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Compile Data Set for Download or QSAR

Found 64 hits Enz. Inhib. hit(s) with all data for entry = 50013333   
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))
BDBM50129256
PNG
(11-(4-Piperidin-1-yl-but-1-ynyl)-7,8,9,10-tetrahyd...)
Show SMILES C(CN1CCCCC1)C#Cc1c2CCCCCc2nc2ccccc12
Show InChI InChI=1S/C23H28N2/c1-3-12-20-19(11-7-10-18-25-16-8-2-9-17-25)21-13-5-6-15-23(21)24-22(20)14-4-1/h5-6,13,15H,1-4,8-10,12,14,16-18H2
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1.70n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Compound was tested for its binding affinity towards human H3L receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50129256
PNG
(11-(4-Piperidin-1-yl-but-1-ynyl)-7,8,9,10-tetrahyd...)
Show SMILES C(CN1CCCCC1)C#Cc1c2CCCCCc2nc2ccccc12
Show InChI InChI=1S/C23H28N2/c1-3-12-20-19(11-7-10-18-25-16-8-2-9-17-25)21-13-5-6-15-23(21)24-22(20)14-4-1/h5-6,13,15H,1-4,8-10,12,14,16-18H2
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1.70n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Compound was tested for its binding affinity towards human H3L receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50129253
PNG
((3-Pyrrolidin-1-yl-propyl)-(7,8,9,10-tetrahydro-6H...)
Show SMILES C(CNc1c2CCCCCc2nc2ccccc12)CN1CCCC1
Show InChI InChI=1S/C21H29N3/c1-2-9-17-19(11-3-1)23-20-12-5-4-10-18(20)21(17)22-13-8-16-24-14-6-7-15-24/h4-5,10,12H,1-3,6-9,11,13-16H2,(H,22,23)
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2.5n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50129253
PNG
((3-Pyrrolidin-1-yl-propyl)-(7,8,9,10-tetrahydro-6H...)
Show SMILES C(CNc1c2CCCCCc2nc2ccccc12)CN1CCCC1
Show InChI InChI=1S/C21H29N3/c1-2-9-17-19(11-3-1)23-20-12-5-4-10-18(20)21(17)22-13-8-16-24-14-6-7-15-24/h4-5,10,12H,1-3,6-9,11,13-16H2,(H,22,23)
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6.60n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Compound was tested for its binding affinity towards human H3L receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50129253
PNG
((3-Pyrrolidin-1-yl-propyl)-(7,8,9,10-tetrahydro-6H...)
Show SMILES C(CNc1c2CCCCCc2nc2ccccc12)CN1CCCC1
Show InChI InChI=1S/C21H29N3/c1-2-9-17-19(11-3-1)23-20-12-5-4-10-18(20)21(17)22-13-8-16-24-14-6-7-15-24/h4-5,10,12H,1-3,6-9,11,13-16H2,(H,22,23)
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6.60n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Compound was tested for its binding affinity towards human H3L receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50129255
PNG
(CHEMBL65849 | N,N-Dimethyl-N'-(7,8,9,10-tetrahydro...)
Show SMILES CN(C)CCCNc1c2CCCCCc2nc2ccccc12
Show InChI InChI=1S/C19H27N3/c1-22(2)14-8-13-20-19-15-9-4-3-5-11-17(15)21-18-12-7-6-10-16(18)19/h6-7,10,12H,3-5,8-9,11,13-14H2,1-2H3,(H,20,21)
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9.70n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Compound was tested for its binding affinity towards human H3L receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50129255
PNG
(CHEMBL65849 | N,N-Dimethyl-N'-(7,8,9,10-tetrahydro...)
Show SMILES CN(C)CCCNc1c2CCCCCc2nc2ccccc12
Show InChI InChI=1S/C19H27N3/c1-22(2)14-8-13-20-19-15-9-4-3-5-11-17(15)21-18-12-7-6-10-16(18)19/h6-7,10,12H,3-5,8-9,11,13-14H2,1-2H3,(H,20,21)
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9.80n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Compound was tested for its binding affinity towards human H3L receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50129254
PNG
(CHEMBL303824 | [2-(1-Methyl-pyrrolidin-2-yl)-ethyl...)
Show SMILES CN1CCCC1CCNc1c2CCCCCc2nc2ccccc12
Show InChI InChI=1S/C21H29N3/c1-24-15-7-8-16(24)13-14-22-21-17-9-3-2-4-11-19(17)23-20-12-6-5-10-18(20)21/h5-6,10,12,16H,2-4,7-9,11,13-15H2,1H3,(H,22,23)
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18n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50129255
PNG
(CHEMBL65849 | N,N-Dimethyl-N'-(7,8,9,10-tetrahydro...)
Show SMILES CN(C)CCCNc1c2CCCCCc2nc2ccccc12
Show InChI InChI=1S/C19H27N3/c1-22(2)14-8-13-20-19-15-9-4-3-5-11-17(15)21-18-12-7-6-10-16(18)19/h6-7,10,12H,3-5,8-9,11,13-14H2,1-2H3,(H,20,21)
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22n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220983
PNG
(CHEMBL291830)
Show SMILES CN(C)CCCCNc1c2CCCCCc2nc2ccccc12
Show InChI InChI=1S/C20H29N3/c1-23(2)15-9-8-14-21-20-16-10-4-3-5-12-18(16)22-19-13-7-6-11-17(19)20/h6-7,11,13H,3-5,8-10,12,14-15H2,1-2H3,(H,21,22)
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39n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50220983
PNG
(CHEMBL291830)
Show SMILES CN(C)CCCCNc1c2CCCCCc2nc2ccccc12
Show InChI InChI=1S/C20H29N3/c1-23(2)15-9-8-14-21-20-16-10-4-3-5-12-18(16)22-19-13-7-6-11-17(19)20/h6-7,11,13H,3-5,8-10,12,14-15H2,1-2H3,(H,21,22)
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44n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards cloned human H3L receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50220977
PNG
(CHEMBL68547)
Show SMILES [H][C@@]12CN(CCCNc3c4CCCCCc4nc4ccccc34)C[C@]1([H])[C@H]2N
Show InChI InChI=1S/C22H30N4/c23-21-17-13-26(14-18(17)21)12-6-11-24-22-15-7-2-1-3-9-19(15)25-20-10-5-4-8-16(20)22/h4-5,8,10,17-18,21H,1-3,6-7,9,11-14,23H2,(H,24,25)/t17-,18+,21+
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45n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards cloned human H3L receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50220980
PNG
(CHEMBL305248)
Show SMILES [H][C@@]12CN(CCCNc3c4CCCCCc4nc4ccccc34)C[C@]1([H])[C@H]2NC(=O)OC(C)(C)C
Show InChI InChI=1S/C27H38N4O2/c1-27(2,3)33-26(32)30-25-20-16-31(17-21(20)25)15-9-14-28-24-18-10-5-4-6-12-22(18)29-23-13-8-7-11-19(23)24/h7-8,11,13,20-21,25H,4-6,9-10,12,14-17H2,1-3H3,(H,28,29)(H,30,32)/t20-,21+,25+
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47n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards cloned human H3L receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50220975
PNG
(CHEMBL66336)
Show SMILES CN(C)CCNc1c2CCCCCc2nc2ccccc12
Show InChI InChI=1S/C18H25N3/c1-21(2)13-12-19-18-14-8-4-3-5-10-16(14)20-17-11-7-6-9-15(17)18/h6-7,9,11H,3-5,8,10,12-13H2,1-2H3,(H,19,20)
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48n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards cloned human H3L receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50220949
PNG
(CHEMBL67495)
Show SMILES CN1CCN(CCCNc2c3CCCCCc3nc3ccccc23)CC1
Show InChI InChI=1S/C22H32N4/c1-25-14-16-26(17-15-25)13-7-12-23-22-18-8-3-2-4-10-20(18)24-21-11-6-5-9-19(21)22/h5-6,9,11H,2-4,7-8,10,12-17H2,1H3,(H,23,24)
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51n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards cloned human H3L receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220980
PNG
(CHEMBL305248)
Show SMILES [H][C@@]12CN(CCCNc3c4CCCCCc4nc4ccccc34)C[C@]1([H])[C@H]2NC(=O)OC(C)(C)C
Show InChI InChI=1S/C27H38N4O2/c1-27(2,3)33-26(32)30-25-20-16-31(17-21(20)25)15-9-14-28-24-18-10-5-4-6-12-22(18)29-23-13-8-7-11-19(23)24/h7-8,11,13,20-21,25H,4-6,9-10,12,14-17H2,1-3H3,(H,28,29)(H,30,32)/t20-,21+,25+
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51n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50220976
PNG
(CHEMBL419993)
Show SMILES CN(C)CCCNc1c2CSCCc2nc2ccccc12
Show InChI InChI=1S/C17H23N3S/c1-20(2)10-5-9-18-17-13-6-3-4-7-15(13)19-16-8-11-21-12-14(16)17/h3-4,6-7H,5,8-12H2,1-2H3,(H,18,19)
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54n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards cloned human H3L receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220976
PNG
(CHEMBL419993)
Show SMILES CN(C)CCCNc1c2CSCCc2nc2ccccc12
Show InChI InChI=1S/C17H23N3S/c1-20(2)10-5-9-18-17-13-6-3-4-7-15(13)19-16-8-11-21-12-14(16)17/h3-4,6-7H,5,8-12H2,1-2H3,(H,18,19)
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59n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220977
PNG
(CHEMBL68547)
Show SMILES [H][C@@]12CN(CCCNc3c4CCCCCc4nc4ccccc34)C[C@]1([H])[C@H]2N
Show InChI InChI=1S/C22H30N4/c23-21-17-13-26(14-18(17)21)12-6-11-24-22-15-7-2-1-3-9-19(15)25-20-10-5-4-8-16(20)22/h4-5,8,10,17-18,21H,1-3,6-7,9,11-14,23H2,(H,24,25)/t17-,18+,21+
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74n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50129254
PNG
(CHEMBL303824 | [2-(1-Methyl-pyrrolidin-2-yl)-ethyl...)
Show SMILES CN1CCCC1CCNc1c2CCCCCc2nc2ccccc12
Show InChI InChI=1S/C21H29N3/c1-24-15-7-8-16(24)13-14-22-21-17-9-3-2-4-11-19(17)23-20-12-6-5-10-18(20)21/h5-6,10,12,16H,2-4,7-9,11,13-15H2,1H3,(H,22,23)
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80n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Compound was tested for its binding affinity towards human H3L receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50129254
PNG
(CHEMBL303824 | [2-(1-Methyl-pyrrolidin-2-yl)-ethyl...)
Show SMILES CN1CCCC1CCNc1c2CCCCCc2nc2ccccc12
Show InChI InChI=1S/C21H29N3/c1-24-15-7-8-16(24)13-14-22-21-17-9-3-2-4-11-19(17)23-20-12-6-5-10-18(20)21/h5-6,10,12,16H,2-4,7-9,11,13-15H2,1H3,(H,22,23)
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80n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Compound was tested for its binding affinity towards human H3L receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50220954
PNG
(CHEMBL66437)
Show SMILES C(CN1CCCCC1)\C=C/c1c2CCCCCc2nc2ccccc12
Show InChI InChI=1S/C23H30N2/c1-3-12-20-19(11-7-10-18-25-16-8-2-9-17-25)21-13-5-6-15-23(21)24-22(20)14-4-1/h5-7,11,13,15H,1-4,8-10,12,14,16-18H2/b11-7-
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87n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards cloned human H3L receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220949
PNG
(CHEMBL67495)
Show SMILES CN1CCN(CCCNc2c3CCCCCc3nc3ccccc23)CC1
Show InChI InChI=1S/C22H32N4/c1-25-14-16-26(17-15-25)13-7-12-23-22-18-8-3-2-4-10-20(18)24-21-11-6-5-9-19(21)22/h5-6,9,11H,2-4,7-8,10,12-17H2,1H3,(H,23,24)
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98n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220975
PNG
(CHEMBL66336)
Show SMILES CN(C)CCNc1c2CCCCCc2nc2ccccc12
Show InChI InChI=1S/C18H25N3/c1-21(2)13-12-19-18-14-8-4-3-5-10-16(14)20-17-11-7-6-9-15(17)18/h6-7,9,11H,3-5,8,10,12-13H2,1-2H3,(H,19,20)
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148n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50220951
PNG
(CHEMBL303676)
Show SMILES CN(C)CCCNc1c2CCCCc2nc2CCCCCc12
Show InChI InChI=1S/C19H31N3/c1-22(2)14-8-13-20-19-15-9-4-3-5-11-17(15)21-18-12-7-6-10-16(18)19/h3-14H2,1-2H3,(H,20,21)
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158n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Compound was tested for its binding affinity towards rat cortical Histamine H3L receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50220956
PNG
(CHEMBL69752)
Show SMILES C(CN1CCCCC1)C#Cc1c2CCCCCCc2nc2ccccc12
Show InChI InChI=1S/C24H30N2/c1-2-5-15-23-21(13-4-1)20(22-14-6-7-16-24(22)25-23)12-8-11-19-26-17-9-3-10-18-26/h6-7,14,16H,1-5,9-11,13,15,17-19H2
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158n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards cloned human H3L receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50220982
PNG
(CHEMBL65311)
Show SMILES C(CN1CCCC1)C#Cc1c2CCCCCc2nc2ccccc12
Show InChI InChI=1S/C22H26N2/c1-2-11-19-18(10-6-7-15-24-16-8-9-17-24)20-12-4-5-14-22(20)23-21(19)13-3-1/h4-5,12,14H,1-3,7-9,11,13,15-17H2
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214n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards cloned human H3L receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50220972
PNG
(CHEMBL304737)
Show SMILES OC[C@@H]1CCN(CCC#Cc2c3CCCCCc3nc3ccccc23)C1
Show InChI InChI=1S/C23H28N2O/c26-17-18-13-15-25(16-18)14-7-6-8-19-20-9-2-1-3-11-22(20)24-23-12-5-4-10-21(19)23/h4-5,10,12,18,26H,1-3,7,9,11,13-17H2/t18-/m1/s1
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251n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards cloned human H3L receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220954
PNG
(CHEMBL66437)
Show SMILES C(CN1CCCCC1)\C=C/c1c2CCCCCc2nc2ccccc12
Show InChI InChI=1S/C23H30N2/c1-3-12-20-19(11-7-10-18-25-16-8-2-9-17-25)21-13-5-6-15-23(21)24-22(20)14-4-1/h5-7,11,13,15H,1-4,8-10,12,14,16-18H2/b11-7-
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275n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220951
PNG
(CHEMBL303676)
Show SMILES CN(C)CCCNc1c2CCCCc2nc2CCCCCc12
Show InChI InChI=1S/C19H31N3/c1-22(2)14-8-13-20-19-15-9-4-3-5-11-17(15)21-18-12-7-6-10-16(18)19/h3-14H2,1-2H3,(H,20,21)
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355n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50220845
PNG
(CHEMBL66880)
Show SMILES CN(C)CCC#Cc1c2CCCCCc2nc2ccccc12
Show InChI InChI=1S/C20H24N2/c1-22(2)15-9-8-10-16-17-11-4-3-5-13-19(17)21-20-14-7-6-12-18(16)20/h6-7,12,14H,3-5,9,11,13,15H2,1-2H3
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389n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards cloned human H3L receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220950
PNG
(CHEMBL67496)
Show SMILES C(CNc1c2CCCCCc2nc2ccccc12)CN1CCOCC1
Show InChI InChI=1S/C21H29N3O/c1-2-7-17-19(9-3-1)23-20-10-5-4-8-18(20)21(17)22-11-6-12-24-13-15-25-16-14-24/h4-5,8,10H,1-3,6-7,9,11-16H2,(H,22,23)
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398n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50129256
PNG
(11-(4-Piperidin-1-yl-but-1-ynyl)-7,8,9,10-tetrahyd...)
Show SMILES C(CN1CCCCC1)C#Cc1c2CCCCCc2nc2ccccc12
Show InChI InChI=1S/C23H28N2/c1-3-12-20-19(11-7-10-18-25-16-8-2-9-17-25)21-13-5-6-15-23(21)24-22(20)14-4-1/h5-6,13,15H,1-4,8-10,12,14,16-18H2
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407n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50220973
PNG
(CHEMBL66832)
Show SMILES C(CN1CCCCCC1)C#Cc1c2CCCCCc2nc2ccccc12
Show InChI InChI=1S/C24H30N2/c1-2-10-18-26(17-9-1)19-11-8-12-20-21-13-4-3-5-15-23(21)25-24-16-7-6-14-22(20)24/h6-7,14,16H,1-5,9-11,13,15,17-19H2
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437n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards cloned human H3L receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220972
PNG
(CHEMBL304737)
Show SMILES OC[C@@H]1CCN(CCC#Cc2c3CCCCCc3nc3ccccc23)C1
Show InChI InChI=1S/C23H28N2O/c26-17-18-13-15-25(16-18)14-7-6-8-19-20-9-2-1-3-11-22(20)24-23-12-5-4-10-21(19)23/h4-5,10,12,18,26H,1-3,7,9,11,13-17H2/t18-/m1/s1
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617n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220956
PNG
(CHEMBL69752)
Show SMILES C(CN1CCCCC1)C#Cc1c2CCCCCCc2nc2ccccc12
Show InChI InChI=1S/C24H30N2/c1-2-5-15-23-21(13-4-1)20(22-14-6-7-16-24(22)25-23)12-8-11-19-26-17-9-3-10-18-26/h6-7,14,16H,1-5,9-11,13,15,17-19H2
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646n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220982
PNG
(CHEMBL65311)
Show SMILES C(CN1CCCC1)C#Cc1c2CCCCCc2nc2ccccc12
Show InChI InChI=1S/C22H26N2/c1-2-11-19-18(10-6-7-15-24-16-8-9-17-24)20-12-4-5-14-22(20)23-21(19)13-3-1/h4-5,12,14H,1-3,7-9,11,13,15-17H2
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646n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220845
PNG
(CHEMBL66880)
Show SMILES CN(C)CCC#Cc1c2CCCCCc2nc2ccccc12
Show InChI InChI=1S/C20H24N2/c1-22(2)15-9-8-10-16-17-11-4-3-5-13-19(17)21-20-14-7-6-12-18(16)20/h6-7,12,14H,3-5,9,11,13,15H2,1-2H3
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692n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50220981
PNG
(CHEMBL65797)
Show SMILES CN1CCN(CCC#Cc2c3CCCCCc3nc3ccccc23)CC1
Show InChI InChI=1S/C23H29N3/c1-25-15-17-26(18-16-25)14-8-7-9-19-20-10-3-2-4-12-22(20)24-23-13-6-5-11-21(19)23/h5-6,11,13H,2-4,8,10,12,14-18H2,1H3
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724n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards cloned human H3L receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50220950
PNG
(CHEMBL67496)
Show SMILES C(CNc1c2CCCCCc2nc2ccccc12)CN1CCOCC1
Show InChI InChI=1S/C21H29N3O/c1-2-7-17-19(9-3-1)23-20-10-5-4-8-18(20)21(17)22-11-6-12-24-13-15-25-16-14-24/h4-5,8,10H,1-3,6-7,9,11-16H2,(H,22,23)
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759n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards cloned human H3L receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50220974
PNG
(CHEMBL68176)
Show SMILES OC[C@H]1CCN(CCC#Cc2c3CCCCCc3nc3ccccc23)C1
Show InChI InChI=1S/C23H28N2O/c26-17-18-13-15-25(16-18)14-7-6-8-19-20-9-2-1-3-11-22(20)24-23-12-5-4-10-21(19)23/h4-5,10,12,18,26H,1-3,7,9,11,13-17H2/t18-/m0/s1
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955n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards cloned human H3L receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50220855
PNG
(CHEMBL68059)
Show SMILES CC(C)(C)OC(=O)N1CCN(CC1)c1c2CCCCCc2nc2ccccc12
Show InChI InChI=1S/C23H31N3O2/c1-23(2,3)28-22(27)26-15-13-25(14-16-26)21-17-9-5-4-6-11-19(17)24-20-12-8-7-10-18(20)21/h7-8,10,12H,4-6,9,11,13-16H2,1-3H3
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<1.00E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards cloned human H3L receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220855
PNG
(CHEMBL68059)
Show SMILES CC(C)(C)OC(=O)N1CCN(CC1)c1c2CCCCCc2nc2ccccc12
Show InChI InChI=1S/C23H31N3O2/c1-23(2,3)28-22(27)26-15-13-25(14-16-26)21-17-9-5-4-6-11-19(17)24-20-12-8-7-10-18(20)21/h7-8,10,12H,4-6,9,11,13-16H2,1-3H3
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<1.00E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220974
PNG
(CHEMBL68176)
Show SMILES OC[C@H]1CCN(CCC#Cc2c3CCCCCc3nc3ccccc23)C1
Show InChI InChI=1S/C23H28N2O/c26-17-18-13-15-25(16-18)14-7-6-8-19-20-9-2-1-3-11-22(20)24-23-12-5-4-10-21(19)23/h4-5,10,12,18,26H,1-3,7,9,11,13-17H2/t18-/m0/s1
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<1.00E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220973
PNG
(CHEMBL66832)
Show SMILES C(CN1CCCCCC1)C#Cc1c2CCCCCc2nc2ccccc12
Show InChI InChI=1S/C24H30N2/c1-2-10-18-26(17-9-1)19-11-8-12-20-21-13-4-3-5-15-23(21)25-24-16-7-6-14-22(20)24/h6-7,14,16H,1-5,9-11,13,15,17-19H2
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<1.00E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220955
PNG
(CHEMBL68465)
Show SMILES C(CN1CCOCC1)C#Cc1c2CCCCCc2nc2ccccc12
Show InChI InChI=1S/C22H26N2O/c1-2-9-19-18(8-6-7-13-24-14-16-25-17-15-24)20-10-4-5-12-22(20)23-21(19)11-3-1/h4-5,10,12H,1-3,7,9,11,13-17H2
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<1.00E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220979
PNG
(CHEMBL67518)
Show SMILES CN(C)CCCN(C(C)=O)c1c2CCCCCc2nc2ccccc12
Show InChI InChI=1S/C21H29N3O/c1-16(25)24(15-9-14-23(2)3)21-17-10-5-4-6-12-19(17)22-20-13-8-7-11-18(20)21/h7-8,11,13H,4-6,9-10,12,14-15H2,1-3H3
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<1.00E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220978
PNG
(CHEMBL67712)
Show SMILES CC(C)(C)OC(=O)N1CCCN(CC1)c1c2CCCCCc2nc2ccccc12
Show InChI InChI=1S/C24H33N3O2/c1-24(2,3)29-23(28)27-15-9-14-26(16-17-27)22-18-10-5-4-6-12-20(18)25-21-13-8-7-11-19(21)22/h7-8,11,13H,4-6,9-10,12,14-17H2,1-3H3
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<1.00E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50220953
PNG
(CHEMBL302278)
Show SMILES C1CCc2nc3ccccc3c(N3CCCNCC3)c2CC1
Show InChI InChI=1S/C19H25N3/c1-2-7-15-17(9-3-1)21-18-10-5-4-8-16(18)19(15)22-13-6-11-20-12-14-22/h4-5,8,10,20H,1-3,6-7,9,11-14H2
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<1.00E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards cloned human H3L receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50220952
PNG
(CHEMBL67368)
Show SMILES C(CNc1c2CCCCCc2nc2ccccc12)Cn1ccnc1
Show InChI InChI=1S/C20H24N4/c1-2-7-16-18(9-3-1)23-19-10-5-4-8-17(19)20(16)22-11-6-13-24-14-12-21-15-24/h4-5,8,10,12,14-15H,1-3,6-7,9,11,13H2,(H,22,23)
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<1.00E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards cloned human H3L receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
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