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Compile Data Set for Download or QSAR

Found 152 hits Enz. Inhib. hit(s) with all data for entry = 50014197   
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))
BDBM50139391
PNG
((R)-4-(2-(2-(2-methylpyrrolidin-1-yl)ethyl)benzofu...)
Show SMILES C[C@@H]1CCCN1CCc1cc2cc(ccc2o1)-c1ccc(cc1)C#N |r|
Show InChI InChI=1S/C22H22N2O/c1-16-3-2-11-24(16)12-10-21-14-20-13-19(8-9-22(20)25-21)18-6-4-17(15-23)5-7-18/h4-9,13-14,16H,2-3,10-12H2,1H3/t16-/m1/s1
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0.447n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding potency was determined by displacement of [3H]-N-alpha-methyl histamine from cloned human histamine H3 receptor expressed in C6 cells


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50139391
PNG
((R)-4-(2-(2-(2-methylpyrrolidin-1-yl)ethyl)benzofu...)
Show SMILES C[C@@H]1CCCN1CCc1cc2cc(ccc2o1)-c1ccc(cc1)C#N |r|
Show InChI InChI=1S/C22H22N2O/c1-16-3-2-11-24(16)12-10-21-14-20-13-19(8-9-22(20)25-21)18-6-4-17(15-23)5-7-18/h4-9,13-14,16H,2-3,10-12H2,1H3/t16-/m1/s1
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0.450n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding potency was determined by displacement of [3H]N-alpha-methyl histamine from cloned human histamine H3 receptor expressed in C6 cells


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50139374
PNG
((6-{2-[2-((R)-2-Methyl-pyrrolidin-1-yl)-ethyl]-ben...)
Show SMILES C[C@@H]1CCCN1CCc1cc2cc(ccc2o1)-c1ccc(cn1)C(=O)N1CCOCC1
Show InChI InChI=1S/C25H29N3O3/c1-18-3-2-9-27(18)10-8-22-16-21-15-19(5-7-24(21)31-22)23-6-4-20(17-26-23)25(29)28-11-13-30-14-12-28/h4-7,15-18H,2-3,8-14H2,1H3/t18-/m1/s1
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0.550n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding potency was determined by displacement of [3H]-N-alpha-methyl histamine from cloned human histamine H3 receptor expressed in C6 cells


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50139374
PNG
((6-{2-[2-((R)-2-Methyl-pyrrolidin-1-yl)-ethyl]-ben...)
Show SMILES C[C@@H]1CCCN1CCc1cc2cc(ccc2o1)-c1ccc(cn1)C(=O)N1CCOCC1
Show InChI InChI=1S/C25H29N3O3/c1-18-3-2-9-27(18)10-8-22-16-21-15-19(5-7-24(21)31-22)23-6-4-20(17-26-23)25(29)28-11-13-30-14-12-28/h4-7,15-18H,2-3,8-14H2,1H3/t18-/m1/s1
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0.550n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding potency was determined by displacement of [3H]N-alpha-methyl histamine from cloned human histamine H3 receptor expressed in C6 cells


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50139403
PNG
((4-{2-[2-((R)-2-Methyl-pyrrolidin-1-yl)-ethyl]-ben...)
Show SMILES C[C@@H]1CCCN1CCc1cc2cc(ccc2o1)-c1ccc(cc1)C(=O)N1CCOCC1
Show InChI InChI=1S/C26H30N2O3/c1-19-3-2-11-27(19)12-10-24-18-23-17-22(8-9-25(23)31-24)20-4-6-21(7-5-20)26(29)28-13-15-30-16-14-28/h4-9,17-19H,2-3,10-16H2,1H3/t19-/m1/s1
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0.700n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding potency was determined by displacement of [3H]-N-alpha-methyl histamine from cloned human histamine H3 receptor expressed in C6 cells


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50139403
PNG
((4-{2-[2-((R)-2-Methyl-pyrrolidin-1-yl)-ethyl]-ben...)
Show SMILES C[C@@H]1CCCN1CCc1cc2cc(ccc2o1)-c1ccc(cc1)C(=O)N1CCOCC1
Show InChI InChI=1S/C26H30N2O3/c1-19-3-2-11-27(19)12-10-24-18-23-17-22(8-9-25(23)31-24)20-4-6-21(7-5-20)26(29)28-13-15-30-16-14-28/h4-9,17-19H,2-3,10-16H2,1H3/t19-/m1/s1
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0.708n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding potency was determined by displacement of [3H]N-alpha-methyl histamine from cloned human histamine H3 receptor expressed in C6 cells


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50139389
PNG
(4-{2-[2-(2-Methyl-pyrrolidin-1-yl)-ethyl]-benzofur...)
Show SMILES CC1CCCN1CCc1cc2cc(ccc2o1)-c1ccc(cc1)C#N
Show InChI InChI=1S/C22H22N2O/c1-16-3-2-11-24(16)12-10-21-14-20-13-19(8-9-22(20)25-21)18-6-4-17(15-23)5-7-18/h4-9,13-14,16H,2-3,10-12H2,1H3
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0.950n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding potency was determined by displacement of [3H]N-alpha-methyl histamine from cloned human histamine H3 receptor expressed in C6 cells


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50139389
PNG
(4-{2-[2-(2-Methyl-pyrrolidin-1-yl)-ethyl]-benzofur...)
Show SMILES CC1CCCN1CCc1cc2cc(ccc2o1)-c1ccc(cc1)C#N
Show InChI InChI=1S/C22H22N2O/c1-16-3-2-11-24(16)12-10-21-14-20-13-19(8-9-22(20)25-21)18-6-4-17(15-23)5-7-18/h4-9,13-14,16H,2-3,10-12H2,1H3
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0.955n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding potency was determined by displacement of [3H]-N-alpha-methyl histamine from cloned human histamine H3 receptor expressed in C6 cells


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50139382
PNG
((4-{2-[2-((2R,6S)-2,6-Dimethyl-piperidin-1-yl)-eth...)
Show SMILES C[C@H]1CCC[C@@H](C)N1CCc1cc2cc(ccc2o1)-c1ccc(cc1)C(=O)N1CCOCC1
Show InChI InChI=1S/C28H34N2O3/c1-20-4-3-5-21(2)30(20)13-12-26-19-25-18-24(10-11-27(25)33-26)22-6-8-23(9-7-22)28(31)29-14-16-32-17-15-29/h6-11,18-21H,3-5,12-17H2,1-2H3/t20-,21+
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1.20n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding potency was determined by displacement of [3H]N-alpha-methyl histamine from cloned human histamine H3 receptor expressed in C6 cells


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50139382
PNG
((4-{2-[2-((2R,6S)-2,6-Dimethyl-piperidin-1-yl)-eth...)
Show SMILES C[C@H]1CCC[C@@H](C)N1CCc1cc2cc(ccc2o1)-c1ccc(cc1)C(=O)N1CCOCC1
Show InChI InChI=1S/C28H34N2O3/c1-20-4-3-5-21(2)30(20)13-12-26-19-25-18-24(10-11-27(25)33-26)22-6-8-23(9-7-22)28(31)29-14-16-32-17-15-29/h6-11,18-21H,3-5,12-17H2,1-2H3/t20-,21+
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1.20n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding potency was determined by displacement of [3H]-N-alpha-methyl histamine from cloned human histamine H3 receptor expressed in C6 cells


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50139374
PNG
((6-{2-[2-((R)-2-Methyl-pyrrolidin-1-yl)-ethyl]-ben...)
Show SMILES C[C@@H]1CCCN1CCc1cc2cc(ccc2o1)-c1ccc(cn1)C(=O)N1CCOCC1
Show InChI InChI=1S/C25H29N3O3/c1-18-3-2-9-27(18)10-8-22-16-21-15-19(5-7-24(21)31-22)23-6-4-20(17-26-23)25(29)28-11-13-30-14-12-28/h4-7,15-18H,2-3,8-14H2,1H3/t18-/m1/s1
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1.60n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding potency was determined by displacement of [3H]N-alpha-methyl histamine from histamine H3 receptor of rat cortical membranes


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50139374
PNG
((6-{2-[2-((R)-2-Methyl-pyrrolidin-1-yl)-ethyl]-ben...)
Show SMILES C[C@@H]1CCCN1CCc1cc2cc(ccc2o1)-c1ccc(cn1)C(=O)N1CCOCC1
Show InChI InChI=1S/C25H29N3O3/c1-18-3-2-9-27(18)10-8-22-16-21-15-19(5-7-24(21)31-22)23-6-4-20(17-26-23)25(29)28-11-13-30-14-12-28/h4-7,15-18H,2-3,8-14H2,1H3/t18-/m1/s1
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1.60n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding potency was determined by displacement of [3H]-N-alpha-methyl histamine from histamine H3 receptor of rat cortical membranes


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50139408
PNG
((4-{2-[2-((S)-2-Hydroxymethyl-pyrrolidin-1-yl)-eth...)
Show SMILES OC[C@@H]1CCCN1CCc1cc2cc(ccc2o1)-c1ccc(cc1)C(=O)N1CCOCC1
Show InChI InChI=1S/C26H30N2O4/c29-18-23-2-1-10-27(23)11-9-24-17-22-16-21(7-8-25(22)32-24)19-3-5-20(6-4-19)26(30)28-12-14-31-15-13-28/h3-8,16-17,23,29H,1-2,9-15,18H2/t23-/m0/s1
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1.90n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding potency was determined by displacement of [3H]N-alpha-methyl histamine from cloned human histamine H3 receptor expressed in C6 cells


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50139403
PNG
((4-{2-[2-((R)-2-Methyl-pyrrolidin-1-yl)-ethyl]-ben...)
Show SMILES C[C@@H]1CCCN1CCc1cc2cc(ccc2o1)-c1ccc(cc1)C(=O)N1CCOCC1
Show InChI InChI=1S/C26H30N2O3/c1-19-3-2-11-27(19)12-10-24-18-23-17-22(8-9-25(23)31-24)20-4-6-21(7-5-20)26(29)28-13-15-30-16-14-28/h4-9,17-19H,2-3,10-16H2,1H3/t19-/m1/s1
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1.90n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding potency was determined by displacement of [3H]N-alpha-methyl histamine from histamine H3 receptor of rat cortical membranes


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50139408
PNG
((4-{2-[2-((S)-2-Hydroxymethyl-pyrrolidin-1-yl)-eth...)
Show SMILES OC[C@@H]1CCCN1CCc1cc2cc(ccc2o1)-c1ccc(cc1)C(=O)N1CCOCC1
Show InChI InChI=1S/C26H30N2O4/c29-18-23-2-1-10-27(23)11-9-24-17-22-16-21(7-8-25(22)32-24)19-3-5-20(6-4-19)26(30)28-12-14-31-15-13-28/h3-8,16-17,23,29H,1-2,9-15,18H2/t23-/m0/s1
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1.90n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding potency was determined by displacement of [3H]-N-alpha-methyl histamine from cloned human histamine H3 receptor expressed in C6 cells


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50139403
PNG
((4-{2-[2-((R)-2-Methyl-pyrrolidin-1-yl)-ethyl]-ben...)
Show SMILES C[C@@H]1CCCN1CCc1cc2cc(ccc2o1)-c1ccc(cc1)C(=O)N1CCOCC1
Show InChI InChI=1S/C26H30N2O3/c1-19-3-2-11-27(19)12-10-24-18-23-17-22(8-9-25(23)31-24)20-4-6-21(7-5-20)26(29)28-13-15-30-16-14-28/h4-9,17-19H,2-3,10-16H2,1H3/t19-/m1/s1
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2n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
pBinding potency of the compound was determined by displacement of [3H]-N-alpha-methyl histamine from histamine H3 receptor of rat cortical membranes


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50139380
PNG
(4-{2-[2-((S)-2-Hydroxymethyl-pyrrolidin-1-yl)-ethy...)
Show SMILES OC[C@@H]1CCCN1CCc1cc2cc(ccc2o1)-c1ccc(cc1)C#N
Show InChI InChI=1S/C22H22N2O2/c23-14-16-3-5-17(6-4-16)18-7-8-22-19(12-18)13-21(26-22)9-11-24-10-1-2-20(24)15-25/h3-8,12-13,20,25H,1-2,9-11,15H2/t20-/m0/s1
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2.20n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding potency was determined by displacement of [3H]-N-alpha-methyl histamine from cloned human histamine H3 receptor expressed in C6 cells


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50139383
PNG
((4-{2-[2-((2R,5R)-2,5-Dimethyl-pyrrolidin-1-yl)-et...)
Show SMILES C[C@@H]1CC[C@@H](C)N1CCc1cc2cc(ccc2o1)-c1ccc(cc1)C(=O)N1CCOCC1
Show InChI InChI=1S/C27H32N2O3/c1-19-3-4-20(2)29(19)12-11-25-18-24-17-23(9-10-26(24)32-25)21-5-7-22(8-6-21)27(30)28-13-15-31-16-14-28/h5-10,17-20H,3-4,11-16H2,1-2H3/t19-,20-/m1/s1
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2.20n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding potency was determined by displacement of [3H]-N-alpha-methyl histamine from cloned human histamine H3 receptor expressed in C6 cells


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50139383
PNG
((4-{2-[2-((2R,5R)-2,5-Dimethyl-pyrrolidin-1-yl)-et...)
Show SMILES C[C@@H]1CC[C@@H](C)N1CCc1cc2cc(ccc2o1)-c1ccc(cc1)C(=O)N1CCOCC1
Show InChI InChI=1S/C27H32N2O3/c1-19-3-4-20(2)29(19)12-11-25-18-24-17-23(9-10-26(24)32-25)21-5-7-22(8-6-21)27(30)28-13-15-31-16-14-28/h5-10,17-20H,3-4,11-16H2,1-2H3/t19-,20-/m1/s1
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2.20n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding potency was determined by displacement of [3H]N-alpha-methyl histamine from cloned human histamine H3 receptor expressed in C6 cells


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50139380
PNG
(4-{2-[2-((S)-2-Hydroxymethyl-pyrrolidin-1-yl)-ethy...)
Show SMILES OC[C@@H]1CCCN1CCc1cc2cc(ccc2o1)-c1ccc(cc1)C#N
Show InChI InChI=1S/C22H22N2O2/c23-14-16-3-5-17(6-4-16)18-7-8-22-19(12-18)13-21(26-22)9-11-24-10-1-2-20(24)15-25/h3-8,12-13,20,25H,1-2,9-11,15H2/t20-/m0/s1
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2.20n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding potency was determined by displacement of [3H]N-alpha-methyl histamine from cloned human histamine H3 receptor expressed in C6 cells


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50139388
PNG
(CHEMBL159565 | Morpholin-4-yl-{4-[2-(2-piperidin-1...)
Show SMILES O=C(N1CCOCC1)c1ccc(cc1)-c1ccc2oc(CCN3CCCCC3)cc2c1
Show InChI InChI=1S/C26H30N2O3/c29-26(28-14-16-30-17-15-28)21-6-4-20(5-7-21)22-8-9-25-23(18-22)19-24(31-25)10-13-27-11-2-1-3-12-27/h4-9,18-19H,1-3,10-17H2
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2.30n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding potency was determined by displacement of [3H]-N-alpha-methyl histamine from cloned human histamine H3 receptor expressed in C6 cells


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50139388
PNG
(CHEMBL159565 | Morpholin-4-yl-{4-[2-(2-piperidin-1...)
Show SMILES O=C(N1CCOCC1)c1ccc(cc1)-c1ccc2oc(CCN3CCCCC3)cc2c1
Show InChI InChI=1S/C26H30N2O3/c29-26(28-14-16-30-17-15-28)21-6-4-20(5-7-21)22-8-9-25-23(18-22)19-24(31-25)10-13-27-11-2-1-3-12-27/h4-9,18-19H,1-3,10-17H2
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2.30n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding potency was determined by displacement of [3H]N-alpha-methyl histamine from cloned human histamine H3 receptor expressed in C6 cells


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50139407
PNG
(4-{2-[2-((2R,6S)-2,6-Dimethyl-piperidin-1-yl)-ethy...)
Show SMILES C[C@H]1CCC[C@@H](C)N1CCc1cc2cc(ccc2o1)-c1ccc(cc1)C#N
Show InChI InChI=1S/C24H26N2O/c1-17-4-3-5-18(2)26(17)13-12-23-15-22-14-21(10-11-24(22)27-23)20-8-6-19(16-25)7-9-20/h6-11,14-15,17-18H,3-5,12-13H2,1-2H3/t17-,18+
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2.40n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding potency was determined by displacement of [3H]-N-alpha-methyl histamine from cloned human histamine H3 receptor expressed in C6 cells


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50139407
PNG
(4-{2-[2-((2R,6S)-2,6-Dimethyl-piperidin-1-yl)-ethy...)
Show SMILES C[C@H]1CCC[C@@H](C)N1CCc1cc2cc(ccc2o1)-c1ccc(cc1)C#N
Show InChI InChI=1S/C24H26N2O/c1-17-4-3-5-18(2)26(17)13-12-23-15-22-14-21(10-11-24(22)27-23)20-8-6-19(16-25)7-9-20/h6-11,14-15,17-18H,3-5,12-13H2,1-2H3/t17-,18+
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2.40n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding potency was determined by displacement of [3H]N-alpha-methyl histamine from cloned human histamine H3 receptor expressed in C6 cells


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50139402
PNG
((4-{2-[2-(2-Methyl-piperidin-1-yl)-ethyl]-benzofur...)
Show SMILES CC1CCCCN1CCc1cc2cc(ccc2o1)-c1ccc(cc1)C(=O)N1CCOCC1
Show InChI InChI=1S/C27H32N2O3/c1-20-4-2-3-12-28(20)13-11-25-19-24-18-23(9-10-26(24)32-25)21-5-7-22(8-6-21)27(30)29-14-16-31-17-15-29/h5-10,18-20H,2-4,11-17H2,1H3
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3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding potency was determined by displacement of [3H]N-alpha-methyl histamine from cloned human histamine H3 receptor expressed in C6 cells


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50139402
PNG
((4-{2-[2-(2-Methyl-piperidin-1-yl)-ethyl]-benzofur...)
Show SMILES CC1CCCCN1CCc1cc2cc(ccc2o1)-c1ccc(cc1)C(=O)N1CCOCC1
Show InChI InChI=1S/C27H32N2O3/c1-20-4-2-3-12-28(20)13-11-25-19-24-18-23(9-10-26(24)32-25)21-5-7-22(8-6-21)27(30)29-14-16-31-17-15-29/h5-10,18-20H,2-4,11-17H2,1H3
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3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding potency was determined by displacement of [3H]-N-alpha-methyl histamine from cloned human histamine H3 receptor expressed in C6 cells


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50139391
PNG
((R)-4-(2-(2-(2-methylpyrrolidin-1-yl)ethyl)benzofu...)
Show SMILES C[C@@H]1CCCN1CCc1cc2cc(ccc2o1)-c1ccc(cc1)C#N |r|
Show InChI InChI=1S/C22H22N2O/c1-16-3-2-11-24(16)12-10-21-14-20-13-19(8-9-22(20)25-21)18-6-4-17(15-23)5-7-18/h4-9,13-14,16H,2-3,10-12H2,1H3/t16-/m1/s1
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3.20n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding potency was determined by displacement of [3H]N-alpha-methyl histamine from histamine H3 receptor of rat cortical membranes


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50139391
PNG
((R)-4-(2-(2-(2-methylpyrrolidin-1-yl)ethyl)benzofu...)
Show SMILES C[C@@H]1CCCN1CCc1cc2cc(ccc2o1)-c1ccc(cc1)C#N |r|
Show InChI InChI=1S/C22H22N2O/c1-16-3-2-11-24(16)12-10-21-14-20-13-19(8-9-22(20)25-21)18-6-4-17(15-23)5-7-18/h4-9,13-14,16H,2-3,10-12H2,1H3/t16-/m1/s1
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3.20n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding potency was determined by displacement of [3H]-N-alpha-methyl histamine from histamine H3 receptor of rat cortical membranes


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50139385
PNG
(CHEMBL346562 | {4-[2-(2-Azepan-1-yl-ethyl)-benzofu...)
Show SMILES O=C(N1CCOCC1)c1ccc(cc1)-c1ccc2oc(CCN3CCCCCC3)cc2c1
Show InChI InChI=1S/C27H32N2O3/c30-27(29-15-17-31-18-16-29)22-7-5-21(6-8-22)23-9-10-26-24(19-23)20-25(32-26)11-14-28-12-3-1-2-4-13-28/h5-10,19-20H,1-4,11-18H2
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3.5n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding potency was determined by displacement of [3H]N-alpha-methyl histamine from cloned human histamine H3 receptor expressed in C6 cells


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50139385
PNG
(CHEMBL346562 | {4-[2-(2-Azepan-1-yl-ethyl)-benzofu...)
Show SMILES O=C(N1CCOCC1)c1ccc(cc1)-c1ccc2oc(CCN3CCCCCC3)cc2c1
Show InChI InChI=1S/C27H32N2O3/c30-27(29-15-17-31-18-16-29)22-7-5-21(6-8-22)23-9-10-26-24(19-23)20-25(32-26)11-14-28-12-3-1-2-4-13-28/h5-10,19-20H,1-4,11-18H2
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3.5n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding potency was determined by displacement of [3H]-N-alpha-methyl histamine from cloned human histamine H3 receptor expressed in C6 cells


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50139392
PNG
(CHEMBL422360 | Morpholin-4-yl-{6-[2-(2-pyrrolidin-...)
Show SMILES O=C(N1CCOCC1)c1ccc(nc1)-c1ccc2oc(CCN3CCCC3)cc2c1
Show InChI InChI=1S/C24H27N3O3/c28-24(27-11-13-29-14-12-27)19-3-5-22(25-17-19)18-4-6-23-20(15-18)16-21(30-23)7-10-26-8-1-2-9-26/h3-6,15-17H,1-2,7-14H2
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3.90n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding potency was determined by displacement of [3H]-N-alpha-methyl histamine from cloned human histamine H3 receptor expressed in C6 cells


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50139392
PNG
(CHEMBL422360 | Morpholin-4-yl-{6-[2-(2-pyrrolidin-...)
Show SMILES O=C(N1CCOCC1)c1ccc(nc1)-c1ccc2oc(CCN3CCCC3)cc2c1
Show InChI InChI=1S/C24H27N3O3/c28-24(27-11-13-29-14-12-27)19-3-5-22(25-17-19)18-4-6-23-20(15-18)16-21(30-23)7-10-26-8-1-2-9-26/h3-6,15-17H,1-2,7-14H2
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4n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding potency was determined by displacement of [3H]N-alpha-methyl histamine from cloned human histamine H3 receptor expressed in C6 cells


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50139377
PNG
(4-[2-(2-Pyrrolidin-1-yl-ethyl)-benzofuran-5-yl]-be...)
Show SMILES N#Cc1ccc(cc1)-c1ccc2oc(CCN3CCCC3)cc2c1
Show InChI InChI=1S/C21H20N2O/c22-15-16-3-5-17(6-4-16)18-7-8-21-19(13-18)14-20(24-21)9-12-23-10-1-2-11-23/h3-8,13-14H,1-2,9-12H2
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4.20n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding potency was determined by displacement of [3H]N-alpha-methyl histamine from cloned human histamine H3 receptor expressed in C6 cells


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50139377
PNG
(4-[2-(2-Pyrrolidin-1-yl-ethyl)-benzofuran-5-yl]-be...)
Show SMILES N#Cc1ccc(cc1)-c1ccc2oc(CCN3CCCC3)cc2c1
Show InChI InChI=1S/C21H20N2O/c22-15-16-3-5-17(6-4-16)18-7-8-21-19(13-18)14-20(24-21)9-12-23-10-1-2-11-23/h3-8,13-14H,1-2,9-12H2
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4.30n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding potency was determined by displacement of [3H]-N-alpha-methyl histamine from cloned human histamine H3 receptor expressed in C6 cells


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50139387
PNG
(4-{2-[2-((2R,5R)-2,5-Dimethyl-pyrrolidin-1-yl)-eth...)
Show SMILES C[C@@H]1CC[C@@H](C)N1CCc1cc2cc(ccc2o1)-c1ccc(cc1)C#N
Show InChI InChI=1S/C23H24N2O/c1-16-3-4-17(2)25(16)12-11-22-14-21-13-20(9-10-23(21)26-22)19-7-5-18(15-24)6-8-19/h5-10,13-14,16-17H,3-4,11-12H2,1-2H3/t16-,17-/m1/s1
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5.10n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding potency was determined by displacement of [3H]N-alpha-methyl histamine from cloned human histamine H3 receptor expressed in C6 cells


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50139387
PNG
(4-{2-[2-((2R,5R)-2,5-Dimethyl-pyrrolidin-1-yl)-eth...)
Show SMILES C[C@@H]1CC[C@@H](C)N1CCc1cc2cc(ccc2o1)-c1ccc(cc1)C#N
Show InChI InChI=1S/C23H24N2O/c1-16-3-4-17(2)25(16)12-11-22-14-21-13-20(9-10-23(21)26-22)19-7-5-18(15-24)6-8-19/h5-10,13-14,16-17H,3-4,11-12H2,1-2H3/t16-,17-/m1/s1
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5.10n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding potency was determined by displacement of [3H]-N-alpha-methyl histamine from cloned human histamine H3 receptor expressed in C6 cells


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50139410
PNG
((6-{2-[2-((2R,6S)-2,6-Dimethyl-piperidin-1-yl)-eth...)
Show SMILES C[C@H]1CCC[C@@H](C)N1CCc1cc2cc(ccc2o1)-c1ccc(cn1)C(=O)N1CCOCC1
Show InChI InChI=1S/C27H33N3O3/c1-19-4-3-5-20(2)30(19)11-10-24-17-23-16-21(7-9-26(23)33-24)25-8-6-22(18-28-25)27(31)29-12-14-32-15-13-29/h6-9,16-20H,3-5,10-15H2,1-2H3/t19-,20+
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5.60n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding potency was determined by displacement of [3H]-N-alpha-methyl histamine from cloned human histamine H3 receptor expressed in C6 cells


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50139410
PNG
((6-{2-[2-((2R,6S)-2,6-Dimethyl-piperidin-1-yl)-eth...)
Show SMILES C[C@H]1CCC[C@@H](C)N1CCc1cc2cc(ccc2o1)-c1ccc(cn1)C(=O)N1CCOCC1
Show InChI InChI=1S/C27H33N3O3/c1-19-4-3-5-20(2)30(19)11-10-24-17-23-16-21(7-9-26(23)33-24)25-8-6-22(18-28-25)27(31)29-12-14-32-15-13-29/h6-9,16-20H,3-5,10-15H2,1-2H3/t19-,20+
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5.60n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding potency was determined by displacement of [3H]N-alpha-methyl histamine from cloned human histamine H3 receptor expressed in C6 cells


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50139394
PNG
(4-{2-[2-(2-Methyl-piperidin-1-yl)-ethyl]-benzofura...)
Show SMILES CC1CCCCN1CCc1cc2cc(ccc2o1)-c1ccc(cc1)C#N
Show InChI InChI=1S/C23H24N2O/c1-17-4-2-3-12-25(17)13-11-22-15-21-14-20(9-10-23(21)26-22)19-7-5-18(16-24)6-8-19/h5-10,14-15,17H,2-4,11-13H2,1H3
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5.80n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding potency was determined by displacement of [3H]N-alpha-methyl histamine from cloned human histamine H3 receptor expressed in C6 cells


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50139411
PNG
((6-{2-[2-((2R,5R)-2,5-Dimethyl-pyrrolidin-1-yl)-et...)
Show SMILES C[C@@H]1CC[C@@H](C)N1CCc1cc2cc(ccc2o1)-c1ccc(cn1)C(=O)N1CCOCC1
Show InChI InChI=1S/C26H31N3O3/c1-18-3-4-19(2)29(18)10-9-23-16-22-15-20(6-8-25(22)32-23)24-7-5-21(17-27-24)26(30)28-11-13-31-14-12-28/h5-8,15-19H,3-4,9-14H2,1-2H3/t18-,19-/m1/s1
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5.90n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding potency was determined by displacement of [3H]N-alpha-methyl histamine from cloned human histamine H3 receptor expressed in C6 cells


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50139411
PNG
((6-{2-[2-((2R,5R)-2,5-Dimethyl-pyrrolidin-1-yl)-et...)
Show SMILES C[C@@H]1CC[C@@H](C)N1CCc1cc2cc(ccc2o1)-c1ccc(cn1)C(=O)N1CCOCC1
Show InChI InChI=1S/C26H31N3O3/c1-18-3-4-19(2)29(18)10-9-23-16-22-15-20(6-8-25(22)32-23)24-7-5-21(17-27-24)26(30)28-11-13-31-14-12-28/h5-8,15-19H,3-4,9-14H2,1-2H3/t18-,19-/m1/s1
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5.90n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding potency was determined by displacement of [3H]-N-alpha-methyl histamine from cloned human histamine H3 receptor expressed in C6 cells


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50139398
PNG
((4-{2-[2-(3,6-Dihydro-2H-pyridin-1-yl)-ethyl]-benz...)
Show SMILES O=C(N1CCOCC1)c1ccc(cc1)-c1ccc2oc(CCN3CCC=CC3)cc2c1 |c:27|
Show InChI InChI=1S/C26H28N2O3/c29-26(28-14-16-30-17-15-28)21-6-4-20(5-7-21)22-8-9-25-23(18-22)19-24(31-25)10-13-27-11-2-1-3-12-27/h1-2,4-9,18-19H,3,10-17H2
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5.90n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding potency was determined by displacement of [3H]-N-alpha-methyl histamine from cloned human histamine H3 receptor expressed in C6 cells


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50139394
PNG
(4-{2-[2-(2-Methyl-piperidin-1-yl)-ethyl]-benzofura...)
Show SMILES CC1CCCCN1CCc1cc2cc(ccc2o1)-c1ccc(cc1)C#N
Show InChI InChI=1S/C23H24N2O/c1-17-4-2-3-12-25(17)13-11-22-15-21-14-20(9-10-23(21)26-22)19-7-5-18(16-24)6-8-19/h5-10,14-15,17H,2-4,11-13H2,1H3
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5.90n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding potency was determined by displacement of [3H]-N-alpha-methyl histamine from cloned human histamine H3 receptor expressed in C6 cells


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50139398
PNG
((4-{2-[2-(3,6-Dihydro-2H-pyridin-1-yl)-ethyl]-benz...)
Show SMILES O=C(N1CCOCC1)c1ccc(cc1)-c1ccc2oc(CCN3CCC=CC3)cc2c1 |c:27|
Show InChI InChI=1S/C26H28N2O3/c29-26(28-14-16-30-17-15-28)21-6-4-20(5-7-21)22-8-9-25-23(18-22)19-24(31-25)10-13-27-11-2-1-3-12-27/h1-2,4-9,18-19H,3,10-17H2
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5.90n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding potency was determined by displacement of [3H]N-alpha-methyl histamine from cloned human histamine H3 receptor expressed in C6 cells


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50139388
PNG
(CHEMBL159565 | Morpholin-4-yl-{4-[2-(2-piperidin-1...)
Show SMILES O=C(N1CCOCC1)c1ccc(cc1)-c1ccc2oc(CCN3CCCCC3)cc2c1
Show InChI InChI=1S/C26H30N2O3/c29-26(28-14-16-30-17-15-28)21-6-4-20(5-7-21)22-8-9-25-23(18-22)19-24(31-25)10-13-27-11-2-1-3-12-27/h4-9,18-19H,1-3,10-17H2
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6.20n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding potency was determined by displacement of [3H]N-alpha-methyl histamine from histamine H3 receptor of rat cortical membranes


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50404283
PNG
(CHEMBL2112921)
Show SMILES O[C@@H]1CCN(CCc2cc3cc(ccc3o2)-c2ccc(cc2)C(=O)N2CCOCC2)C1 |r|
Show InChI InChI=1S/C25H28N2O4/c28-22-7-9-26(17-22)10-8-23-16-21-15-20(5-6-24(21)31-23)18-1-3-19(4-2-18)25(29)27-11-13-30-14-12-27/h1-6,15-16,22,28H,7-14,17H2/t22-/m1/s1
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6.20n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding potency was determined by displacement of [3H]-N-alpha-methyl histamine from cloned human histamine H3 receptor expressed in C6 cells


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50139388
PNG
(CHEMBL159565 | Morpholin-4-yl-{4-[2-(2-piperidin-1...)
Show SMILES O=C(N1CCOCC1)c1ccc(cc1)-c1ccc2oc(CCN3CCCCC3)cc2c1
Show InChI InChI=1S/C26H30N2O3/c29-26(28-14-16-30-17-15-28)21-6-4-20(5-7-21)22-8-9-25-23(18-22)19-24(31-25)10-13-27-11-2-1-3-12-27/h4-9,18-19H,1-3,10-17H2
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6.20n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding potency was determined by displacement of [3H]-N-alpha-methyl histamine from histamine H3 receptor of rat cortical membranes


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50404283
PNG
(CHEMBL2112921)
Show SMILES O[C@@H]1CCN(CCc2cc3cc(ccc3o2)-c2ccc(cc2)C(=O)N2CCOCC2)C1 |r|
Show InChI InChI=1S/C25H28N2O4/c28-22-7-9-26(17-22)10-8-23-16-21-15-20(5-6-24(21)31-23)18-1-3-19(4-2-18)25(29)27-11-13-30-14-12-27/h1-6,15-16,22,28H,7-14,17H2/t22-/m1/s1
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6.20n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding potency was determined by displacement of [3H]N-alpha-methyl histamine from cloned human histamine H3 receptor expressed in C6 cells


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50139389
PNG
(4-{2-[2-(2-Methyl-pyrrolidin-1-yl)-ethyl]-benzofur...)
Show SMILES CC1CCCN1CCc1cc2cc(ccc2o1)-c1ccc(cc1)C#N
Show InChI InChI=1S/C22H22N2O/c1-16-3-2-11-24(16)12-10-21-14-20-13-19(8-9-22(20)25-21)18-6-4-17(15-23)5-7-18/h4-9,13-14,16H,2-3,10-12H2,1H3
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6.5n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding potency was determined by displacement of [3H]-N-alpha-methyl histamine from histamine H3 receptor of rat cortical membranes


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50139389
PNG
(4-{2-[2-(2-Methyl-pyrrolidin-1-yl)-ethyl]-benzofur...)
Show SMILES CC1CCCN1CCc1cc2cc(ccc2o1)-c1ccc(cc1)C#N
Show InChI InChI=1S/C22H22N2O/c1-16-3-2-11-24(16)12-10-21-14-20-13-19(8-9-22(20)25-21)18-6-4-17(15-23)5-7-18/h4-9,13-14,16H,2-3,10-12H2,1H3
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6.5n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding potency was determined by displacement of [3H]N-alpha-methyl histamine from histamine H3 receptor of rat cortical membranes


Bioorg Med Chem Lett 14: 689-93 (2004)


BindingDB Entry DOI: 10.7270/Q20C4V5H
More data for this
Ligand-Target Pair
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