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PubMed code 19443217

Compile data set for download or QSAR
Found 60 hits of Enzyme Inhibition Constant Data   
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
Histamine H1 receptor


(Homo sapiens (Human))		BDBM50346044
PNG
(2-methyl-5-(2-(pyridin-3-yl)ethyl)-2,3,4,5-tetrahy...)
Show SMILES CN1CCc2c(C1)c1ccccc1n2CCc1cccnc1
Show InChI InChI=1S/C19H21N3/c1-21-11-9-19-17(14-21)16-6-2-3-7-18(16)22(19)12-8-15-5-4-10-20-13-15/h2-7,10,13H,8-9,11-12,14H2,1H3
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n/an/a 100n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human histamine H1 receptor in SK-N-SH cells assessed as inhibition of histamine-induced calcium level increase during phase-1...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Homo sapiens (Human))		BDBM50346052
PNG
(8-fluoro-2-methyl-5-(2-(6-methylpyridin-3-yl)ethyl...)
Show SMILES CN1CCc2c(C1)c1cc(F)ccc1n2CCc1ccc(C)nc1
Show InChI InChI=1S/C20H22FN3/c1-14-3-4-15(12-22-14)7-10-24-19-6-5-16(21)11-17(19)18-13-23(2)9-8-20(18)24/h3-6,11-12H,7-10,13H2,1-2H3
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n/an/a 110n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human histamine H1 receptor in SK-N-SH cells assessed as inhibition of histamine-induced calcium level increase during phase-1...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Homo sapiens (Human))		BDBM50346058
PNG
(8-fluoro-2-methyl-5-(2-(pyridin-4-yl)ethyl)-2,3,4,...)
Show SMILES CN1CCc2c(C1)c1cc(F)ccc1n2CCc1ccncc1
Show InChI InChI=1S/C19H20FN3/c1-22-10-7-19-17(13-22)16-12-15(20)2-3-18(16)23(19)11-6-14-4-8-21-9-5-14/h2-5,8-9,12H,6-7,10-11,13H2,1H3
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n/an/a 120n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human histamine H1 receptor in SK-N-SH cells assessed as inhibition of histamine-induced calcium level increase during phase-1...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Homo sapiens (Human))		BDBM50346050
PNG
(2-methyl-5-(2-(pyridin-4-yl)ethyl)-2,3,4,5-tetrahy...)
Show SMILES CN1CCc2c(C1)c1ccccc1n2CCc1ccncc1
Show InChI InChI=1S/C19H21N3/c1-21-12-9-19-17(14-21)16-4-2-3-5-18(16)22(19)13-8-15-6-10-20-11-7-15/h2-7,10-11H,8-9,12-14H2,1H3
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n/an/a 120n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human histamine H1 receptor in SK-N-SH cells assessed as inhibition of histamine-induced calcium level increase during phase-1...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Homo sapiens (Human))		BDBM50346057
PNG
(8-bromo-2-methyl-5-(2-(pyridin-2-yl)ethyl)-2,3,4,5...)
Show SMILES CN1CCc2c(C1)c1cc(Br)ccc1n2CCc1ccccn1
Show InChI InChI=1S/C19H20BrN3/c1-22-10-8-19-17(13-22)16-12-14(20)5-6-18(16)23(19)11-7-15-4-2-3-9-21-15/h2-6,9,12H,7-8,10-11,13H2,1H3
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n/an/a 120n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human histamine H1 receptor in SK-N-SH cells assessed as inhibition of histamine-induced calcium level increase during phase-1...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Homo sapiens (Human))		BDBM50346059
PNG
(2,8-dimethyl-5-(2-(pyridin-4-yl)ethyl)-2,3,4,5-tet...)
Show SMILES CN1CCc2c(C1)c1cc(C)ccc1n2CCc1ccncc1
Show InChI InChI=1S/C20H23N3/c1-15-3-4-19-17(13-15)18-14-22(2)11-8-20(18)23(19)12-7-16-5-9-21-10-6-16/h3-6,9-10,13H,7-8,11-12,14H2,1-2H3
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n/an/a 160n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human histamine H1 receptor in SK-N-SH cells assessed as inhibition of histamine-induced calcium level increase during phase-1...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Homo sapiens (Human))		BDBM50305261
PNG
(CHEMBL589390 | Dimebolin)
Show SMILES CN1CCc2c(C1)c1cc(C)ccc1n2CCc1ccc(C)nc1
Show InChI InChI=1S/C21H25N3/c1-15-4-7-20-18(12-15)19-14-23(3)10-9-21(19)24(20)11-8-17-6-5-16(2)22-13-17/h4-7,12-13H,8-11,14H2,1-3H3
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n/an/a 160n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human histamine H1 receptor in SK-N-SH cells assessed as inhibition of histamine-induced calcium level increase during phase-1...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Homo sapiens (Human))		BDBM50346045
PNG
(2-methyl-5-(2-(pyridin-4-yl)ethyl)-8-(trifluoromet...)
Show SMILES CN1CCc2c(C1)c1cc(ccc1n2CCc1ccncc1)C(F)(F)F
Show InChI InChI=1S/C20H20F3N3/c1-25-10-7-19-17(13-25)16-12-15(20(21,22)23)2-3-18(16)26(19)11-6-14-4-8-24-9-5-14/h2-5,8-9,12H,6-7,10-11,13H2,1H3
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n/an/a 220n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human histamine H1 receptor in SK-N-SH cells assessed as inhibition of histamine-induced calcium level increase during phase-1...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Homo sapiens (Human))		BDBM50346049
PNG
(2,8-dimethyl-5-(2-pyrazine-2-ylethyl)-gamma-carbol...)
Show SMILES CN1CCc2c(C1)c1cc(C)ccc1n2CCc1cnccn1
Show InChI InChI=1S/C19H22N4/c1-14-3-4-18-16(11-14)17-13-22(2)9-6-19(17)23(18)10-5-15-12-20-7-8-21-15/h3-4,7-8,11-12H,5-6,9-10,13H2,1-2H3
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Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human histamine H1 receptor in SK-N-SH cells assessed as inhibition of histamine-induced calcium level increase during phase-1...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))		BDBM50346059
PNG
(2,8-dimethyl-5-(2-(pyridin-4-yl)ethyl)-2,3,4,5-tet...)
Show SMILES CN1CCc2c(C1)c1cc(C)ccc1n2CCc1ccncc1
Show InChI InChI=1S/C20H23N3/c1-15-3-4-19-17(13-15)18-14-22(2)11-8-20(18)23(19)12-7-16-5-9-21-10-6-16/h3-6,9-10,13H,7-8,11-12,14H2,1-2H3
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n/an/a 370n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human recombinant 5-HT6 receptor expressed in HEK293 cells assessed as inhibition of serotonin-induced intracellular cAMP accu...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Homo sapiens (Human))		BDBM50346060
PNG
(8-methoxy-2-methyl-5-(2-(pyridin-4-yl)ethyl)-2,3,4...)
Show SMILES COc1ccc2n(CCc3ccncc3)c3CCN(C)Cc3c2c1
Show InChI InChI=1S/C20H23N3O/c1-22-11-8-20-18(14-22)17-13-16(24-2)3-4-19(17)23(20)12-7-15-5-9-21-10-6-15/h3-6,9-10,13H,7-8,11-12,14H2,1-2H3
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n/an/a 390n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human histamine H1 receptor in SK-N-SH cells assessed as inhibition of histamine-induced calcium level increase during phase-1...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Homo sapiens (Human))		BDBM50346044
PNG
(2-methyl-5-(2-(pyridin-3-yl)ethyl)-2,3,4,5-tetrahy...)
Show SMILES CN1CCc2c(C1)c1ccccc1n2CCc1cccnc1
Show InChI InChI=1S/C19H21N3/c1-21-11-9-19-17(14-21)16-6-2-3-7-18(16)22(19)12-8-15-5-4-10-20-13-15/h2-7,10,13H,8-9,11-12,14H2,1H3
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Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human histamine H1 receptor in SK-N-SH cells assessed as inhibition of histamine-induced calcium flow during phase-II compound...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))		BDBM50346061
PNG
(2,8-dimethyl-5-(2-(pyridin-3-yl)ethyl)-2,3,4,5-tet...)
Show SMILES CN1CCc2c(C1)c1cc(C)ccc1n2CCc1cccnc1
Show InChI InChI=1S/C20H23N3/c1-15-5-6-19-17(12-15)18-14-22(2)10-8-20(18)23(19)11-7-16-4-3-9-21-13-16/h3-6,9,12-13H,7-8,10-11,14H2,1-2H3
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n/an/a 440n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human recombinant 5-HT6 receptor expressed in HEK293 cells assessed as inhibition of serotonin-induced intracellular cAMP accu...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Homo sapiens (Human))		BDBM50346058
PNG
(8-fluoro-2-methyl-5-(2-(pyridin-4-yl)ethyl)-2,3,4,...)
Show SMILES CN1CCc2c(C1)c1cc(F)ccc1n2CCc1ccncc1
Show InChI InChI=1S/C19H20FN3/c1-22-10-7-19-17(13-22)16-12-15(20)2-3-18(16)23(19)11-6-14-4-8-21-9-5-14/h2-5,8-9,12H,6-7,10-11,13H2,1H3
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n/an/a 470n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human histamine H1 receptor in SK-N-SH cells assessed as inhibition of histamine-induced calcium flow during phase-II compound...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Homo sapiens (Human))		BDBM50346050
PNG
(2-methyl-5-(2-(pyridin-4-yl)ethyl)-2,3,4,5-tetrahy...)
Show SMILES CN1CCc2c(C1)c1ccccc1n2CCc1ccncc1
Show InChI InChI=1S/C19H21N3/c1-21-12-9-19-17(14-21)16-4-2-3-5-18(16)22(19)13-8-15-6-10-20-11-7-15/h2-7,10-11H,8-9,12-14H2,1H3
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n/an/a 500n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human histamine H1 receptor in SK-N-SH cells assessed as inhibition of histamine-induced calcium flow during phase-II compound...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Homo sapiens (Human))		BDBM50346051
PNG
(2,8-dimethyl-5-(2-(pyridin-2-yl)ethyl)-2,3,4,5-tet...)
Show SMILES CN1CCc2c(C1)c1cc(C)ccc1n2CCc1ccccn1
Show InChI InChI=1S/C20H23N3/c1-15-6-7-19-17(13-15)18-14-22(2)11-9-20(18)23(19)12-8-16-5-3-4-10-21-16/h3-7,10,13H,8-9,11-12,14H2,1-2H3
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Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human histamine H1 receptor in SK-N-SH cells assessed as inhibition of histamine-induced calcium level increase during phase-1...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Homo sapiens (Human))		BDBM50346061
PNG
(2,8-dimethyl-5-(2-(pyridin-3-yl)ethyl)-2,3,4,5-tet...)
Show SMILES CN1CCc2c(C1)c1cc(C)ccc1n2CCc1cccnc1
Show InChI InChI=1S/C20H23N3/c1-15-5-6-19-17(12-15)18-14-22(2)10-8-20(18)23(19)11-7-16-4-3-9-21-13-16/h3-6,9,12-13H,7-8,10-11,14H2,1-2H3
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Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human histamine H1 receptor in SK-N-SH cells assessed as inhibition of histamine-induced calcium level increase during phase-1...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Homo sapiens (Human))		BDBM50346062
PNG
(2-methyl-5-(2-(pyridin-2-yl)ethyl)-8-(trifluoromet...)
Show SMILES CN1CCc2c(C1)c1cc(ccc1n2CCc1ccccn1)C(F)(F)F
Show InChI InChI=1S/C20H20F3N3/c1-25-10-8-19-17(13-25)16-12-14(20(21,22)23)5-6-18(16)26(19)11-7-15-4-2-3-9-24-15/h2-6,9,12H,7-8,10-11,13H2,1H3
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Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human histamine H1 receptor in SK-N-SH cells assessed as inhibition of histamine-induced calcium level increase during phase-1...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Homo sapiens (Human))		BDBM50346063
PNG
(8-fluoro-2-methyl-5-(2-(pyridin-2-yl)ethyl)-2,3,4,...)
Show SMILES CN1CCc2c(C1)c1cc(F)ccc1n2CCc1ccccn1
Show InChI InChI=1S/C19H20FN3/c1-22-10-8-19-17(13-22)16-12-14(20)5-6-18(16)23(19)11-7-15-4-2-3-9-21-15/h2-6,9,12H,7-8,10-11,13H2,1H3
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Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human histamine H1 receptor in SK-N-SH cells assessed as inhibition of histamine-induced calcium flow during phase-II compound...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Homo sapiens (Human))		BDBM50346056
PNG
(8-fluoro-2-methyl-5-(2-(pyridin-3-yl)ethyl)-2,3,4,...)
Show SMILES CN1CCc2c(C1)c1cc(F)ccc1n2CCc1cccnc1
Show InChI InChI=1S/C19H20FN3/c1-22-9-7-19-17(13-22)16-11-15(20)4-5-18(16)23(19)10-6-14-3-2-8-21-12-14/h2-5,8,11-12H,6-7,9-10,13H2,1H3
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n/an/a 650n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human histamine H1 receptor in SK-N-SH cells assessed as inhibition of histamine-induced calcium level increase during phase-1...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Homo sapiens (Human))		BDBM50346052
PNG
(8-fluoro-2-methyl-5-(2-(6-methylpyridin-3-yl)ethyl...)
Show SMILES CN1CCc2c(C1)c1cc(F)ccc1n2CCc1ccc(C)nc1
Show InChI InChI=1S/C20H22FN3/c1-14-3-4-15(12-22-14)7-10-24-19-6-5-16(21)11-17(19)18-13-23(2)9-8-20(18)24/h3-6,11-12H,7-10,13H2,1-2H3
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n/an/a 730n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human histamine H1 receptor in SK-N-SH cells assessed as inhibition of histamine-induced calcium flow during phase-II compound...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))		BDBM50346051
PNG
(2,8-dimethyl-5-(2-(pyridin-2-yl)ethyl)-2,3,4,5-tet...)
Show SMILES CN1CCc2c(C1)c1cc(C)ccc1n2CCc1ccccn1
Show InChI InChI=1S/C20H23N3/c1-15-6-7-19-17(13-15)18-14-22(2)11-9-20(18)23(19)12-8-16-5-3-4-10-21-16/h3-7,10,13H,8-9,11-12,14H2,1-2H3
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n/an/a 860n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human recombinant 5-HT6 receptor expressed in HEK293 cells assessed as inhibition of serotonin-induced intracellular cAMP accu...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))		BDBM50305261
PNG
(CHEMBL589390 | Dimebolin)
Show SMILES CN1CCc2c(C1)c1cc(C)ccc1n2CCc1ccc(C)nc1
Show InChI InChI=1S/C21H25N3/c1-15-4-7-20-18(12-15)19-14-23(3)10-9-21(19)24(20)11-8-17-6-5-16(2)22-13-17/h4-7,12-13H,8-11,14H2,1-3H3
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n/an/a 890n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human recombinant 5-HT6 receptor expressed in HEK293 cells assessed as inhibition of serotonin-induced intracellular cAMP accu...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Homo sapiens (Human))		BDBM50346053
PNG
(2-methyl-5-(2-(pyridin-2-yl)ethyl)-2,3,4,5-tetrahy...)
Show SMILES CN1CCc2c(C1)c1ccccc1n2CCc1ccccn1
Show InChI InChI=1S/C19H21N3/c1-21-12-10-19-17(14-21)16-7-2-3-8-18(16)22(19)13-9-15-6-4-5-11-20-15/h2-8,11H,9-10,12-14H2,1H3
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n/an/a 930n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human histamine H1 receptor in SK-N-SH cells assessed as inhibition of histamine-induced calcium flow during phase-II compound...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Homo sapiens (Human))		BDBM50346056
PNG
(8-fluoro-2-methyl-5-(2-(pyridin-3-yl)ethyl)-2,3,4,...)
Show SMILES CN1CCc2c(C1)c1cc(F)ccc1n2CCc1cccnc1
Show InChI InChI=1S/C19H20FN3/c1-22-9-7-19-17(13-22)16-11-15(20)4-5-18(16)23(19)10-6-14-3-2-8-21-12-14/h2-5,8,11-12H,6-7,9-10,13H2,1H3
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n/an/a 930n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human histamine H1 receptor in SK-N-SH cells assessed as inhibition of histamine-induced calcium flow during phase-II compound...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Homo sapiens (Human))		BDBM50346063
PNG
(8-fluoro-2-methyl-5-(2-(pyridin-2-yl)ethyl)-2,3,4,...)
Show SMILES CN1CCc2c(C1)c1cc(F)ccc1n2CCc1ccccn1
Show InChI InChI=1S/C19H20FN3/c1-22-10-8-19-17(13-22)16-12-14(20)5-6-18(16)23(19)11-7-15-4-2-3-9-21-15/h2-6,9,12H,7-8,10-11,13H2,1H3
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n/an/a 940n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human histamine H1 receptor in SK-N-SH cells assessed as inhibition of histamine-induced calcium level increase during phase-1...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))		BDBM50346057
PNG
(8-bromo-2-methyl-5-(2-(pyridin-2-yl)ethyl)-2,3,4,5...)
Show SMILES CN1CCc2c(C1)c1cc(Br)ccc1n2CCc1ccccn1
Show InChI InChI=1S/C19H20BrN3/c1-22-10-8-19-17(13-22)16-12-14(20)5-6-18(16)23(19)11-7-15-4-2-3-9-21-15/h2-6,9,12H,7-8,10-11,13H2,1H3
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n/an/a 1.04E+3n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human recombinant 5-HT6 receptor expressed in HEK293 cells assessed as inhibition of serotonin-induced intracellular cAMP accu...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Homo sapiens (Human))		BDBM50346047
PNG
(2-methyl-5-(2-(pyridin-2-yl)ethyl)-2,3,4,5-tetrahy...)
Show SMILES CN1CCc2c(C1)c1cc(ccc1n2CCc1ccccn1)C#N
Show InChI InChI=1S/C20H20N4/c1-23-10-8-20-18(14-23)17-12-15(13-21)5-6-19(17)24(20)11-7-16-4-2-3-9-22-16/h2-6,9,12H,7-8,10-11,14H2,1H3
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n/an/a 1.29E+3n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human histamine H1 receptor in SK-N-SH cells assessed as inhibition of histamine-induced calcium level increase during phase-1...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Homo sapiens (Human))		BDBM50305261
PNG
(CHEMBL589390 | Dimebolin)
Show SMILES CN1CCc2c(C1)c1cc(C)ccc1n2CCc1ccc(C)nc1
Show InChI InChI=1S/C21H25N3/c1-15-4-7-20-18(12-15)19-14-23(3)10-9-21(19)24(20)11-8-17-6-5-16(2)22-13-17/h4-7,12-13H,8-11,14H2,1-3H3
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n/an/a 1.58E+3n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human histamine H1 receptor in SK-N-SH cells assessed as inhibition of histamine-induced calcium flow during phase-II compound...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))		BDBM50346062
PNG
(2-methyl-5-(2-(pyridin-2-yl)ethyl)-8-(trifluoromet...)
Show SMILES CN1CCc2c(C1)c1cc(ccc1n2CCc1ccccn1)C(F)(F)F
Show InChI InChI=1S/C20H20F3N3/c1-25-10-8-19-17(13-25)16-12-14(20(21,22)23)5-6-18(16)26(19)11-7-15-4-2-3-9-24-15/h2-6,9,12H,7-8,10-11,13H2,1H3
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n/an/a 1.59E+3n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human recombinant 5-HT6 receptor expressed in HEK293 cells assessed as inhibition of serotonin-induced intracellular cAMP accu...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Homo sapiens (Human))		BDBM50346062
PNG
(2-methyl-5-(2-(pyridin-2-yl)ethyl)-8-(trifluoromet...)
Show SMILES CN1CCc2c(C1)c1cc(ccc1n2CCc1ccccn1)C(F)(F)F
Show InChI InChI=1S/C20H20F3N3/c1-25-10-8-19-17(13-25)16-12-14(20(21,22)23)5-6-18(16)26(19)11-7-15-4-2-3-9-24-15/h2-6,9,12H,7-8,10-11,13H2,1H3
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n/an/a 1.59E+3n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human histamine H1 receptor in SK-N-SH cells assessed as inhibition of histamine-induced calcium flow during phase-II compound...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Homo sapiens (Human))		BDBM50346053
PNG
(2-methyl-5-(2-(pyridin-2-yl)ethyl)-2,3,4,5-tetrahy...)
Show SMILES CN1CCc2c(C1)c1ccccc1n2CCc1ccccn1
Show InChI InChI=1S/C19H21N3/c1-21-12-10-19-17(14-21)16-7-2-3-8-18(16)22(19)13-9-15-6-4-5-11-20-15/h2-8,11H,9-10,12-14H2,1H3
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n/an/a 1.82E+3n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human histamine H1 receptor in SK-N-SH cells assessed as inhibition of histamine-induced calcium level increase during phase-1...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))		BDBM50346049
PNG
(2,8-dimethyl-5-(2-pyrazine-2-ylethyl)-gamma-carbol...)
Show SMILES CN1CCc2c(C1)c1cc(C)ccc1n2CCc1cnccn1
Show InChI InChI=1S/C19H22N4/c1-14-3-4-18-16(11-14)17-13-22(2)9-6-19(17)23(18)10-5-15-12-20-7-8-21-15/h3-4,7-8,11-12H,5-6,9-10,13H2,1-2H3
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n/an/a 2.06E+3n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human recombinant 5-HT6 receptor expressed in HEK293 cells assessed as inhibition of serotonin-induced intracellular cAMP accu...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Homo sapiens (Human))		BDBM50346064
PNG
(8-methyl-2-(1-methylpiperidin-4-yl)-5-(2-(pyridin-...)
Show SMILES CN1CCC(CC1)N1CCc2c(C1)c1cc(C)ccc1n2CCc1cccnc1
Show InChI InChI=1S/C25H32N4/c1-19-5-6-24-22(16-19)23-18-28(21-8-12-27(2)13-9-21)14-10-25(23)29(24)15-7-20-4-3-11-26-17-20/h3-6,11,16-17,21H,7-10,12-15,18H2,1-2H3
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n/an/a 2.79E+3n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human histamine H1 receptor in SK-N-SH cells assessed as inhibition of histamine-induced calcium level increase during phase-1...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))		BDBM50346063
PNG
(8-fluoro-2-methyl-5-(2-(pyridin-2-yl)ethyl)-2,3,4,...)
Show SMILES CN1CCc2c(C1)c1cc(F)ccc1n2CCc1ccccn1
Show InChI InChI=1S/C19H20FN3/c1-22-10-8-19-17(13-22)16-12-14(20)5-6-18(16)23(19)11-7-15-4-2-3-9-21-15/h2-6,9,12H,7-8,10-11,13H2,1H3
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n/an/a 2.98E+3n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human recombinant 5-HT6 receptor expressed in HEK293 cells assessed as inhibition of serotonin-induced intracellular cAMP accu...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Homo sapiens (Human))		BDBM50346061
PNG
(2,8-dimethyl-5-(2-(pyridin-3-yl)ethyl)-2,3,4,5-tet...)
Show SMILES CN1CCc2c(C1)c1cc(C)ccc1n2CCc1cccnc1
Show InChI InChI=1S/C20H23N3/c1-15-5-6-19-17(12-15)18-14-22(2)10-8-20(18)23(19)11-7-16-4-3-9-21-13-16/h3-6,9,12-13H,7-8,10-11,14H2,1-2H3
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n/an/a 3.16E+3n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human histamine H1 receptor in SK-N-SH cells assessed as inhibition of histamine-induced calcium flow during phase-II compound...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))		BDBM50346058
PNG
(8-fluoro-2-methyl-5-(2-(pyridin-4-yl)ethyl)-2,3,4,...)
Show SMILES CN1CCc2c(C1)c1cc(F)ccc1n2CCc1ccncc1
Show InChI InChI=1S/C19H20FN3/c1-22-10-7-19-17(13-22)16-12-15(20)2-3-18(16)23(19)11-6-14-4-8-21-9-5-14/h2-5,8-9,12H,6-7,10-11,13H2,1H3
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n/an/a 3.24E+3n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human recombinant 5-HT6 receptor expressed in HEK293 cells assessed as inhibition of serotonin-induced intracellular cAMP accu...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Homo sapiens (Human))		BDBM50346059
PNG
(2,8-dimethyl-5-(2-(pyridin-4-yl)ethyl)-2,3,4,5-tet...)
Show SMILES CN1CCc2c(C1)c1cc(C)ccc1n2CCc1ccncc1
Show InChI InChI=1S/C20H23N3/c1-15-3-4-19-17(13-15)18-14-22(2)11-8-20(18)23(19)12-7-16-5-9-21-10-6-16/h3-6,9-10,13H,7-8,11-12,14H2,1-2H3
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n/an/a 3.98E+3n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human histamine H1 receptor in SK-N-SH cells assessed as inhibition of histamine-induced calcium flow during phase-II compound...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))		BDBM50346060
PNG
(8-methoxy-2-methyl-5-(2-(pyridin-4-yl)ethyl)-2,3,4...)
Show SMILES COc1ccc2n(CCc3ccncc3)c3CCN(C)Cc3c2c1
Show InChI InChI=1S/C20H23N3O/c1-22-11-8-20-18(14-22)17-13-16(24-2)3-4-19(17)23(20)12-7-15-5-9-21-10-6-15/h3-6,9-10,13H,7-8,11-12,14H2,1-2H3
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n/an/a 4.34E+3n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human recombinant 5-HT6 receptor expressed in HEK293 cells assessed as inhibition of serotonin-induced intracellular cAMP accu...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Homo sapiens (Human))		BDBM50346042
PNG
(8-methoxy-2-methyl-5-(2-(pyridin-2-yl)ethyl)-2,3,4...)
Show SMILES COc1ccc2n(CCc3ccccn3)c3CCN(C)Cc3c2c1
Show InChI InChI=1S/C20H23N3O/c1-22-11-9-20-18(14-22)17-13-16(24-2)6-7-19(17)23(20)12-8-15-5-3-4-10-21-15/h3-7,10,13H,8-9,11-12,14H2,1-2H3
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n/an/a 4.67E+3n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human histamine H1 receptor in SK-N-SH cells assessed as inhibition of histamine-induced calcium level increase during phase-1...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))		BDBM50346043
PNG
(2-methyl-5-(2-(pyridin-3-yl)ethyl)-8-(trifluoromet...)
Show SMILES CN1CCc2c(C1)c1cc(ccc1n2CCc1cccnc1)C(F)(F)F
Show InChI InChI=1S/C20H20F3N3/c1-25-9-7-19-17(13-25)16-11-15(20(21,22)23)4-5-18(16)26(19)10-6-14-3-2-8-24-12-14/h2-5,8,11-12H,6-7,9-10,13H2,1H3
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n/an/a 5.80E+3n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human recombinant 5-HT6 receptor expressed in HEK293 cells assessed as inhibition of serotonin-induced intracellular cAMP accu...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))		BDBM50346044
PNG
(2-methyl-5-(2-(pyridin-3-yl)ethyl)-2,3,4,5-tetrahy...)
Show SMILES CN1CCc2c(C1)c1ccccc1n2CCc1cccnc1
Show InChI InChI=1S/C19H21N3/c1-21-11-9-19-17(14-21)16-6-2-3-7-18(16)22(19)12-8-15-5-4-10-20-13-15/h2-7,10,13H,8-9,11-12,14H2,1H3
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n/an/a 5.99E+3n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human recombinant 5-HT6 receptor expressed in HEK293 cells assessed as inhibition of serotonin-induced intracellular cAMP accu...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))		BDBM50346045
PNG
(2-methyl-5-(2-(pyridin-4-yl)ethyl)-8-(trifluoromet...)
Show SMILES CN1CCc2c(C1)c1cc(ccc1n2CCc1ccncc1)C(F)(F)F
Show InChI InChI=1S/C20H20F3N3/c1-25-10-7-19-17(13-25)16-12-15(20(21,22)23)2-3-18(16)26(19)11-6-14-4-8-24-9-5-14/h2-5,8-9,12H,6-7,10-11,13H2,1H3
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n/an/a 6.40E+3n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human recombinant 5-HT6 receptor expressed in HEK293 cells assessed as inhibition of serotonin-induced intracellular cAMP accu...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Homo sapiens (Human))		BDBM50346046
PNG
(2-methyl-8-pyridin-3-yl-5-(2-pyridin-2-ylethyl)-2,...)
Show SMILES CN1CCc2c(C1)c1cc(ccc1n2CCc1ccccn1)-c1cccnc1
Show InChI InChI=1S/C24H24N4/c1-27-13-10-24-22(17-27)21-15-18(19-5-4-11-25-16-19)7-8-23(21)28(24)14-9-20-6-2-3-12-26-20/h2-8,11-12,15-16H,9-10,13-14,17H2,1H3
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n/an/a 7.16E+3n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human histamine H1 receptor in SK-N-SH cells assessed as inhibition of histamine-induced calcium level increase during phase-1...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))		BDBM50346047
PNG
(2-methyl-5-(2-(pyridin-2-yl)ethyl)-2,3,4,5-tetrahy...)
Show SMILES CN1CCc2c(C1)c1cc(ccc1n2CCc1ccccn1)C#N
Show InChI InChI=1S/C20H20N4/c1-23-10-8-20-18(14-23)17-12-15(13-21)5-6-19(17)24(20)11-7-16-4-2-3-9-22-16/h2-6,9,12H,7-8,10-11,14H2,1H3
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n/an/a 7.47E+3n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human recombinant 5-HT6 receptor expressed in HEK293 cells assessed as inhibition of serotonin-induced intracellular cAMP accu...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Homo sapiens (Human))		BDBM50346048
PNG
(8-methyl-2-(1-methylpiperidin-4-yl)-5-(2-(pyridin-...)
Show SMILES CN1CCC(CC1)N1CCc2c(C1)c1cc(C)ccc1n2CCc1ccncc1
Show InChI InChI=1S/C25H32N4/c1-19-3-4-24-22(17-19)23-18-28(21-8-13-27(2)14-9-21)15-10-25(23)29(24)16-7-20-5-11-26-12-6-20/h3-6,11-12,17,21H,7-10,13-16,18H2,1-2H3
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n/an/a 7.57E+3n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human histamine H1 receptor in SK-N-SH cells assessed as inhibition of histamine-induced calcium level increase during phase-1...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
Cholinesterase


(Homo sapiens (Human))		BDBM50305261
PNG
(CHEMBL589390 | Dimebolin)
Show SMILES CN1CCc2c(C1)c1cc(C)ccc1n2CCc1ccc(C)nc1
Show InChI InChI=1S/C21H25N3/c1-15-4-7-20-18(12-15)19-14-23(3)10-9-21(19)24(20)11-8-17-6-5-16(2)22-13-17/h4-7,12-13H,8-11,14H2,1-3H3
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n/an/a 7.90E+3n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Inhibition of BuChE

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Homo sapiens (Human))		BDBM50346049
PNG
(2,8-dimethyl-5-(2-pyrazine-2-ylethyl)-gamma-carbol...)
Show SMILES CN1CCc2c(C1)c1cc(C)ccc1n2CCc1cnccn1
Show InChI InChI=1S/C19H22N4/c1-14-3-4-18-16(11-14)17-13-22(2)9-6-19(17)23(18)10-5-15-12-20-7-8-21-15/h3-4,7-8,11-12H,5-6,9-10,13H2,1-2H3
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n/an/a 7.94E+3n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human histamine H1 receptor in SK-N-SH cells assessed as inhibition of histamine-induced calcium flow during phase-II compound...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))		BDBM50346042
PNG
(8-methoxy-2-methyl-5-(2-(pyridin-2-yl)ethyl)-2,3,4...)
Show SMILES COc1ccc2n(CCc3ccccn3)c3CCN(C)Cc3c2c1
Show InChI InChI=1S/C20H23N3O/c1-22-11-9-20-18(14-22)17-13-16(24-2)6-7-19(17)23(20)12-8-15-5-3-4-10-21-15/h3-7,10,13H,8-9,11-12,14H2,1-2H3
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n/an/a 8.36E+3n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human recombinant 5-HT6 receptor expressed in HEK293 cells assessed as inhibition of serotonin-induced intracellular cAMP accu...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))		BDBM50346050
PNG
(2-methyl-5-(2-(pyridin-4-yl)ethyl)-2,3,4,5-tetrahy...)
Show SMILES CN1CCc2c(C1)c1ccccc1n2CCc1ccncc1
Show InChI InChI=1S/C19H21N3/c1-21-12-9-19-17(14-21)16-4-2-3-5-18(16)22(19)13-8-15-6-10-20-11-7-15/h2-7,10-11H,8-9,12-14H2,1H3
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n/an/a 8.91E+3n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human recombinant 5-HT6 receptor expressed in HEK293 cells assessed as inhibition of serotonin-induced intracellular cAMP accu...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Homo sapiens (Human))		BDBM50346043
PNG
(2-methyl-5-(2-(pyridin-3-yl)ethyl)-8-(trifluoromet...)
Show SMILES CN1CCc2c(C1)c1cc(ccc1n2CCc1cccnc1)C(F)(F)F
Show InChI InChI=1S/C20H20F3N3/c1-25-9-7-19-17(13-25)16-11-15(20(21,22)23)4-5-18(16)26(19)10-6-14-3-2-8-24-12-14/h2-5,8,11-12H,6-7,9-10,13H2,1H3
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n/an/a>1.00E+4n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human histamine H1 receptor in SK-N-SH cells assessed as inhibition of histamine-induced calcium level increase during phase-1...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))		BDBM50346054
PNG
(2-methyl-5-(2-(pyridin-4-yl)ethyl)-2,3,4,5-tetrahy...)
Show SMILES CN1CCc2c(C1)c1cc(ccc1n2CCc1ccncc1)C(O)=O
Show InChI InChI=1S/C20H21N3O2/c1-22-10-7-19-17(13-22)16-12-15(20(24)25)2-3-18(16)23(19)11-6-14-4-8-21-9-5-14/h2-5,8-9,12H,6-7,10-11,13H2,1H3,(H,24,25)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human recombinant 5-HT6 receptor expressed in HEK293 cells assessed as inhibition of serotonin-induced intracellular cAMP accu...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Homo sapiens (Human))		BDBM50346054
PNG
(2-methyl-5-(2-(pyridin-4-yl)ethyl)-2,3,4,5-tetrahy...)
Show SMILES CN1CCc2c(C1)c1cc(ccc1n2CCc1ccncc1)C(O)=O
Show InChI InChI=1S/C20H21N3O2/c1-22-10-7-19-17(13-22)16-12-15(20(24)25)2-3-18(16)23(19)11-6-14-4-8-21-9-5-14/h2-5,8-9,12H,6-7,10-11,13H2,1H3,(H,24,25)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human histamine H1 receptor in SK-N-SH cells assessed as inhibition of histamine-induced calcium level increase during phase-1...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Homo sapiens (Human))		BDBM50346051
PNG
(2,8-dimethyl-5-(2-(pyridin-2-yl)ethyl)-2,3,4,5-tet...)
Show SMILES CN1CCc2c(C1)c1cc(C)ccc1n2CCc1ccccn1
Show InChI InChI=1S/C20H23N3/c1-15-6-7-19-17(13-15)18-14-22(2)11-9-20(18)23(19)12-8-16-5-3-4-10-21-16/h3-7,10,13H,8-9,11-12,14H2,1-2H3
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n/an/a 1.00E+4n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human histamine H1 receptor in SK-N-SH cells assessed as inhibition of histamine-induced calcium flow during phase-II compound...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))		BDBM50346056
PNG
(8-fluoro-2-methyl-5-(2-(pyridin-3-yl)ethyl)-2,3,4,...)
Show SMILES CN1CCc2c(C1)c1cc(F)ccc1n2CCc1cccnc1
Show InChI InChI=1S/C19H20FN3/c1-22-9-7-19-17(13-22)16-11-15(20)4-5-18(16)23(19)10-6-14-3-2-8-21-12-14/h2-5,8,11-12H,6-7,9-10,13H2,1H3
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n/an/a>1.00E+4n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human recombinant 5-HT6 receptor expressed in HEK293 cells assessed as inhibition of serotonin-induced intracellular cAMP accu...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Homo sapiens (Human))		BDBM50346055
PNG
(8-methyl-2-(1-methylpiperidin-4-yl)-5-(2-(pyridin-...)
Show SMILES CN1CCC(CC1)N1CCc2c(C1)c1cc(C)ccc1n2CCc1ccccn1
Show InChI InChI=1S/C25H32N4/c1-19-6-7-24-22(17-19)23-18-28(21-9-13-27(2)14-10-21)15-11-25(23)29(24)16-8-20-5-3-4-12-26-20/h3-7,12,17,21H,8-11,13-16,18H2,1-2H3
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n/an/a>1.00E+4n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human histamine H1 receptor in SK-N-SH cells assessed as inhibition of histamine-induced calcium level increase during phase-1...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))		BDBM50346052
PNG
(8-fluoro-2-methyl-5-(2-(6-methylpyridin-3-yl)ethyl...)
Show SMILES CN1CCc2c(C1)c1cc(F)ccc1n2CCc1ccc(C)nc1
Show InChI InChI=1S/C20H22FN3/c1-14-3-4-15(12-22-14)7-10-24-19-6-5-16(21)11-17(19)18-13-23(2)9-8-20(18)24/h3-6,11-12H,7-10,13H2,1-2H3
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n/an/a 1.07E+4n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human recombinant 5-HT6 receptor expressed in HEK293 cells assessed as inhibition of serotonin-induced intracellular cAMP accu...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))		BDBM50346053
PNG
(2-methyl-5-(2-(pyridin-2-yl)ethyl)-2,3,4,5-tetrahy...)
Show SMILES CN1CCc2c(C1)c1ccccc1n2CCc1ccccn1
Show InChI InChI=1S/C19H21N3/c1-21-12-10-19-17(14-21)16-7-2-3-8-18(16)22(19)13-9-15-6-4-5-11-20-15/h2-8,11H,9-10,12-14H2,1H3
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n/an/a 1.58E+4n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human recombinant 5-HT6 receptor expressed in HEK293 cells assessed as inhibition of serotonin-induced intracellular cAMP accu...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))		BDBM50346046
PNG
(2-methyl-8-pyridin-3-yl-5-(2-pyridin-2-ylethyl)-2,...)
Show SMILES CN1CCc2c(C1)c1cc(ccc1n2CCc1ccccn1)-c1cccnc1
Show InChI InChI=1S/C24H24N4/c1-27-13-10-24-22(17-27)21-15-18(19-5-4-11-25-16-19)7-8-23(21)28(24)14-9-20-6-2-3-12-26-20/h2-8,11-12,15-16H,9-10,13-14,17H2,1H3
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n/an/a 4.32E+4n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human recombinant 5-HT6 receptor expressed in HEK293 cells assessed as inhibition of serotonin-induced intracellular cAMP accu...

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Homo sapiens (Human))		BDBM50305261
PNG
(CHEMBL589390 | Dimebolin)
Show SMILES CN1CCc2c(C1)c1cc(C)ccc1n2CCc1ccc(C)nc1
Show InChI InChI=1S/C21H25N3/c1-15-4-7-20-18(12-15)19-14-23(3)10-9-21(19)24(20)11-8-17-6-5-16(2)22-13-17/h4-7,12-13H,8-11,14H2,1-3H3
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n/an/a 4.50E+4n/an/an/an/an/an/a



Chemical Diversity Research Institute

Curated by ChEMBL


Assay Description
Inhibition of AChE

Bioorg Med Chem Lett 19: 3183-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.128
BindingDB Entry DOI: 10.7270/Q2FJ2H4X
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%