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Compile Data Set for Download or QSAR

Found 176 hits Enz. Inhib. hit(s) with all data for entry = 50048528   
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))
BDBM50119707
PNG
(4-[3-(4-Hexanoyl-phenoxy)-propyl]-piperazine-1-car...)
Show SMILES CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)OCC)cc1
Show InChI InChI=1S/C22H34N2O4/c1-3-5-6-8-21(25)19-9-11-20(12-10-19)28-18-7-13-23-14-16-24(17-15-23)22(26)27-4-2/h9-12H,3-8,13-18H2,1-2H3
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1.40n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220338
PNG
(CHEMBL302886)
Show SMILES CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)C2CC2)cc1
Show InChI InChI=1S/C23H34N2O3/c1-2-3-4-6-22(26)19-9-11-21(12-10-19)28-18-5-13-24-14-16-25(17-15-24)23(27)20-7-8-20/h9-12,20H,2-8,13-18H2,1H3
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2.10n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220339
PNG
(CHEMBL64408)
Show SMILES CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)OC)cc1
Show InChI InChI=1S/C21H32N2O4/c1-3-4-5-7-20(24)18-8-10-19(11-9-18)27-17-6-12-22-13-15-23(16-14-22)21(25)26-2/h8-11H,3-7,12-17H2,1-2H3
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3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220101
PNG
(CHEMBL64100)
Show SMILES CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)C2CCC2)cc1
Show InChI InChI=1S/C24H36N2O3/c1-2-3-4-9-23(27)20-10-12-22(13-11-20)29-19-6-14-25-15-17-26(18-16-25)24(28)21-7-5-8-21/h10-13,21H,2-9,14-19H2,1H3
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3.20n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220401
PNG
(CHEMBL294502)
Show SMILES CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)CC)cc1
Show InChI InChI=1S/C22H34N2O3/c1-3-5-6-8-21(25)19-9-11-20(12-10-19)27-18-7-13-23-14-16-24(17-15-23)22(26)4-2/h9-12H,3-8,13-18H2,1-2H3
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3.20n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220109
PNG
(CHEMBL304714)
Show SMILES CCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)OCC)cc1
Show InChI InChI=1S/C20H30N2O4/c1-3-6-19(23)17-7-9-18(10-8-17)26-16-5-11-21-12-14-22(15-13-21)20(24)25-4-2/h7-10H,3-6,11-16H2,1-2H3
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3.60n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220143
PNG
(CHEMBL449040)
Show SMILES CCCCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)OCC)cc1
Show InChI InChI=1S/C24H38N2O4/c1-3-5-6-7-8-10-23(27)21-11-13-22(14-12-21)30-20-9-15-25-16-18-26(19-17-25)24(28)29-4-2/h11-14H,3-10,15-20H2,1-2H3
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3.70n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220400
PNG
(CHEMBL64884)
Show SMILES CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)c2cccn2C)cc1
Show InChI InChI=1S/C25H35N3O3/c1-3-4-5-9-24(29)21-10-12-22(13-11-21)31-20-7-15-27-16-18-28(19-17-27)25(30)23-8-6-14-26(23)2/h6,8,10-14H,3-5,7,9,15-20H2,1-2H3
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4.10n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220396
PNG
(CHEMBL62527)
Show SMILES CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)C(C)C)cc1
Show InChI InChI=1S/C23H36N2O3/c1-4-5-6-8-22(26)20-9-11-21(12-10-20)28-18-7-13-24-14-16-25(17-15-24)23(27)19(2)3/h9-12,19H,4-8,13-18H2,1-3H3
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4.5n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220008
PNG
(CHEMBL59715)
Show SMILES CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)c2c[nH]cn2)cc1
Show InChI InChI=1S/C23H32N4O3/c1-2-3-4-6-22(28)19-7-9-20(10-8-19)30-16-5-11-26-12-14-27(15-13-26)23(29)21-17-24-18-25-21/h7-10,17-18H,2-6,11-16H2,1H3,(H,24,25)
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4.5n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220403
PNG
(CHEMBL62948)
Show SMILES CCOC(=O)N1CCN(CCCOc2ccc(cc2)C(=O)C2CC2)CC1
Show InChI InChI=1S/C20H28N2O4/c1-2-25-20(24)22-13-11-21(12-14-22)10-3-15-26-18-8-6-17(7-9-18)19(23)16-4-5-16/h6-9,16H,2-5,10-15H2,1H3
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4.70n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220113
PNG
(CHEMBL62840)
Show SMILES CCOC(=O)N1CCN(CCCOc2ccc(cc2)C(C)=O)CC1
Show InChI InChI=1S/C18H26N2O4/c1-3-23-18(22)20-12-10-19(11-13-20)9-4-14-24-17-7-5-16(6-8-17)15(2)21/h5-8H,3-4,9-14H2,1-2H3
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5n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220333
PNG
(CHEMBL64259)
Show SMILES CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)OC(C)C)cc1
Show InChI InChI=1S/C23H36N2O4/c1-4-5-6-8-22(26)20-9-11-21(12-10-20)28-18-7-13-24-14-16-25(17-15-24)23(27)29-19(2)3/h9-12,19H,4-8,13-18H2,1-3H3
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5n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220142
PNG
(CHEMBL62066)
Show SMILES CCOC(=O)N1CCN(CCCOc2ccc(cc2)C(=O)CC)CC1
Show InChI InChI=1S/C19H28N2O4/c1-3-18(22)16-6-8-17(9-7-16)25-15-5-10-20-11-13-21(14-12-20)19(23)24-4-2/h6-9H,3-5,10-15H2,1-2H3
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5.40n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220341
PNG
(CHEMBL65518)
Show SMILES CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)N2CCOCC2)cc1
Show InChI InChI=1S/C24H37N3O4/c1-2-3-4-6-23(28)21-7-9-22(10-8-21)31-18-5-11-25-12-14-26(15-13-25)24(29)27-16-19-30-20-17-27/h7-10H,2-6,11-20H2,1H3
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5.90n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220404
PNG
(CHEMBL291394)
Show SMILES CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)c2ccncc2)cc1
Show InChI InChI=1S/C25H33N3O3/c1-2-3-4-6-24(29)21-7-9-23(10-8-21)31-20-5-15-27-16-18-28(19-17-27)25(30)22-11-13-26-14-12-22/h7-14H,2-6,15-20H2,1H3
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6.30n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220104
PNG
(CHEMBL444307)
Show SMILES CCOC(=O)N1CCN(CCCOc2ccc(cc2)C(=O)\C=C\c2cccnc2)CC1
Show InChI InChI=1S/C24H29N3O4/c1-2-30-24(29)27-16-14-26(15-17-27)13-4-18-31-22-9-7-21(8-10-22)23(28)11-6-20-5-3-12-25-19-20/h3,5-12,19H,2,4,13-18H2,1H3/b11-6+
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6.30n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220340
PNG
(CHEMBL64479)
Show SMILES CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)CCC)cc1
Show InChI InChI=1S/C23H36N2O3/c1-3-5-6-9-22(26)20-10-12-21(13-11-20)28-19-7-14-24-15-17-25(18-16-24)23(27)8-4-2/h10-13H,3-9,14-19H2,1-2H3
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6.5n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220107
PNG
(CHEMBL61231)
Show SMILES CCOC(=O)N1CCN(CCCOc2ccc(cc2)C(=O)CC(C)C)CC1
Show InChI InChI=1S/C21H32N2O4/c1-4-26-21(25)23-13-11-22(12-14-23)10-5-15-27-19-8-6-18(7-9-19)20(24)16-17(2)3/h6-9,17H,4-5,10-16H2,1-3H3
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7.20n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220213
PNG
(CHEMBL292275)
Show SMILES CCOC(=O)N1CCN(CCCOc2ccc(cc2)C(=O)\C=C\c2ccc(OC)cc2)CC1
Show InChI InChI=1S/C26H32N2O5/c1-3-32-26(30)28-18-16-27(17-19-28)15-4-20-33-24-12-8-22(9-13-24)25(29)14-7-21-5-10-23(31-2)11-6-21/h5-14H,3-4,15-20H2,1-2H3/b14-7+
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7.20n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220099
PNG
(CHEMBL64667)
Show SMILES CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)N2CCCC2)cc1
Show InChI InChI=1S/C24H37N3O3/c1-2-3-4-8-23(28)21-9-11-22(12-10-21)30-20-7-13-25-16-18-27(19-17-25)24(29)26-14-5-6-15-26/h9-12H,2-8,13-20H2,1H3
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7.40n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220402
PNG
(CHEMBL62949)
Show SMILES CCCCCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)OCC)cc1
Show InChI InChI=1S/C25H40N2O4/c1-3-5-6-7-8-9-11-24(28)22-12-14-23(15-13-22)31-21-10-16-26-17-19-27(20-18-26)25(29)30-4-2/h12-15H,3-11,16-21H2,1-2H3
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7.90n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220408
PNG
(CHEMBL61396)
Show SMILES CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)c2occc2C)cc1
Show InChI InChI=1S/C25H34N2O4/c1-3-4-5-7-23(28)21-8-10-22(11-9-21)30-18-6-13-26-14-16-27(17-15-26)25(29)24-20(2)12-19-31-24/h8-12,19H,3-7,13-18H2,1-2H3
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8.5n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220105
PNG
(CHEMBL59798)
Show SMILES CCCCCC(=O)c1ccc(OCCCN2CCN(CC(C)C)CC2)cc1
Show InChI InChI=1S/C23H38N2O2/c1-4-5-6-8-23(26)21-9-11-22(12-10-21)27-18-7-13-24-14-16-25(17-15-24)19-20(2)3/h9-12,20H,4-8,13-19H2,1-3H3
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9.30n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220116
PNG
(CHEMBL64773)
Show SMILES CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)NC(C)C)cc1
Show InChI InChI=1S/C23H37N3O3/c1-4-5-6-8-22(27)20-9-11-21(12-10-20)29-18-7-13-25-14-16-26(17-15-25)23(28)24-19(2)3/h9-12,19H,4-8,13-18H2,1-3H3,(H,24,28)
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9.5n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220337
PNG
(CHEMBL62312)
Show SMILES CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)c2ccco2)cc1
Show InChI InChI=1S/C24H32N2O4/c1-2-3-4-7-22(27)20-9-11-21(12-10-20)29-19-6-13-25-14-16-26(17-15-25)24(28)23-8-5-18-30-23/h5,8-12,18H,2-4,6-7,13-17,19H2,1H3
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10n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220112
PNG
(CHEMBL64775)
Show SMILES CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)OCC(C)C)cc1
Show InChI InChI=1S/C24H38N2O4/c1-4-5-6-8-23(27)21-9-11-22(12-10-21)29-18-7-13-25-14-16-26(17-15-25)24(28)30-19-20(2)3/h9-12,20H,4-8,13-19H2,1-3H3
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10n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220407
PNG
(CHEMBL305338)
Show SMILES CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)Cc2ccccc2)cc1
Show InChI InChI=1S/C27H36N2O3/c1-2-3-5-11-26(30)24-12-14-25(15-13-24)32-21-8-16-28-17-19-29(20-18-28)27(31)22-23-9-6-4-7-10-23/h4,6-7,9-10,12-15H,2-3,5,8,11,16-22H2,1H3
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10n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220399
PNG
(CHEMBL64235)
Show SMILES CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)CSCC)cc1
Show InChI InChI=1S/C23H36N2O3S/c1-3-5-6-8-22(26)20-9-11-21(12-10-20)28-18-7-13-24-14-16-25(17-15-24)23(27)19-29-4-2/h9-12H,3-8,13-19H2,1-2H3
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11n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220111
PNG
(CHEMBL64334)
Show SMILES CCCCCC(=O)c1ccc(OCCCN2CCN(CCCC)CC2)cc1
Show InChI InChI=1S/C23H38N2O2/c1-3-5-7-9-23(26)21-10-12-22(13-11-21)27-20-8-15-25-18-16-24(17-19-25)14-6-4-2/h10-13H,3-9,14-20H2,1-2H3
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13n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220115
PNG
(CHEMBL64247)
Show SMILES CCOC(=O)N1CCN(CCCOc2ccc(cc2)C(=O)c2ccc(cc2)C(C)(C)C)CC1
Show InChI InChI=1S/C27H36N2O4/c1-5-32-26(31)29-18-16-28(17-19-29)15-6-20-33-24-13-9-22(10-14-24)25(30)21-7-11-23(12-8-21)27(2,3)4/h7-14H,5-6,15-20H2,1-4H3
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13n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220409
PNG
(CHEMBL63631)
Show SMILES CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)S(=O)(=O)C(C)C)cc1
Show InChI InChI=1S/C22H36N2O4S/c1-4-5-6-8-22(25)20-9-11-21(12-10-20)28-18-7-13-23-14-16-24(17-15-23)29(26,27)19(2)3/h9-12,19H,4-8,13-18H2,1-3H3
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13n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220108
PNG
(CHEMBL62726)
Show SMILES CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)c2cccs2)cc1
Show InChI InChI=1S/C24H32N2O3S/c1-2-3-4-7-22(27)20-9-11-21(12-10-20)29-18-6-13-25-14-16-26(17-15-25)24(28)23-8-5-19-30-23/h5,8-12,19H,2-4,6-7,13-18H2,1H3
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16n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220141
PNG
(CHEMBL60383)
Show SMILES CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)c2ccc(C)s2)cc1
Show InChI InChI=1S/C25H34N2O3S/c1-3-4-5-7-23(28)21-9-11-22(12-10-21)30-19-6-14-26-15-17-27(18-16-26)25(29)24-13-8-20(2)31-24/h8-13H,3-7,14-19H2,1-2H3
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16n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220114
PNG
(CHEMBL64253)
Show SMILES CCCCCC(=O)c1ccc(OCCCN2CCN(CC3CC3)CC2)cc1
Show InChI InChI=1S/C23H36N2O2/c1-2-3-4-6-23(26)21-9-11-22(12-10-21)27-18-5-13-24-14-16-25(17-15-24)19-20-7-8-20/h9-12,20H,2-8,13-19H2,1H3
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16n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220393
PNG
(CHEMBL60360)
Show SMILES CCCCCC(=O)c1ccc(OCCCN2CCN(Cc3nccs3)CC2)cc1
Show InChI InChI=1S/C23H33N3O2S/c1-2-3-4-6-22(27)20-7-9-21(10-8-20)28-17-5-12-25-13-15-26(16-14-25)19-23-24-11-18-29-23/h7-11,18H,2-6,12-17,19H2,1H3
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17n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220410
PNG
(CHEMBL62115)
Show SMILES CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)c2cnccn2)cc1
Show InChI InChI=1S/C24H32N4O3/c1-2-3-4-6-23(29)20-7-9-21(10-8-20)31-18-5-13-27-14-16-28(17-15-27)24(30)22-19-25-11-12-26-22/h7-12,19H,2-6,13-18H2,1H3
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18n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220398
PNG
(CHEMBL64317)
Show SMILES CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)OCCCC)cc1
Show InChI InChI=1S/C24H38N2O4/c1-3-5-7-9-23(27)21-10-12-22(13-11-21)29-20-8-14-25-15-17-26(18-16-25)24(28)30-19-6-4-2/h10-13H,3-9,14-20H2,1-2H3
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20n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220406
PNG
(CHEMBL418658)
Show SMILES CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)c2cccnc2)cc1
Show InChI InChI=1S/C25H33N3O3/c1-2-3-4-8-24(29)21-9-11-23(12-10-21)31-19-6-14-27-15-17-28(18-16-27)25(30)22-7-5-13-26-20-22/h5,7,9-13,20H,2-4,6,8,14-19H2,1H3
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20n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220103
PNG
(CHEMBL431172)
Show SMILES CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)S(C)(=O)=O)cc1
Show InChI InChI=1S/C20H32N2O4S/c1-3-4-5-7-20(23)18-8-10-19(11-9-18)26-17-6-12-21-13-15-22(16-14-21)27(2,24)25/h8-11H,3-7,12-17H2,1-2H3
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21n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220100
PNG
(CHEMBL60620)
Show SMILES CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)NCC)cc1
Show InChI InChI=1S/C22H35N3O3/c1-3-5-6-8-21(26)19-9-11-20(12-10-19)28-18-7-13-24-14-16-25(17-15-24)22(27)23-4-2/h9-12H,3-8,13-18H2,1-2H3,(H,23,27)
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21n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220405
PNG
(CHEMBL61070)
Show SMILES CCOC(=O)N1CCN(CCCOc2ccc(cc2)C(=O)C2CCCCC2)CC1
Show InChI InChI=1S/C23H34N2O4/c1-2-28-23(27)25-16-14-24(15-17-25)13-6-18-29-21-11-9-20(10-12-21)22(26)19-7-4-3-5-8-19/h9-12,19H,2-8,13-18H2,1H3
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25n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220416
PNG
(CHEMBL304027)
Show SMILES CCOC(=O)N1CCN(CCCOc2ccc(cc2)C(=O)c2cccc(F)c2F)CC1
Show InChI InChI=1S/C23H26F2N2O4/c1-2-30-23(29)27-14-12-26(13-15-27)11-4-16-31-18-9-7-17(8-10-18)22(28)19-5-3-6-20(24)21(19)25/h3,5-10H,2,4,11-16H2,1H3
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25n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220392
PNG
(CHEMBL302445)
Show SMILES CCCCCC(=O)c1ccc(OCCCN2CCNCC2)cc1
Show InChI InChI=1S/C19H30N2O2/c1-2-3-4-6-19(22)17-7-9-18(10-8-17)23-16-5-13-21-14-11-20-12-15-21/h7-10,20H,2-6,11-16H2,1H3
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27n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220144
PNG
(CHEMBL432144)
Show SMILES CCCCCC(=O)c1ccc(OCCCN2CCN(CCC)CC2)cc1
Show InChI InChI=1S/C22H36N2O2/c1-3-5-6-8-22(25)20-9-11-21(12-10-20)26-19-7-14-24-17-15-23(13-4-2)16-18-24/h9-12H,3-8,13-19H2,1-2H3
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28n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220411
PNG
(CHEMBL291882)
Show SMILES CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)c2sccc2Cl)cc1
Show InChI InChI=1S/C24H31ClN2O3S/c1-2-3-4-6-22(28)19-7-9-20(10-8-19)30-17-5-12-26-13-15-27(16-14-26)24(29)23-21(25)11-18-31-23/h7-11,18H,2-6,12-17H2,1H3
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30n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220071
PNG
(CHEMBL294519)
Show SMILES CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)c2ccccc2)cc1
Show InChI InChI=1S/C26H34N2O3/c1-2-3-5-11-25(29)22-12-14-24(15-13-22)31-21-8-16-27-17-19-28(20-18-27)26(30)23-9-6-4-7-10-23/h4,6-7,9-10,12-15H,2-3,5,8,11,16-21H2,1H3
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36n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220102
PNG
(CHEMBL63632)
Show SMILES CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)S(=O)(=O)c2ccc(cc2)C#N)cc1
Show InChI InChI=1S/C26H33N3O4S/c1-2-3-4-6-26(30)23-9-11-24(12-10-23)33-20-5-15-28-16-18-29(19-17-28)34(31,32)25-13-7-22(21-27)8-14-25/h7-14H,2-6,15-20H2,1H3
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37n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220413
PNG
(CHEMBL305313)
Show SMILES [#6]-[#6]-[#8]-[#6](=O)-[#7]-1-[#6]-[#6]-[#7](-[#6]-[#6]-[#6]-[#8]-c2ccc(cc2)-[#6](=O)\[#6]=[#6](\[#6])-[#6])-[#6]-[#6]-1
Show InChI InChI=1S/C21H30N2O4/c1-4-26-21(25)23-13-11-22(12-14-23)10-5-15-27-19-8-6-18(7-9-19)20(24)16-17(2)3/h6-9,16H,4-5,10-15H2,1-3H3
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39n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220106
PNG
(CHEMBL418691)
Show SMILES CCOC(=O)N1CCN(CCCOc2ccc(cc2)C(=O)c2ccc(OC)cc2)CC1
Show InChI InChI=1S/C24H30N2O5/c1-3-30-24(28)26-16-14-25(15-17-26)13-4-18-31-22-11-7-20(8-12-22)23(27)19-5-9-21(29-2)10-6-19/h5-12H,3-4,13-18H2,1-2H3
PDB

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40n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair
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