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PubMed code 15163206

Compile data set for download or QSAR
Found 18 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


(Rattus norvegicus (rat))
BDBM22914
PNG
(CHEMBL260374 | N-cyclohexyl-4-(1H-imidazol-5-yl)pi...)
Show SMILES S=C(NC1CCCCC1)N1CCC(CC1)c1cnc[nH]1
Show InChI InChI=1S/C15H24N4S/c20-15(18-13-4-2-1-3-5-13)19-8-6-12(7-9-19)14-10-16-11-17-14/h10-13H,1-9H2,(H,16,17)(H,18,20)
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PubMed
4n/an/an/an/an/an/an/an/a



University College London

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against against histamine H3 receptor using [3H]-Histamine as radioligand from rat cerebral cortex synaptosomes


J Med Chem 47: 3264-74 (2004)


Article DOI: 10.1021/jm031141p
BindingDB Entry DOI: 10.7270/Q2F47NK5
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50148122
PNG
(4-[3-(3-Trifluoromethyl-phenoxy)-propyl]-1H-imidaz...)
Show SMILES FC(F)(F)c1cccc(OCCCc2cnc[nH]2)c1
Show InChI InChI=1S/C13H13F3N2O/c14-13(15,16)10-3-1-5-12(7-10)19-6-2-4-11-8-17-9-18-11/h1,3,5,7-9H,2,4,6H2,(H,17,18)
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8.40n/an/an/an/an/an/an/an/a



University College London

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against against histamine H3 receptor using [3H]-Histamine as radioligand from rat cerebral cortex synaptosomes


J Med Chem 47: 3264-74 (2004)


Article DOI: 10.1021/jm031141p
BindingDB Entry DOI: 10.7270/Q2F47NK5
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50148120
PNG
(4-[3-(3-Nitro-phenoxy)-propyl]-1H-imidazole | CHEM...)
Show SMILES [O-][N+](=O)c1cccc(OCCCc2cnc[nH]2)c1
Show InChI InChI=1S/C12H13N3O3/c16-15(17)11-4-1-5-12(7-11)18-6-2-3-10-8-13-9-14-10/h1,4-5,7-9H,2-3,6H2,(H,13,14)
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9.40n/an/an/an/an/an/an/an/a



University College London

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against against histamine H3 receptor using [3H]-Histamine as radioligand from rat cerebral cortex synaptosomes


J Med Chem 47: 3264-74 (2004)


Article DOI: 10.1021/jm031141p
BindingDB Entry DOI: 10.7270/Q2F47NK5
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50053278
PNG
(4-[3-(1H-Imidazol-4-yl)-propoxy]-benzonitrile | 4-...)
Show SMILES N#Cc1ccc(OCCCc2cnc[nH]2)cc1
Show InChI InChI=1S/C13H13N3O/c14-8-11-3-5-13(6-4-11)17-7-1-2-12-9-15-10-16-12/h3-6,9-10H,1-2,7H2,(H,15,16)
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12n/an/an/an/an/an/an/an/a



University College London

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against against histamine H3 receptor using [3H]-Histamine as radioligand from rat cerebral cortex synaptosomes


J Med Chem 47: 3264-74 (2004)


Article DOI: 10.1021/jm031141p
BindingDB Entry DOI: 10.7270/Q2F47NK5
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50053298
PNG
(4-[3-(4-Trifluoromethyl-phenoxy)-propyl]-1H-imidaz...)
Show SMILES FC(F)(F)c1ccc(OCCCc2cnc[nH]2)cc1
Show InChI InChI=1S/C13H13F3N2O/c14-13(15,16)10-3-5-12(6-4-10)19-7-1-2-11-8-17-9-18-11/h3-6,8-9H,1-2,7H2,(H,17,18)
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14n/an/an/an/an/an/an/an/a



University College London

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against against histamine H3 receptor using [3H]-Histamine as radioligand from rat cerebral cortex synaptosomes


J Med Chem 47: 3264-74 (2004)


Article DOI: 10.1021/jm031141p
BindingDB Entry DOI: 10.7270/Q2F47NK5
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50148121
PNG
(4-[3-(3-Ethyl-phenoxy)-propyl]-1H-imidazole | CHEM...)
Show SMILES CCc1cccc(OCCCc2cnc[nH]2)c1
Show InChI InChI=1S/C14H18N2O/c1-2-12-5-3-7-14(9-12)17-8-4-6-13-10-15-11-16-13/h3,5,7,9-11H,2,4,6,8H2,1H3,(H,15,16)
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15n/an/an/an/an/an/an/an/a



University College London

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against against histamine H3 receptor using [3H]-Histamine as radioligand from rat cerebral cortex synaptosomes


J Med Chem 47: 3264-74 (2004)


Article DOI: 10.1021/jm031141p
BindingDB Entry DOI: 10.7270/Q2F47NK5
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50148116
PNG
(4-[2-(3-Trifluoromethyl-phenoxy)-ethyl]-1H-imidazo...)
Show SMILES FC(F)(F)c1cccc(OCCc2cnc[nH]2)c1
Show InChI InChI=1S/C12H11F3N2O/c13-12(14,15)9-2-1-3-11(6-9)18-5-4-10-7-16-8-17-10/h1-3,6-8H,4-5H2,(H,16,17)
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18n/an/an/an/an/an/an/an/a



University College London

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against against histamine H3 receptor using [3H]-Histamine as radioligand from rat cerebral cortex synaptosomes


J Med Chem 47: 3264-74 (2004)


Article DOI: 10.1021/jm031141p
BindingDB Entry DOI: 10.7270/Q2F47NK5
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50148117
PNG
(4-[3-(3-Bromo-phenoxy)-propyl]-1H-imidazole | CHEM...)
Show SMILES Brc1cccc(OCCCc2cnc[nH]2)c1
Show InChI InChI=1S/C12H13BrN2O/c13-10-3-1-5-12(7-10)16-6-2-4-11-8-14-9-15-11/h1,3,5,7-9H,2,4,6H2,(H,14,15)
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19n/an/an/an/an/an/an/an/a



University College London

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against against histamine H3 receptor using [3H]-Histamine as radioligand from rat cerebral cortex synaptosomes


J Med Chem 47: 3264-74 (2004)


Article DOI: 10.1021/jm031141p
BindingDB Entry DOI: 10.7270/Q2F47NK5
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50409931
PNG
(CHEMBL2112499)
Show SMILES CC(=O)c1cccc(OCCCc2cnc[nH]2)c1
Show InChI InChI=1S/C14H16N2O2/c1-11(17)12-4-2-6-14(8-12)18-7-3-5-13-9-15-10-16-13/h2,4,6,8-10H,3,5,7H2,1H3,(H,15,16)
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20n/an/an/an/an/an/an/an/a



University College London

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against against histamine H3 receptor using [3H]-Histamine as radioligand from rat cerebral cortex synaptosomes


J Med Chem 47: 3264-74 (2004)


Article DOI: 10.1021/jm031141p
BindingDB Entry DOI: 10.7270/Q2F47NK5
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50148125
PNG
(4-[3-(3-tert-Butyl-phenoxy)-propyl]-1H-imidazole |...)
Show SMILES CC(C)(C)c1cccc(OCCCc2cnc[nH]2)c1
Show InChI InChI=1S/C16H22N2O/c1-16(2,3)13-6-4-8-15(10-13)19-9-5-7-14-11-17-12-18-14/h4,6,8,10-12H,5,7,9H2,1-3H3,(H,17,18)
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22n/an/an/an/an/an/an/an/a



University College London

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against against histamine H3 receptor using [3H]-Histamine as radioligand from rat cerebral cortex synaptosomes


J Med Chem 47: 3264-74 (2004)


Article DOI: 10.1021/jm031141p
BindingDB Entry DOI: 10.7270/Q2F47NK5
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50148114
PNG
(4-[2-(3-Trifluoromethyl-phenylsulfanyl)-ethyl]-1H-...)
Show SMILES FC(F)(F)c1cccc(SCCc2cnc[nH]2)c1
Show InChI InChI=1S/C12H11F3N2S/c13-12(14,15)9-2-1-3-11(6-9)18-5-4-10-7-16-8-17-10/h1-3,6-8H,4-5H2,(H,16,17)
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23n/an/an/an/an/an/an/an/a



University College London

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against against histamine H3 receptor using [3H]-Histamine as radioligand from rat cerebral cortex synaptosomes


J Med Chem 47: 3264-74 (2004)


Article DOI: 10.1021/jm031141p
BindingDB Entry DOI: 10.7270/Q2F47NK5
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50148124
PNG
(4-[3-(3-Isopropyl-phenoxy)-propyl]-1H-imidazole | ...)
Show SMILES CC(C)c1cccc(OCCCc2cnc[nH]2)c1
Show InChI InChI=1S/C15H20N2O/c1-12(2)13-5-3-7-15(9-13)18-8-4-6-14-10-16-11-17-14/h3,5,7,9-12H,4,6,8H2,1-2H3,(H,16,17)
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29n/an/an/an/an/an/an/an/a



University College London

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against against histamine H3 receptor using [3H]-Histamine as radioligand from rat cerebral cortex synaptosomes


J Med Chem 47: 3264-74 (2004)


Article DOI: 10.1021/jm031141p
BindingDB Entry DOI: 10.7270/Q2F47NK5
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50148115
PNG
(4-(3-m-Tolyloxy-propyl)-1H-imidazole | CHEMBL11041...)
Show SMILES Cc1cccc(OCCCc2cnc[nH]2)c1
Show InChI InChI=1S/C13H16N2O/c1-11-4-2-6-13(8-11)16-7-3-5-12-9-14-10-15-12/h2,4,6,8-10H,3,5,7H2,1H3,(H,14,15)
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37n/an/an/an/an/an/an/an/a



University College London

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against against histamine H3 receptor using [3H]-Histamine as radioligand from rat cerebral cortex synaptosomes


J Med Chem 47: 3264-74 (2004)


Article DOI: 10.1021/jm031141p
BindingDB Entry DOI: 10.7270/Q2F47NK5
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50148113
PNG
(4-[3-(3-Trifluoromethyl-phenylsulfanyl)-propyl]-1H...)
Show SMILES FC(F)(F)c1cccc(SCCCc2cnc[nH]2)c1
Show InChI InChI=1S/C13H13F3N2S/c14-13(15,16)10-3-1-5-12(7-10)19-6-2-4-11-8-17-9-18-11/h1,3,5,7-9H,2,4,6H2,(H,17,18)
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38n/an/an/an/an/an/an/an/a



University College London

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against against histamine H3 receptor using [3H]-Histamine as radioligand from rat cerebral cortex synaptosomes


J Med Chem 47: 3264-74 (2004)


Article DOI: 10.1021/jm031141p
BindingDB Entry DOI: 10.7270/Q2F47NK5
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50148118
PNG
(4-[4-(3-Trifluoromethyl-phenyl)-butyl]-1H-imidazol...)
Show SMILES FC(F)(F)c1cccc(CCCCc2cnc[nH]2)c1
Show InChI InChI=1S/C14H15F3N2/c15-14(16,17)12-6-3-5-11(8-12)4-1-2-7-13-9-18-10-19-13/h3,5-6,8-10H,1-2,4,7H2,(H,18,19)
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38n/an/an/an/an/an/an/an/a



University College London

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against against histamine H3 receptor using [3H]-Histamine as radioligand from rat cerebral cortex synaptosomes


J Med Chem 47: 3264-74 (2004)


Article DOI: 10.1021/jm031141p
BindingDB Entry DOI: 10.7270/Q2F47NK5
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50092833
PNG
(4-(3-Phenoxy-propyl)-1H-imidazole with (0.95M)oxal...)
Show SMILES C(COc1ccccc1)Cc1cnc[nH]1
Show InChI InChI=1S/C12H14N2O/c1-2-6-12(7-3-1)15-8-4-5-11-9-13-10-14-11/h1-3,6-7,9-10H,4-5,8H2,(H,13,14)
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55n/an/an/an/an/an/an/an/a



University College London

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against against histamine H3 receptor using [3H]-Histamine as radioligand from rat cerebral cortex synaptosomes


J Med Chem 47: 3264-74 (2004)


Article DOI: 10.1021/jm031141p
BindingDB Entry DOI: 10.7270/Q2F47NK5
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50148119
PNG
(3-[3-(1H-Imidazol-4-yl)-propoxy]-benzonitrile | CH...)
Show SMILES N#Cc1cccc(OCCCc2cnc[nH]2)c1
Show InChI InChI=1S/C13H13N3O/c14-8-11-3-1-5-13(7-11)17-6-2-4-12-9-15-10-16-12/h1,3,5,7,9-10H,2,4,6H2,(H,15,16)
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108n/an/an/an/an/an/an/an/a



University College London

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against against histamine H3 receptor using [3H]-Histamine as radioligand from rat cerebral cortex synaptosomes


J Med Chem 47: 3264-74 (2004)


Article DOI: 10.1021/jm031141p
BindingDB Entry DOI: 10.7270/Q2F47NK5
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50148123
PNG
(4-[3-(3,5-Bis-trifluoromethyl-phenoxy)-propyl]-1H-...)
Show SMILES FC(F)(F)c1cc(OCCCc2cnc[nH]2)cc(c1)C(F)(F)F
Show InChI InChI=1S/C14H12F6N2O/c15-13(16,17)9-4-10(14(18,19)20)6-12(5-9)23-3-1-2-11-7-21-8-22-11/h4-8H,1-3H2,(H,21,22)
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116n/an/an/an/an/an/an/an/a



University College London

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against against histamine H3 receptor using [3H]-Histamine as radioligand from rat cerebral cortex synaptosomes


J Med Chem 47: 3264-74 (2004)


Article DOI: 10.1021/jm031141p
BindingDB Entry DOI: 10.7270/Q2F47NK5
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%