(2-(dimethylamino)ethyl)-3-(naphthalen-1-ylsu...)
Show SMILES CN(C)CCn1cc(c2nc(ccc12)C(C)=O)S(=O)(=O)c1cccc2ccccc12
Show InChI InChI=1S/C23H23N3O3S/c1-16(27)19-11-12-20-23(24-19)22(15-26(20)14-13-25(2)3)30(28,29)21-10-6-8-17-7-4-5-9-18(17)21/h4-12,15H,13-14H2,1-3H3
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n/an/a 295n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Antagonistic activity at human HT6 receptor expressed in HeLa cells assessed as intracellular cAMP level by radioimmunoassay


Bioorg Med Chem Lett 19: 6935-8 (2009)

More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 6 (5-HT6)


(Homo sapiens (human))
BDBM50303163
PNG
(1-(3-(4-bromophenylsulfonyl)-1-(2-(dimethylamino)e...)
Show SMILES CN(C)CCn1cc(c2nc(ccc12)C(C)=O)S(=O)(=O)c1ccc(Br)cc1
Show InChI InChI=1S/C19H20BrN3O3S/c1-13(24)16-8-9-17-19(21-16)18(12-23(17)11-10-22(2)3)27(25,26)15-6-4-14(20)5-7-15/h4-9,12H,10-11H2,1-3H3
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n/an/a 385n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Antagonistic activity at human HT6 receptor expressed in HeLa cells assessed as intracellular cAMP level by radioimmunoassay


Bioorg Med Chem Lett 19: 6935-8 (2009)

More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 6 (5-HT6)


(Homo sapiens (human))
BDBM50303165
PNG
(2-(3-(3-fluorophenylsulfonyl)-1H-pyrrolo[3,2-b]pyr...)
Show SMILES NCCn1cc(c2ncccc12)S(=O)(=O)c1cccc(F)c1
Show InChI InChI=1S/C15H14FN3O2S/c16-11-3-1-4-12(9-11)22(20,21)14-10-19(8-6-17)13-5-2-7-18-15(13)14/h1-5,7,9-10H,6,8,17H2
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n/an/a 823n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Antagonistic activity at human HT6 receptor expressed in HeLa cells assessed as intracellular cAMP level by radioimmunoassay


Bioorg Med Chem Lett 19: 6935-8 (2009)

More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 6 (5-HT6)


(Homo sapiens (human))
BDBM50300832
PNG
(CHEMBL578826 | N,N-Dimethyl-N-{2-[3-(phenylsulfony...)
Show SMILES CN(C)CCn1cc(c2cccnc12)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C17H19N3O2S/c1-19(2)11-12-20-13-16(15-9-6-10-18-17(15)20)23(21,22)14-7-4-3-5-8-14/h3-10,13H,11-12H2,1-2H3
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n/an/an/an/a 25n/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Agonist activity at human HT6 receptor expressed in human HeLa cells assessed as intracellular cAMP level by radioimmunoassay


Bioorg Med Chem Lett 19: 6935-8 (2009)

More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 6 (5-HT6)


(Homo sapiens (human))
BDBM50300828
PNG
(2-(3-(3-fluorophenylsulfonyl)-1H-pyrrolo[2,3-b]pyr...)
Show SMILES CN(C)CCn1cc(c2cccnc12)S(=O)(=O)c1cccc(F)c1
Show InChI InChI=1S/C17H18FN3O2S/c1-20(2)9-10-21-12-16(15-7-4-8-19-17(15)21)24(22,23)14-6-3-5-13(18)11-14/h3-8,11-12H,9-10H2,1-2H3
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n/an/an/an/a 7.30n/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Agonist activity at human HT6 receptor expressed in human HeLa cells assessed as intracellular cAMP level by radioimmunoassay


Bioorg Med Chem Lett 19: 6935-8 (2009)

More data for this
Ligand-Target Pair