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PubMed code 21186123

Compile data set for download or QSAR
Found 36 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 H3 receptor


(Homo sapiens (Human))		BDBM50333520
PNG
(2-(1,4'-bipiperidin-1'-yl)-5-(6-methoxypyridin-2-y...)
Show SMILES COc1cccc(n1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
Show InChI InChI=1S/C18H25N5OS/c1-24-16-7-5-6-15(19-16)17-20-21-18(25-17)23-12-8-14(9-13-23)22-10-3-2-4-11-22/h5-7,14H,2-4,8-13H2,1H3
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PubMed
 3.5n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-alpha-methylhistamine from human recombinant histamine H3 receptor expressed in HEK cells after 30 mins by scintillation count...

Bioorg Med Chem Lett 21: 861-4 (2011)


Article DOI: 10.1016/j.bmcl.2010.11.065
BindingDB Entry DOI: 10.7270/Q20V8D24
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))		BDBM50333511
PNG
(1-(3-(5-(1,4'-bipiperidin-1'-yl)-1,3,4-thiadiazol-...)
Show SMILES CC(=O)c1cccc(c1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
Show InChI InChI=1S/C20H26N4OS/c1-15(25)16-6-5-7-17(14-16)19-21-22-20(26-19)24-12-8-18(9-13-24)23-10-3-2-4-11-23/h5-7,14,18H,2-4,8-13H2,1H3
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 4n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-alpha-methylhistamine from human recombinant histamine H3 receptor expressed in HEK cells after 30 mins by scintillation count...

Bioorg Med Chem Lett 21: 861-4 (2011)


Article DOI: 10.1016/j.bmcl.2010.11.065
BindingDB Entry DOI: 10.7270/Q20V8D24
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))		BDBM50333521
PNG
(2-(1,4'-bipiperidin-1'-yl)-5-(6-methylpyridin-2-yl...)
Show SMILES Cc1cccc(n1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
Show InChI InChI=1S/C18H25N5S/c1-14-6-5-7-16(19-14)17-20-21-18(24-17)23-12-8-15(9-13-23)22-10-3-2-4-11-22/h5-7,15H,2-4,8-13H2,1H3
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 6.10n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-alpha-methylhistamine from human recombinant histamine H3 receptor expressed in HEK cells after 30 mins by scintillation count...

Bioorg Med Chem Lett 21: 861-4 (2011)


Article DOI: 10.1016/j.bmcl.2010.11.065
BindingDB Entry DOI: 10.7270/Q20V8D24
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))		BDBM50333534
PNG
(1-(2-(5-(1,4'-bipiperidin-1'-yl)-1,3,4-thiadiazol-...)
Show SMILES CC(=O)c1ccccc1-c1nnc(s1)N1CCC(CC1)N1CCCCC1
Show InChI InChI=1S/C20H26N4OS/c1-15(25)17-7-3-4-8-18(17)19-21-22-20(26-19)24-13-9-16(10-14-24)23-11-5-2-6-12-23/h3-4,7-8,16H,2,5-6,9-14H2,1H3
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 8.40n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-alpha-methylhistamine from human recombinant histamine H3 receptor expressed in HEK cells after 30 mins by scintillation count...

Bioorg Med Chem Lett 21: 861-4 (2011)


Article DOI: 10.1016/j.bmcl.2010.11.065
BindingDB Entry DOI: 10.7270/Q20V8D24
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))		BDBM50333515
PNG
(3-(5-(1,4'-bipiperidin-1'-yl)-1,3,4-thiadiazol-2-y...)
Show SMILES COc1cc(cc(c1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1)C#N
Show InChI InChI=1S/C20H25N5OS/c1-26-18-12-15(14-21)11-16(13-18)19-22-23-20(27-19)25-9-5-17(6-10-25)24-7-3-2-4-8-24/h11-13,17H,2-10H2,1H3
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 12n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-alpha-methylhistamine from human recombinant histamine H3 receptor expressed in HEK cells after 30 mins by scintillation count...

Bioorg Med Chem Lett 21: 861-4 (2011)


Article DOI: 10.1016/j.bmcl.2010.11.065
BindingDB Entry DOI: 10.7270/Q20V8D24
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))		BDBM50333514
PNG
(2-(1,4'-bipiperidin-1'-yl)-5-(3-chloro-5-methoxyph...)
Show SMILES COc1cc(Cl)cc(c1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
Show InChI InChI=1S/C19H25ClN4OS/c1-25-17-12-14(11-15(20)13-17)18-21-22-19(26-18)24-9-5-16(6-10-24)23-7-3-2-4-8-23/h11-13,16H,2-10H2,1H3
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 12n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-alpha-methylhistamine from human recombinant histamine H3 receptor expressed in HEK cells after 30 mins by scintillation count...

Bioorg Med Chem Lett 21: 861-4 (2011)


Article DOI: 10.1016/j.bmcl.2010.11.065
BindingDB Entry DOI: 10.7270/Q20V8D24
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))		BDBM50333513
PNG
(2-(1,4'-bipiperidin-1'-yl)-5-(3,5-dimethoxyphenyl)...)
Show SMILES COc1cc(OC)cc(c1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
Show InChI InChI=1S/C20H28N4O2S/c1-25-17-12-15(13-18(14-17)26-2)19-21-22-20(27-19)24-10-6-16(7-11-24)23-8-4-3-5-9-23/h12-14,16H,3-11H2,1-2H3
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 15n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-alpha-methylhistamine from human recombinant histamine H3 receptor expressed in HEK cells after 30 mins by scintillation count...

Bioorg Med Chem Lett 21: 861-4 (2011)


Article DOI: 10.1016/j.bmcl.2010.11.065
BindingDB Entry DOI: 10.7270/Q20V8D24
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))		BDBM50333516
PNG
(2-(1,4'-bipiperidin-1'-yl)-5-(3-fluoro-5-methoxyph...)
Show SMILES COc1cc(F)cc(c1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
Show InChI InChI=1S/C19H25FN4OS/c1-25-17-12-14(11-15(20)13-17)18-21-22-19(26-18)24-9-5-16(6-10-24)23-7-3-2-4-8-23/h11-13,16H,2-10H2,1H3
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 16n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-alpha-methylhistamine from human recombinant histamine H3 receptor expressed in HEK cells after 30 mins by scintillation count...

Bioorg Med Chem Lett 21: 861-4 (2011)


Article DOI: 10.1016/j.bmcl.2010.11.065
BindingDB Entry DOI: 10.7270/Q20V8D24
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))		BDBM50333518
PNG
(5-(5-(1,4'-bipiperidin-1'-yl)-1,3,4-thiadiazol-2-y...)
Show SMILES N#Cc1cc(cc(c1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1)C#N
Show InChI InChI=1S/C20H22N6S/c21-13-15-10-16(14-22)12-17(11-15)19-23-24-20(27-19)26-8-4-18(5-9-26)25-6-2-1-3-7-25/h10-12,18H,1-9H2
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 23n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-alpha-methylhistamine from human recombinant histamine H3 receptor expressed in HEK cells after 30 mins by scintillation count...

Bioorg Med Chem Lett 21: 861-4 (2011)


Article DOI: 10.1016/j.bmcl.2010.11.065
BindingDB Entry DOI: 10.7270/Q20V8D24
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))		BDBM50333524
PNG
(2-(1,4'-bipiperidin-1'-yl)-5-(2-methoxythiazol-5-y...)
Show SMILES COc1ncc(s1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
Show InChI InChI=1S/C16H23N5OS2/c1-22-16-17-11-13(23-16)14-18-19-15(24-14)21-9-5-12(6-10-21)20-7-3-2-4-8-20/h11-12H,2-10H2,1H3
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 28n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-alpha-methylhistamine from human recombinant histamine H3 receptor expressed in HEK cells after 30 mins by scintillation count...

Bioorg Med Chem Lett 21: 861-4 (2011)


Article DOI: 10.1016/j.bmcl.2010.11.065
BindingDB Entry DOI: 10.7270/Q20V8D24
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))		BDBM50333519
PNG
(2-(1,4'-bipiperidin-1'-yl)-5-(pyridin-2-yl)-1,3,4-...)
Show SMILES C1CCN(CC1)C1CCN(CC1)c1nnc(s1)-c1ccccn1
Show InChI InChI=1S/C17H23N5S/c1-4-10-21(11-5-1)14-7-12-22(13-8-14)17-20-19-16(23-17)15-6-2-3-9-18-15/h2-3,6,9,14H,1,4-5,7-8,10-13H2
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 30n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-alpha-methylhistamine from human recombinant histamine H3 receptor expressed in HEK cells after 30 mins by scintillation count...

Bioorg Med Chem Lett 21: 861-4 (2011)


Article DOI: 10.1016/j.bmcl.2010.11.065
BindingDB Entry DOI: 10.7270/Q20V8D24
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))		BDBM50333506
PNG
(2-(1,4'-bipiperidin-1'-yl)-5-(3-methoxyphenyl)-1,3...)
Show SMILES COc1cccc(c1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
Show InChI InChI=1S/C19H26N4OS/c1-24-17-7-5-6-15(14-17)18-20-21-19(25-18)23-12-8-16(9-13-23)22-10-3-2-4-11-22/h5-7,14,16H,2-4,8-13H2,1H3
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 31.9n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-alpha-methylhistamine from human recombinant histamine H3 receptor expressed in HEK cells after 30 mins by scintillation count...

Bioorg Med Chem Lett 21: 861-4 (2011)


Article DOI: 10.1016/j.bmcl.2010.11.065
BindingDB Entry DOI: 10.7270/Q20V8D24
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))		BDBM50333533
PNG
(2-(1,4'-bipiperidin-1'-yl)-5-o-tolyl-1,3,4-thiadia...)
Show SMILES Cc1ccccc1-c1nnc(s1)N1CCC(CC1)N1CCCCC1
Show InChI InChI=1S/C19H26N4S/c1-15-7-3-4-8-17(15)18-20-21-19(24-18)23-13-9-16(10-14-23)22-11-5-2-6-12-22/h3-4,7-8,16H,2,5-6,9-14H2,1H3
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 36n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-alpha-methylhistamine from human recombinant histamine H3 receptor expressed in HEK cells after 30 mins by scintillation count...

Bioorg Med Chem Lett 21: 861-4 (2011)


Article DOI: 10.1016/j.bmcl.2010.11.065
BindingDB Entry DOI: 10.7270/Q20V8D24
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))		BDBM50333531
PNG
(2-(1,4'-bipiperidin-1'-yl)-5-(2-fluorophenyl)-1,3,...)
Show SMILES Fc1ccccc1-c1nnc(s1)N1CCC(CC1)N1CCCCC1
Show InChI InChI=1S/C18H23FN4S/c19-16-7-3-2-6-15(16)17-20-21-18(24-17)23-12-8-14(9-13-23)22-10-4-1-5-11-22/h2-3,6-7,14H,1,4-5,8-13H2
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 36n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-alpha-methylhistamine from human recombinant histamine H3 receptor expressed in HEK cells after 30 mins by scintillation count...

Bioorg Med Chem Lett 21: 861-4 (2011)


Article DOI: 10.1016/j.bmcl.2010.11.065
BindingDB Entry DOI: 10.7270/Q20V8D24
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))		BDBM50333535
PNG
(4-(5-(1,4'-bipiperidin-1'-yl)-1,3,4-thiadiazol-2-y...)
Show SMILES N#Cc1ccc(cc1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
Show InChI InChI=1S/C19H23N5S/c20-14-15-4-6-16(7-5-15)18-21-22-19(25-18)24-12-8-17(9-13-24)23-10-2-1-3-11-23/h4-7,17H,1-3,8-13H2
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 36.4n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-alpha-methylhistamine from human recombinant histamine H3 receptor expressed in HEK cells after 30 mins by scintillation count...

Bioorg Med Chem Lett 21: 861-4 (2011)


Article DOI: 10.1016/j.bmcl.2010.11.065
BindingDB Entry DOI: 10.7270/Q20V8D24
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))		BDBM50333536
PNG
(2-(1,4'-bipiperidin-1'-yl)-5-(4-fluorophenyl)-1,3,...)
Show SMILES Fc1ccc(cc1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
Show InChI InChI=1S/C18H23FN4S/c19-15-6-4-14(5-7-15)17-20-21-18(24-17)23-12-8-16(9-13-23)22-10-2-1-3-11-22/h4-7,16H,1-3,8-13H2
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 39n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-alpha-methylhistamine from human recombinant histamine H3 receptor expressed in HEK cells after 30 mins by scintillation count...

Bioorg Med Chem Lett 21: 861-4 (2011)


Article DOI: 10.1016/j.bmcl.2010.11.065
BindingDB Entry DOI: 10.7270/Q20V8D24
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))		BDBM50333530
PNG
(2-(1,4'-bipiperidin-1'-yl)-5-(2-methoxyphenyl)-1,3...)
Show SMILES COc1ccccc1-c1nnc(s1)N1CCC(CC1)N1CCCCC1
Show InChI InChI=1S/C19H26N4OS/c1-24-17-8-4-3-7-16(17)18-20-21-19(25-18)23-13-9-15(10-14-23)22-11-5-2-6-12-22/h3-4,7-8,15H,2,5-6,9-14H2,1H3
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 40n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-alpha-methylhistamine from human recombinant histamine H3 receptor expressed in HEK cells after 30 mins by scintillation count...

Bioorg Med Chem Lett 21: 861-4 (2011)


Article DOI: 10.1016/j.bmcl.2010.11.065
BindingDB Entry DOI: 10.7270/Q20V8D24
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))		BDBM50333525
PNG
(2-(1,4'-bipiperidin-1'-yl)-5-(4-methoxyphenyl)-1,3...)
Show SMILES COc1ccc(cc1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
Show InChI InChI=1S/C19H26N4OS/c1-24-17-7-5-15(6-8-17)18-20-21-19(25-18)23-13-9-16(10-14-23)22-11-3-2-4-12-22/h5-8,16H,2-4,9-14H2,1H3
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 40.1n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-alpha-methylhistamine from human recombinant histamine H3 receptor expressed in HEK cells after 30 mins by scintillation count...

Bioorg Med Chem Lett 21: 861-4 (2011)


Article DOI: 10.1016/j.bmcl.2010.11.065
BindingDB Entry DOI: 10.7270/Q20V8D24
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))		BDBM50333507
PNG
(3-(5-(1,4'-bipiperidin-1'-yl)-1,3,4-thiadiazol-2-y...)
Show SMILES N#Cc1cccc(c1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
Show InChI InChI=1S/C19H23N5S/c20-14-15-5-4-6-16(13-15)18-21-22-19(25-18)24-11-7-17(8-12-24)23-9-2-1-3-10-23/h4-6,13,17H,1-3,7-12H2
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 42.6n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-alpha-methylhistamine from human recombinant histamine H3 receptor expressed in HEK cells after 30 mins by scintillation count...

Bioorg Med Chem Lett 21: 861-4 (2011)


Article DOI: 10.1016/j.bmcl.2010.11.065
BindingDB Entry DOI: 10.7270/Q20V8D24
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))		BDBM50333504
PNG
(1-(5-(1,4'-bipiperidin-1'-yl)-1,3,4-thiadiazol-2-y...)
Show SMILES O=C(NC1CCCC1)Nc1nnc(s1)N1CCC(CC1)N1CCCCC1
Show InChI InChI=1S/C18H30N6OS/c25-16(19-14-6-2-3-7-14)20-17-21-22-18(26-17)24-12-8-15(9-13-24)23-10-4-1-5-11-23/h14-15H,1-13H2,(H2,19,20,21,25)
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 48.6n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-alpha-methylhistamine from human recombinant histamine H3 receptor expressed in HEK cells after 30 mins by scintillation count...

Bioorg Med Chem Lett 21: 861-4 (2011)


Article DOI: 10.1016/j.bmcl.2010.11.065
BindingDB Entry DOI: 10.7270/Q20V8D24
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))		BDBM50333509
PNG
(2-(1,4'-bipiperidin-1'-yl)-5-(3-chlorophenyl)-1,3,...)
Show SMILES Clc1cccc(c1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
Show InChI InChI=1S/C18H23ClN4S/c19-15-6-4-5-14(13-15)17-20-21-18(24-17)23-11-7-16(8-12-23)22-9-2-1-3-10-22/h4-6,13,16H,1-3,7-12H2
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 49n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-alpha-methylhistamine from human recombinant histamine H3 receptor expressed in HEK cells after 30 mins by scintillation count...

Bioorg Med Chem Lett 21: 861-4 (2011)


Article DOI: 10.1016/j.bmcl.2010.11.065
BindingDB Entry DOI: 10.7270/Q20V8D24
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))		BDBM50333517
PNG
(2-(1,4'-bipiperidin-1'-yl)-5-(3,5-difluorophenyl)-...)
Show SMILES Fc1cc(F)cc(c1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
Show InChI InChI=1S/C18H22F2N4S/c19-14-10-13(11-15(20)12-14)17-21-22-18(25-17)24-8-4-16(5-9-24)23-6-2-1-3-7-23/h10-12,16H,1-9H2
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 50n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-alpha-methylhistamine from human recombinant histamine H3 receptor expressed in HEK cells after 30 mins by scintillation count...

Bioorg Med Chem Lett 21: 861-4 (2011)


Article DOI: 10.1016/j.bmcl.2010.11.065
BindingDB Entry DOI: 10.7270/Q20V8D24
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))		BDBM50333510
PNG
(2-(1,4'-bipiperidin-1'-yl)-5-m-tolyl-1,3,4-thiadia...)
Show SMILES Cc1cccc(c1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
Show InChI InChI=1S/C19H26N4S/c1-15-6-5-7-16(14-15)18-20-21-19(24-18)23-12-8-17(9-13-23)22-10-3-2-4-11-22/h5-7,14,17H,2-4,8-13H2,1H3
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 60n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-alpha-methylhistamine from human recombinant histamine H3 receptor expressed in HEK cells after 30 mins by scintillation count...

Bioorg Med Chem Lett 21: 861-4 (2011)


Article DOI: 10.1016/j.bmcl.2010.11.065
BindingDB Entry DOI: 10.7270/Q20V8D24
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))		BDBM50333508
PNG
(2-(1,4'-bipiperidin-1'-yl)-5-(3-fluorophenyl)-1,3,...)
Show SMILES Fc1cccc(c1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
Show InChI InChI=1S/C18H23FN4S/c19-15-6-4-5-14(13-15)17-20-21-18(24-17)23-11-7-16(8-12-23)22-9-2-1-3-10-22/h4-6,13,16H,1-3,7-12H2
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 62n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-alpha-methylhistamine from human recombinant histamine H3 receptor expressed in HEK cells after 30 mins by scintillation count...

Bioorg Med Chem Lett 21: 861-4 (2011)


Article DOI: 10.1016/j.bmcl.2010.11.065
BindingDB Entry DOI: 10.7270/Q20V8D24
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))		BDBM50333539
PNG
(1-(4-(5-(1,4'-bipiperidin-1'-yl)-1,3,4-thiadiazol-...)
Show SMILES CC(=O)c1ccc(cc1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
Show InChI InChI=1S/C20H26N4OS/c1-15(25)16-5-7-17(8-6-16)19-21-22-20(26-19)24-13-9-18(10-14-24)23-11-3-2-4-12-23/h5-8,18H,2-4,9-14H2,1H3
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 65n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-alpha-methylhistamine from human recombinant histamine H3 receptor expressed in HEK cells after 30 mins by scintillation count...

Bioorg Med Chem Lett 21: 861-4 (2011)


Article DOI: 10.1016/j.bmcl.2010.11.065
BindingDB Entry DOI: 10.7270/Q20V8D24
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))		BDBM50333532
PNG
(2-(1,4'-bipiperidin-1'-yl)-5-(2-chlorophenyl)-1,3,...)
Show SMILES Clc1ccccc1-c1nnc(s1)N1CCC(CC1)N1CCCCC1
Show InChI InChI=1S/C18H23ClN4S/c19-16-7-3-2-6-15(16)17-20-21-18(24-17)23-12-8-14(9-13-23)22-10-4-1-5-11-22/h2-3,6-7,14H,1,4-5,8-13H2
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 69n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-alpha-methylhistamine from human recombinant histamine H3 receptor expressed in HEK cells after 30 mins by scintillation count...

Bioorg Med Chem Lett 21: 861-4 (2011)


Article DOI: 10.1016/j.bmcl.2010.11.065
BindingDB Entry DOI: 10.7270/Q20V8D24
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))		BDBM50333512
PNG
(2-(1,4'-bipiperidin-1'-yl)-5-(3,5-dichlorophenyl)-...)
Show SMILES Clc1cc(Cl)cc(c1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
Show InChI InChI=1S/C18H22Cl2N4S/c19-14-10-13(11-15(20)12-14)17-21-22-18(25-17)24-8-4-16(5-9-24)23-6-2-1-3-7-23/h10-12,16H,1-9H2
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 72n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-alpha-methylhistamine from human recombinant histamine H3 receptor expressed in HEK cells after 30 mins by scintillation count...

Bioorg Med Chem Lett 21: 861-4 (2011)


Article DOI: 10.1016/j.bmcl.2010.11.065
BindingDB Entry DOI: 10.7270/Q20V8D24
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))		BDBM50333505
PNG
(2-(1,4'-bipiperidin-1'-yl)-5-phenyl-1,3,4-thiadiaz...)
Show SMILES C1CCN(CC1)C1CCN(CC1)c1nnc(s1)-c1ccccc1
Show InChI InChI=1S/C18H24N4S/c1-3-7-15(8-4-1)17-19-20-18(23-17)22-13-9-16(10-14-22)21-11-5-2-6-12-21/h1,3-4,7-8,16H,2,5-6,9-14H2
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 80.1n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-alpha-methylhistamine from human recombinant histamine H3 receptor expressed in HEK cells after 30 mins by scintillation count...

Bioorg Med Chem Lett 21: 861-4 (2011)


Article DOI: 10.1016/j.bmcl.2010.11.065
BindingDB Entry DOI: 10.7270/Q20V8D24
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))		BDBM50333522
PNG
(2-(1,4'-bipiperidin-1'-yl)-5-(pyrimidin-2-yl)-1,3,...)
Show SMILES C1CCN(CC1)C1CCN(CC1)c1nnc(s1)-c1ncccn1
Show InChI InChI=1S/C16H22N6S/c1-2-9-21(10-3-1)13-5-11-22(12-6-13)16-20-19-15(23-16)14-17-7-4-8-18-14/h4,7-8,13H,1-3,5-6,9-12H2
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 103n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-alpha-methylhistamine from human recombinant histamine H3 receptor expressed in HEK cells after 30 mins by scintillation count...

Bioorg Med Chem Lett 21: 861-4 (2011)


Article DOI: 10.1016/j.bmcl.2010.11.065
BindingDB Entry DOI: 10.7270/Q20V8D24
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))		BDBM50333537
PNG
(2-(1,4'-bipiperidin-1'-yl)-5-(4-chlorophenyl)-1,3,...)
Show SMILES Clc1ccc(cc1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
Show InChI InChI=1S/C18H23ClN4S/c19-15-6-4-14(5-7-15)17-20-21-18(24-17)23-12-8-16(9-13-23)22-10-2-1-3-11-22/h4-7,16H,1-3,8-13H2
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 161n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-alpha-methylhistamine from human recombinant histamine H3 receptor expressed in HEK cells after 30 mins by scintillation count...

Bioorg Med Chem Lett 21: 861-4 (2011)


Article DOI: 10.1016/j.bmcl.2010.11.065
BindingDB Entry DOI: 10.7270/Q20V8D24
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))		BDBM50333526
PNG
(2-(4-ethylpiperazin-1-yl)-5-(4-methoxyphenyl)-1,3,...)
Show SMILES CCN1CCN(CC1)c1nnc(s1)-c1ccc(OC)cc1
Show InChI InChI=1S/C15H20N4OS/c1-3-18-8-10-19(11-9-18)15-17-16-14(21-15)12-4-6-13(20-2)7-5-12/h4-7H,3,8-11H2,1-2H3
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 162n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-alpha-methylhistamine from human recombinant histamine H3 receptor expressed in HEK cells after 30 mins by scintillation count...

Bioorg Med Chem Lett 21: 861-4 (2011)


Article DOI: 10.1016/j.bmcl.2010.11.065
BindingDB Entry DOI: 10.7270/Q20V8D24
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))		BDBM50333538
PNG
(2-(1,4'-bipiperidin-1'-yl)-5-p-tolyl-1,3,4-thiadia...)
Show SMILES Cc1ccc(cc1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
Show InChI InChI=1S/C19H26N4S/c1-15-5-7-16(8-6-15)18-20-21-19(24-18)23-13-9-17(10-14-23)22-11-3-2-4-12-22/h5-8,17H,2-4,9-14H2,1H3
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 163n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-alpha-methylhistamine from human recombinant histamine H3 receptor expressed in HEK cells after 30 mins by scintillation count...

Bioorg Med Chem Lett 21: 861-4 (2011)


Article DOI: 10.1016/j.bmcl.2010.11.065
BindingDB Entry DOI: 10.7270/Q20V8D24
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))		BDBM50333527
PNG
(2-(4-cyclopentylpiperazin-1-yl)-5-(4-methoxyphenyl...)
Show SMILES COc1ccc(cc1)-c1nnc(s1)N1CCN(CC1)C1CCCC1
Show InChI InChI=1S/C18H24N4OS/c1-23-16-8-6-14(7-9-16)17-19-20-18(24-17)22-12-10-21(11-13-22)15-4-2-3-5-15/h6-9,15H,2-5,10-13H2,1H3
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 182n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-alpha-methylhistamine from human recombinant histamine H3 receptor expressed in HEK cells after 30 mins by scintillation count...

Bioorg Med Chem Lett 21: 861-4 (2011)


Article DOI: 10.1016/j.bmcl.2010.11.065
BindingDB Entry DOI: 10.7270/Q20V8D24
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))		BDBM50333523
PNG
(2-(1,4'-bipiperidin-1'-yl)-5-(1H-pyrazol-4-yl)-1,3...)
Show SMILES C1CCN(CC1)C1CCN(CC1)c1nnc(s1)-c1cn[nH]c1
Show InChI InChI=1S/C15H22N6S/c1-2-6-20(7-3-1)13-4-8-21(9-5-13)15-19-18-14(22-15)12-10-16-17-11-12/h10-11,13H,1-9H2,(H,16,17)
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 192n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-alpha-methylhistamine from human recombinant histamine H3 receptor expressed in HEK cells after 30 mins by scintillation count...

Bioorg Med Chem Lett 21: 861-4 (2011)


Article DOI: 10.1016/j.bmcl.2010.11.065
BindingDB Entry DOI: 10.7270/Q20V8D24
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))		BDBM50333529
PNG
(2-(4-methoxyphenyl)-5-(4-(pyrrolidin-1-yl)piperidi...)
Show SMILES COc1ccc(cc1)-c1nnc(s1)N1CCC(CC1)N1CCCC1
Show InChI InChI=1S/C18H24N4OS/c1-23-16-6-4-14(5-7-16)17-19-20-18(24-17)22-12-8-15(9-13-22)21-10-2-3-11-21/h4-7,15H,2-3,8-13H2,1H3
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 601n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-alpha-methylhistamine from human recombinant histamine H3 receptor expressed in HEK cells after 30 mins by scintillation count...

Bioorg Med Chem Lett 21: 861-4 (2011)


Article DOI: 10.1016/j.bmcl.2010.11.065
BindingDB Entry DOI: 10.7270/Q20V8D24
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))		BDBM50333528
PNG
(2-(hexahydropyrrolo[1,2-a]pyrazin-2(1H)-yl)-5-(4-m...)
Show SMILES COc1ccc(cc1)-c1nnc(s1)N1CCN2CCCC2C1
Show InChI InChI=1S/C16H20N4OS/c1-21-14-6-4-12(5-7-14)15-17-18-16(22-15)20-10-9-19-8-2-3-13(19)11-20/h4-7,13H,2-3,8-11H2,1H3
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 653n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-alpha-methylhistamine from human recombinant histamine H3 receptor expressed in HEK cells after 30 mins by scintillation count...

Bioorg Med Chem Lett 21: 861-4 (2011)


Article DOI: 10.1016/j.bmcl.2010.11.065
BindingDB Entry DOI: 10.7270/Q20V8D24
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%