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Compile Data Set for Download or QSAR

Found 210 hits of ic50 for UniProtKB: P31389   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50007538
PNG
(8-(2-Azetidin-1-yl-ethyl)-3-chloro-6-methyl-7,8-di...)
Show SMILES CN1C[C@@H](CCN2CCC2)Oc2ncc(Cl)cc2C1=S
Show InChI InChI=1S/C14H18ClN3OS/c1-17-9-11(3-6-18-4-2-5-18)19-13-12(14(17)20)7-10(15)8-16-13/h7-8,11H,2-6,9H2,1H3/t11-/m1/s1
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n/an/a 0.260n/an/an/an/an/an/a



A. H. Robins Company, Inc.

Curated by ChEMBL


Assay Description
Inhibition of [3H]-mepyramine binding to the histamine receptor in guinea pig cortex


J Med Chem 34: 1314-28 (1991)


BindingDB Entry DOI: 10.7270/Q23F4NMG
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50017674
PNG
((2-Benzhydryloxy-ethyl)-dimethyl-amine | 2-(benzhy...)
Show SMILES CN(C)CCOC(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C17H21NO/c1-18(2)13-14-19-17(15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-12,17H,13-14H2,1-2H3
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n/an/a 1n/an/an/an/an/an/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Antihistaminic activity against Histamine H1 receptor was measured on isolated terminal part of guinea pig ileum


J Med Chem 33: 2970-6 (1990)


BindingDB Entry DOI: 10.7270/Q2Z89DMH
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM22567
PNG
(3H]pyrilamine | CHEMBL511 | Dorantamin | MEPYRAMIN...)
Show SMILES COc1ccc(CN(CCN(C)C)c2ccccn2)cc1
Show InChI InChI=1S/C17H23N3O/c1-19(2)12-13-20(17-6-4-5-11-18-17)14-15-7-9-16(21-3)10-8-15/h4-11H,12-14H2,1-3H3
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n/an/a 1.5n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of guinea pig histamine H1 receptor


Bioorg Med Chem 18: 7675-99 (2010)


Article DOI: 10.1016/j.bmc.2010.07.034
BindingDB Entry DOI: 10.7270/Q2DF6S69
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50131441
PNG
(9,13b-dihydro-1H-dibenzo[c,f]imidazo[1,5-a]azepin-...)
Show SMILES NC1=NCC2N1c1ccccc1Cc1ccccc21 |t:1|
Show InChI InChI=1S/C16H15N3/c17-16-18-10-15-13-7-3-1-5-11(13)9-12-6-2-4-8-14(12)19(15)16/h1-8,15H,9-10H2,(H2,17,18)
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n/an/a 1.58n/an/an/an/an/an/a



Vrije Universiteit

Curated by ChEMBL


Assay Description
Potency against histamine H1 receptor on guinea pig ileum


J Med Chem 38: 3351-60 (1995)


BindingDB Entry DOI: 10.7270/Q2ZW1N49
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50007542
PNG
(3-Chloro-8-(2-dimethylamino-ethyl)-6-methyl-7,8-di...)
Show SMILES CN(C)CC[C@@H]1CN(C)C(=S)c2cc(Cl)cnc2O1
Show InChI InChI=1S/C13H18ClN3OS/c1-16(2)5-4-10-8-17(3)13(19)11-6-9(14)7-15-12(11)18-10/h6-7,10H,4-5,8H2,1-3H3/t10-/m1/s1
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n/an/a 1.90n/an/an/an/an/an/a



A. H. Robins Company, Inc.

Curated by ChEMBL


Assay Description
Inhibition of [3H]-mepyramine binding to the histamine receptor in guinea pig cortex


J Med Chem 34: 1314-28 (1991)


BindingDB Entry DOI: 10.7270/Q23F4NMG
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50019624
PNG
(1-(2-Ethoxy-ethyl)-2-(4-methyl-[1,4]diazepan-1-yl)...)
Show SMILES CCOCCn1c(nc2ccccc12)N1CCCN(C)CC1
Show InChI InChI=1S/C17H26N4O/c1-3-22-14-13-21-16-8-5-4-7-15(16)18-17(21)20-10-6-9-19(2)11-12-20/h4-5,7-8H,3,6,9-14H2,1-2H3
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n/an/a 6.10n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of histamine-induced contractions in guinea pig ileum


J Med Chem 29: 1178-83 (1987)


BindingDB Entry DOI: 10.7270/Q2QR4XPC
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50019595
PNG
(2-(4-Methyl-piperazin-1-yl)-1-(2-phenoxy-ethyl)-1H...)
Show SMILES CN1CCN(CC1)c1nc2ccccc2n1CCOc1ccccc1
Show InChI InChI=1S/C20H24N4O/c1-22-11-13-23(14-12-22)20-21-18-9-5-6-10-19(18)24(20)15-16-25-17-7-3-2-4-8-17/h2-10H,11-16H2,1H3
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TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of histamine-induced contractions in guinea pig ileum


J Med Chem 29: 1178-83 (1987)


BindingDB Entry DOI: 10.7270/Q2QR4XPC
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50019605
PNG
(1-(2-Ethoxy-ethyl)-2-(4-pentyl-[1,4]diazepan-1-yl)...)
Show SMILES CCCCCN1CCCN(CC1)c1nc2ccccc2n1CCOCC
Show InChI InChI=1S/C21H34N4O/c1-3-5-8-12-23-13-9-14-24(16-15-23)21-22-19-10-6-7-11-20(19)25(21)17-18-26-4-2/h6-7,10-11H,3-5,8-9,12-18H2,1-2H3
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n/an/a 7.40n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of histamine-induced contractions in guinea pig ileum


J Med Chem 29: 1178-83 (1987)


BindingDB Entry DOI: 10.7270/Q2QR4XPC
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50017371
PNG
(1-[4-(3-{4-[Bis-(4-fluoro-phenyl)-hydroxy-methyl]-...)
Show SMILES COc1cc(ccc1OCCCN1CCC(CC1)C(O)(c1ccc(F)cc1)c1ccc(F)cc1)C(C)=O
Show InChI InChI=1S/C30H33F2NO4/c1-21(34)22-4-13-28(29(20-22)36-2)37-19-3-16-33-17-14-25(15-18-33)30(35,23-5-9-26(31)10-6-23)24-7-11-27(32)12-8-24/h4-13,20,25,35H,3,14-19H2,1-2H3
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A.H. Robins Company

Curated by ChEMBL


Assay Description
Inhibitory activity of the compound against Tritiated [3H]- mepyramine binding to histamine H1 receptor in guinea pig cerebral cortex


J Med Chem 32: 105-18 (1989)


BindingDB Entry DOI: 10.7270/Q2WM1CD6
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50019644
PNG
(1-(2-Ethoxy-ethyl)-2-(4-propyl-[1,4]diazepan-1-yl)...)
Show SMILES CCCN1CCCN(CC1)c1nc2ccccc2n1CCOCC
Show InChI InChI=1S/C19H30N4O/c1-3-10-21-11-7-12-22(14-13-21)19-20-17-8-5-6-9-18(17)23(19)15-16-24-4-2/h5-6,8-9H,3-4,7,10-16H2,1-2H3
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n/an/a 8.40n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of histamine-induced contractions in guinea pig ileum


J Med Chem 29: 1178-83 (1987)


BindingDB Entry DOI: 10.7270/Q2QR4XPC
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50019643
PNG
(2-(4-Butyl-[1,4]diazepan-1-yl)-1-(2-ethoxy-ethyl)-...)
Show SMILES CCCCN1CCCN(CC1)c1nc2ccccc2n1CCOCC
Show InChI InChI=1S/C20H32N4O/c1-3-5-11-22-12-8-13-23(15-14-22)20-21-18-9-6-7-10-19(18)24(20)16-17-25-4-2/h6-7,9-10H,3-5,8,11-17H2,1-2H3
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TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of histamine-induced contractions in guinea pig ileum


J Med Chem 29: 1178-83 (1987)


BindingDB Entry DOI: 10.7270/Q2QR4XPC
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50019602
PNG
(1-(2-Ethoxy-ethyl)-2-(4-hexyl-piperazin-1-yl)-1H-b...)
Show SMILES CCCCCCN1CCN(CC1)c1nc2ccccc2n1CCOCC
Show InChI InChI=1S/C21H34N4O/c1-3-5-6-9-12-23-13-15-24(16-14-23)21-22-19-10-7-8-11-20(19)25(21)17-18-26-4-2/h7-8,10-11H,3-6,9,12-18H2,1-2H3
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n/an/a 8.60n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of histamine-induced contractions in guinea pig ileum


J Med Chem 29: 1178-83 (1987)


BindingDB Entry DOI: 10.7270/Q2QR4XPC
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM35938
PNG
(1-(p-chlorophenyl)-1-(2-pyridyl)-3-N,N-dimethylpro...)
Show SMILES CN(C)CCC(c1ccc(Cl)cc1)c1ccccn1
Show InChI InChI=1S/C16H19ClN2/c1-19(2)12-10-15(16-5-3-4-11-18-16)13-6-8-14(17)9-7-13/h3-9,11,15H,10,12H2,1-2H3
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n/an/a 8.80n/an/an/an/an/an/a



A. H. Robins Company, Inc.

Curated by ChEMBL


Assay Description
Inhibition of [3H]-mepyramine binding to the Histamine H1 receptor in guinea pig cortex


J Med Chem 34: 1314-28 (1991)


BindingDB Entry DOI: 10.7270/Q23F4NMG
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM76863
PNG
(3-[3-(4-benzhydrylpiperazin-1-yl)propyl]-1H-benzim...)
Show SMILES O=c1[nH]c2ccccc2n1CCCN1CCN(CC1)C(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C27H30N4O/c32-27-28-24-14-7-8-15-25(24)31(27)17-9-16-29-18-20-30(21-19-29)26(22-10-3-1-4-11-22)23-12-5-2-6-13-23/h1-8,10-15,26H,9,16-21H2,(H,28,32)
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n/an/a 9n/an/an/an/an/an/a



A.H. Robins Company

Curated by ChEMBL


Assay Description
Inhibitory activity of the compound against Tritiated [3H]- mepyramine binding to Histamine H1 receptor in guinea pig cerebral cortex


J Med Chem 32: 105-18 (1989)


BindingDB Entry DOI: 10.7270/Q2WM1CD6
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50019628
PNG
(2-(4-Methyl-[1,4]diazepan-1-yl)-1-(2-phenoxy-ethyl...)
Show SMILES CN1CCCN(CC1)c1nc2ccccc2n1CCOc1ccccc1
Show InChI InChI=1S/C21H26N4O/c1-23-12-7-13-24(15-14-23)21-22-19-10-5-6-11-20(19)25(21)16-17-26-18-8-3-2-4-9-18/h2-6,8-11H,7,12-17H2,1H3
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n/an/a 9.10n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of histamine-induced contractions in guinea pig ileum


J Med Chem 29: 1178-83 (1987)


BindingDB Entry DOI: 10.7270/Q2QR4XPC
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50019609
PNG
(2-(4-Methyl-[1,4]diazepan-1-yl)-1-(2-prop-2-ynylox...)
Show SMILES CN1CCCN(CC1)c1nc2ccccc2n1CCOCC#C
Show InChI InChI=1S/C18H24N4O/c1-3-14-23-15-13-22-17-8-5-4-7-16(17)19-18(22)21-10-6-9-20(2)11-12-21/h1,4-5,7-8H,6,9-15H2,2H3
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TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of histamine-induced contractions in guinea pig ileum


J Med Chem 29: 1178-83 (1987)


BindingDB Entry DOI: 10.7270/Q2QR4XPC
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50019636
PNG
(2-(4-Methyl-piperazin-1-yl)-1-(2-vinyloxy-ethyl)-1...)
Show SMILES CN1CCN(CC1)c1nc2ccccc2n1CCOC=C
Show InChI InChI=1S/C16H22N4O/c1-3-21-13-12-20-15-7-5-4-6-14(15)17-16(20)19-10-8-18(2)9-11-19/h3-7H,1,8-13H2,2H3
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TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of histamine-induced contractions in guinea pig ileum


J Med Chem 29: 1178-83 (1987)


BindingDB Entry DOI: 10.7270/Q2QR4XPC
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50019607
PNG
(1-(2-Ethoxy-ethyl)-2-(4-methyl-piperazin-1-yl)-1H-...)
Show SMILES CCOCCn1c(nc2ccccc12)N1CCN(C)CC1
Show InChI InChI=1S/C16H24N4O/c1-3-21-13-12-20-15-7-5-4-6-14(15)17-16(20)19-10-8-18(2)9-11-19/h4-7H,3,8-13H2,1-2H3
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TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of histamine-induced contractions in guinea pig ileum


J Med Chem 29: 1178-83 (1987)


BindingDB Entry DOI: 10.7270/Q2QR4XPC
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50019618
PNG
(1-(2-Allyloxy-ethyl)-2-(4-methyl-[1,4]diazepan-1-y...)
Show SMILES CN1CCCN(CC1)c1nc2ccccc2n1CCOCC=C
Show InChI InChI=1S/C18H26N4O/c1-3-14-23-15-13-22-17-8-5-4-7-16(17)19-18(22)21-10-6-9-20(2)11-12-21/h3-5,7-8H,1,6,9-15H2,2H3
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TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of histamine-induced contractions in guinea pig ileum


J Med Chem 29: 1178-83 (1987)


BindingDB Entry DOI: 10.7270/Q2QR4XPC
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50019614
PNG
(1-(2-Butoxy-ethyl)-2-(4-methyl-[1,4]diazepan-1-yl)...)
Show SMILES CCCCOCCn1c(nc2ccccc12)N1CCCN(C)CC1
Show InChI InChI=1S/C19H30N4O/c1-3-4-15-24-16-14-23-18-9-6-5-8-17(18)20-19(23)22-11-7-10-21(2)12-13-22/h5-6,8-9H,3-4,7,10-16H2,1-2H3
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TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of histamine-induced contractions in guinea pig ileum


J Med Chem 29: 1178-83 (1987)


BindingDB Entry DOI: 10.7270/Q2QR4XPC
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50089149
PNG
(2-Benzyl-9-phenyl-2,3,4,4a-tetrahydro-1H-indeno[2,...)
Show SMILES C(N1CCC2C(C1)=C(c1ccccc21)c1ccccc1)c1ccccc1 |c:7|
Show InChI InChI=1S/C25H23N/c1-3-9-19(10-4-1)17-26-16-15-22-21-13-7-8-14-23(21)25(24(22)18-26)20-11-5-2-6-12-20/h1-14,22H,15-18H2
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n/an/a 11n/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
In vitro antagonistic activity at the Histamine H1 receptor in guinea pig ileum


Bioorg Med Chem Lett 10: 1277-9 (2000)


BindingDB Entry DOI: 10.7270/Q2T152VB
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50019629
PNG
(1-(2-Ethoxy-ethyl)-2-piperazin-1-yl-1H-benzoimidaz...)
Show SMILES CCOCCn1c(nc2ccccc12)N1CCNCC1
Show InChI InChI=1S/C15H22N4O/c1-2-20-12-11-19-14-6-4-3-5-13(14)17-15(19)18-9-7-16-8-10-18/h3-6,16H,2,7-12H2,1H3
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TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of histamine-induced contractions in guinea pig ileum


J Med Chem 29: 1178-83 (1987)


BindingDB Entry DOI: 10.7270/Q2QR4XPC
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50019596
PNG
(2-(4-Methyl-piperazin-1-yl)-1-(2-prop-2-ynyloxy-et...)
Show SMILES CN1CCN(CC1)c1nc2ccccc2n1CCOCC#C
Show InChI InChI=1S/C17H22N4O/c1-3-13-22-14-12-21-16-7-5-4-6-15(16)18-17(21)20-10-8-19(2)9-11-20/h1,4-7H,8-14H2,2H3
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TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of histamine-induced contractions in guinea pig ileum


J Med Chem 29: 1178-83 (1987)


BindingDB Entry DOI: 10.7270/Q2QR4XPC
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM35938
PNG
(1-(p-chlorophenyl)-1-(2-pyridyl)-3-N,N-dimethylpro...)
Show SMILES CN(C)CCC(c1ccc(Cl)cc1)c1ccccn1
Show InChI InChI=1S/C16H19ClN2/c1-19(2)12-10-15(16-5-3-4-11-18-16)13-6-8-14(17)9-7-13/h3-9,11,15H,10,12H2,1-2H3
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n/an/a 12n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of histamine-induced contractions in guinea pig ileum


J Med Chem 29: 1178-83 (1987)


BindingDB Entry DOI: 10.7270/Q2QR4XPC
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50019634
PNG
(1-(2-Methoxy-ethyl)-2-(4-methyl-piperazin-1-yl)-1H...)
Show SMILES COCCn1c(nc2ccccc12)N1CCN(C)CC1
Show InChI InChI=1S/C15H22N4O/c1-17-7-9-18(10-8-17)15-16-13-5-3-4-6-14(13)19(15)11-12-20-2/h3-6H,7-12H2,1-2H3
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n/an/a 13n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of histamine-induced contractions in guinea pig ileum


J Med Chem 29: 1178-83 (1987)


BindingDB Entry DOI: 10.7270/Q2QR4XPC
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50019597
PNG
(2-(4-Butyl-piperazin-1-yl)-1-(2-ethoxy-ethyl)-1H-b...)
Show SMILES CCCCN1CCN(CC1)c1nc2ccccc2n1CCOCC
Show InChI InChI=1S/C19H30N4O/c1-3-5-10-21-11-13-22(14-12-21)19-20-17-8-6-7-9-18(17)23(19)15-16-24-4-2/h6-9H,3-5,10-16H2,1-2H3
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n/an/a 15n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of histamine-induced contractions in guinea pig ileum


J Med Chem 29: 1178-83 (1987)


BindingDB Entry DOI: 10.7270/Q2QR4XPC
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50019625
PNG
(2-(4-Benzyl-[1,4]diazepan-1-yl)-1-(2-ethoxy-ethyl)...)
Show SMILES CCOCCn1c(nc2ccccc12)N1CCCN(Cc2ccccc2)CC1
Show InChI InChI=1S/C23H30N4O/c1-2-28-18-17-27-22-12-7-6-11-21(22)24-23(27)26-14-8-13-25(15-16-26)19-20-9-4-3-5-10-20/h3-7,9-12H,2,8,13-19H2,1H3
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n/an/a 15n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of histamine-induced contractions in guinea pig ileum


J Med Chem 29: 1178-83 (1987)


BindingDB Entry DOI: 10.7270/Q2QR4XPC
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50019631
PNG
(1-(2-Ethoxy-ethyl)-2-(4-propyl-piperazin-1-yl)-1H-...)
Show SMILES CCCN1CCN(CC1)c1nc2ccccc2n1CCOCC
Show InChI InChI=1S/C18H28N4O/c1-3-9-20-10-12-21(13-11-20)18-19-16-7-5-6-8-17(16)22(18)14-15-23-4-2/h5-8H,3-4,9-15H2,1-2H3
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n/an/a 16n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of histamine-induced contractions in guinea pig ileum


J Med Chem 29: 1178-83 (1987)


BindingDB Entry DOI: 10.7270/Q2QR4XPC
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50019630
PNG
(1-(2-Ethoxy-ethyl)-2-(4-ethyl-[1,4]diazepan-1-yl)-...)
Show SMILES CCOCCn1c(nc2ccccc12)N1CCCN(CC)CC1
Show InChI InChI=1S/C18H28N4O/c1-3-20-10-7-11-21(13-12-20)18-19-16-8-5-6-9-17(16)22(18)14-15-23-4-2/h5-6,8-9H,3-4,7,10-15H2,1-2H3
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n/an/a 16n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of histamine-induced contractions in guinea pig ileum


J Med Chem 29: 1178-83 (1987)


BindingDB Entry DOI: 10.7270/Q2QR4XPC
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50019611
PNG
(2-(4-Methyl-[1,4]diazepan-1-yl)-1-(2-propoxy-ethyl...)
Show SMILES CCCOCCn1c(nc2ccccc12)N1CCCN(C)CC1
Show InChI InChI=1S/C18H28N4O/c1-3-14-23-15-13-22-17-8-5-4-7-16(17)19-18(22)21-10-6-9-20(2)11-12-21/h4-5,7-8H,3,6,9-15H2,1-2H3
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n/an/a 16n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of histamine-induced contractions in guinea pig ileum


J Med Chem 29: 1178-83 (1987)


BindingDB Entry DOI: 10.7270/Q2QR4XPC
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50089150
PNG
(2-Ethyl-9-phenyl-2,3,4,9-tetrahydro-1H-indeno[2,1-...)
Show SMILES CCN1CCC2=C(C1)C(c1ccccc21)c1ccccc1 |c:5|
Show InChI InChI=1S/C20H21N/c1-2-21-13-12-17-16-10-6-7-11-18(16)20(19(17)14-21)15-8-4-3-5-9-15/h3-11,20H,2,12-14H2,1H3
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n/an/a 17n/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
In vitro antagonistic activity at the Histamine H1 receptor in guinea pig ileum


Bioorg Med Chem Lett 10: 1277-9 (2000)


BindingDB Entry DOI: 10.7270/Q2T152VB
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50019617
PNG
(1-(2-Allyloxy-ethyl)-2-(4-methyl-piperazin-1-yl)-1...)
Show SMILES CN1CCN(CC1)c1nc2ccccc2n1CCOCC=C
Show InChI InChI=1S/C17H24N4O/c1-3-13-22-14-12-21-16-7-5-4-6-15(16)18-17(21)20-10-8-19(2)9-11-20/h3-7H,1,8-14H2,2H3
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n/an/a 17n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of histamine-induced contractions in guinea pig ileum


J Med Chem 29: 1178-83 (1987)


BindingDB Entry DOI: 10.7270/Q2QR4XPC
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50019616
PNG
(1-Benzyl-2-(4-methyl-piperazin-1-yl)-1H-benzoimida...)
Show SMILES CN1CCN(CC1)c1nc2ccccc2n1Cc1ccccc1
Show InChI InChI=1S/C19H22N4/c1-21-11-13-22(14-12-21)19-20-17-9-5-6-10-18(17)23(19)15-16-7-3-2-4-8-16/h2-10H,11-15H2,1H3
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n/an/a 17n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of histamine-induced contractions in guinea pig ileum


J Med Chem 29: 1178-83 (1987)


BindingDB Entry DOI: 10.7270/Q2QR4XPC
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50019635
PNG
(1-(2-Ethoxy-ethyl)-2-(4-ethyl-piperazin-1-yl)-1H-b...)
Show SMILES CCOCCn1c(nc2ccccc12)N1CCN(CC)CC1
Show InChI InChI=1S/C17H26N4O/c1-3-19-9-11-20(12-10-19)17-18-15-7-5-6-8-16(15)21(17)13-14-22-4-2/h5-8H,3-4,9-14H2,1-2H3
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n/an/a 18n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of histamine-induced contractions in guinea pig ileum


J Med Chem 29: 1178-83 (1987)


BindingDB Entry DOI: 10.7270/Q2QR4XPC
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50019619
PNG
(2-(4-Methyl-piperazin-1-yl)-1-propoxymethyl-1H-ben...)
Show SMILES CCCOCn1c(nc2ccccc12)N1CCN(C)CC1
Show InChI InChI=1S/C16H24N4O/c1-3-12-21-13-20-15-7-5-4-6-14(15)17-16(20)19-10-8-18(2)9-11-19/h4-7H,3,8-13H2,1-2H3
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n/an/a 18n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of histamine-induced contractions in guinea pig ileum


J Med Chem 29: 1178-83 (1987)


BindingDB Entry DOI: 10.7270/Q2QR4XPC
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50019626
PNG
(2-(4-Methyl-piperazin-1-yl)-1-pentyl-1H-benzoimida...)
Show SMILES CCCCCn1c(nc2ccccc12)N1CCN(C)CC1
Show InChI InChI=1S/C17H26N4/c1-3-4-7-10-21-16-9-6-5-8-15(16)18-17(21)20-13-11-19(2)12-14-20/h5-6,8-9H,3-4,7,10-14H2,1-2H3
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n/an/a 19n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of histamine-induced contractions in guinea pig ileum


J Med Chem 29: 1178-83 (1987)


BindingDB Entry DOI: 10.7270/Q2QR4XPC
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50019593
PNG
(1-(2-Ethylsulfanyl-ethyl)-2-(4-methyl-piperazin-1-...)
Show SMILES CCSCCn1c(nc2ccccc12)N1CCN(C)CC1
Show InChI InChI=1S/C16H24N4S/c1-3-21-13-12-20-15-7-5-4-6-14(15)17-16(20)19-10-8-18(2)9-11-19/h4-7H,3,8-13H2,1-2H3
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n/an/a 19n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of histamine-induced contractions in guinea pig ileum


J Med Chem 29: 1178-83 (1987)


BindingDB Entry DOI: 10.7270/Q2QR4XPC
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50019599
PNG
(2-(4-Methyl-piperazin-1-yl)-1-(2-propoxy-ethyl)-1H...)
Show SMILES CCCOCCn1c(nc2ccccc12)N1CCN(C)CC1
Show InChI InChI=1S/C17H26N4O/c1-3-13-22-14-12-21-16-7-5-4-6-15(16)18-17(21)20-10-8-19(2)9-11-20/h4-7H,3,8-14H2,1-2H3
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n/an/a 20n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of histamine-induced contractions in guinea pig ileum


J Med Chem 29: 1178-83 (1987)


BindingDB Entry DOI: 10.7270/Q2QR4XPC
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50089148
PNG
(((3R,4S)-1-Ethyl-4-hydroxy-4-phenyl-piperidin-3-yl...)
Show SMILES CCN1CC[C@](O)([C@@H](C1)C(=O)c1ccccc1)c1ccccc1
Show InChI InChI=1S/C20H23NO2/c1-2-21-14-13-20(23,17-11-7-4-8-12-17)18(15-21)19(22)16-9-5-3-6-10-16/h3-12,18,23H,2,13-15H2,1H3/t18-,20+/m0/s1
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n/an/a 23n/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
In vitro antagonistic activity at the Histamine H1 receptor in guinea pig ileum


Bioorg Med Chem Lett 10: 1277-9 (2000)


BindingDB Entry DOI: 10.7270/Q2T152VB
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50007536
PNG
(CHEMBL24517 | [3-(5-Chloro-pyridin-2-yl)-3-pyridin...)
Show SMILES CN(C)CCC(c1ccccn1)c1ccc(Cl)cn1
Show InChI InChI=1S/C15H18ClN3/c1-19(2)10-8-13(14-5-3-4-9-17-14)15-7-6-12(16)11-18-15/h3-7,9,11,13H,8,10H2,1-2H3
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n/an/a 24n/an/an/an/an/an/a



A. H. Robins Company, Inc.

Curated by ChEMBL


Assay Description
Inhibition of [3H]-mepyramine binding to the Histamine H1 receptor in guinea pig cortex


J Med Chem 34: 1314-28 (1991)


BindingDB Entry DOI: 10.7270/Q23F4NMG
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50019639
PNG
(2-[1,4]Diazepan-1-yl-1-(2-ethoxy-ethyl)-1H-benzoim...)
Show SMILES CCOCCn1c(nc2ccccc12)N1CCCNCC1
Show InChI InChI=1S/C16H24N4O/c1-2-21-13-12-20-15-7-4-3-6-14(15)18-16(20)19-10-5-8-17-9-11-19/h3-4,6-7,17H,2,5,8-13H2,1H3
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n/an/a 25n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of histamine-induced contractions in guinea pig ileum


J Med Chem 29: 1178-83 (1987)


BindingDB Entry DOI: 10.7270/Q2QR4XPC
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50019632
PNG
(1-Hexyl-2-(4-methyl-piperazin-1-yl)-1H-benzoimidaz...)
Show SMILES CCCCCCn1c(nc2ccccc12)N1CCN(C)CC1
Show InChI InChI=1S/C18H28N4/c1-3-4-5-8-11-22-17-10-7-6-9-16(17)19-18(22)21-14-12-20(2)13-15-21/h6-7,9-10H,3-5,8,11-15H2,1-2H3
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n/an/a 26n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of histamine-induced contractions in guinea pig ileum


J Med Chem 29: 1178-83 (1987)


BindingDB Entry DOI: 10.7270/Q2QR4XPC
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50089146
PNG
(((3R,4S)-4-Hydroxy-1-methyl-4-phenyl-piperidin-3-y...)
Show SMILES CN1CC[C@](O)([C@@H](C1)C(=O)c1ccccc1)c1ccccc1
Show InChI InChI=1S/C19H21NO2/c1-20-13-12-19(22,16-10-6-3-7-11-16)17(14-20)18(21)15-8-4-2-5-9-15/h2-11,17,22H,12-14H2,1H3/t17-,19+/m0/s1
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n/an/a 26n/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
In vitro antagonistic activity at the Histamine H1 receptor in guinea pig ileum


Bioorg Med Chem Lett 10: 1277-9 (2000)


BindingDB Entry DOI: 10.7270/Q2T152VB
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50019627
PNG
(2-(4-Benzyl-piperazin-1-yl)-1-(2-ethoxy-ethyl)-1H-...)
Show SMILES CCOCCn1c(nc2ccccc12)N1CCN(Cc2ccccc2)CC1
Show InChI InChI=1S/C22H28N4O/c1-2-27-17-16-26-21-11-7-6-10-20(21)23-22(26)25-14-12-24(13-15-25)18-19-8-4-3-5-9-19/h3-11H,2,12-18H2,1H3
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n/an/a 27n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of histamine-induced contractions in guinea pig ileum


J Med Chem 29: 1178-83 (1987)


BindingDB Entry DOI: 10.7270/Q2QR4XPC
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50089144
PNG
(2-Methyl-9-phenyl-2,3,4,4a-tetrahydro-1H-indeno[2,...)
Show SMILES CN1CCC2C(C1)=C(c1ccccc21)c1ccccc1 |c:7|
Show InChI InChI=1S/C19H19N/c1-20-12-11-16-15-9-5-6-10-17(15)19(18(16)13-20)14-7-3-2-4-8-14/h2-10,16H,11-13H2,1H3
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University of Bath

Curated by ChEMBL


Assay Description
In vitro antagonistic activity at the Histamine H1 receptor in guinea pig ileum


Bioorg Med Chem Lett 10: 1277-9 (2000)


BindingDB Entry DOI: 10.7270/Q2T152VB
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50156861
PNG
(2-(2-(4-(1-((5-chlorothiophen-2-yl)methyl)-6-fluor...)
Show SMILES OC(=O)c1ccccc1OCCN1CCC(CC1)c1cn(Cc2ccc(Cl)s2)c2cc(F)ccc12
Show InChI InChI=1S/C27H26ClFN2O3S/c28-26-8-6-20(35-26)16-31-17-23(21-7-5-19(29)15-24(21)31)18-9-11-30(12-10-18)13-14-34-25-4-2-1-3-22(25)27(32)33/h1-8,15,17-18H,9-14,16H2,(H,32,33)
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n/an/a 28n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Displacement of [3H]mepyramine from histamine H1 receptor in guinea pig cerebellum membranes


J Med Chem 47: 6326-37 (2004)


Article DOI: 10.1021/jm0498203
BindingDB Entry DOI: 10.7270/Q2HM57XC
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50007539
PNG
(8-(2-Dimethylamino-ethyl)-6-methyl-7,8-dihydro-6H-...)
Show SMILES CN(C)CC[C@@H]1CN(C)C(=S)c2cccnc2O1
Show InChI InChI=1S/C13H19N3OS/c1-15(2)8-6-10-9-16(3)13(18)11-5-4-7-14-12(11)17-10/h4-5,7,10H,6,8-9H2,1-3H3/t10-/m1/s1
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n/an/a 30n/an/an/an/an/an/a



A. H. Robins Company, Inc.

Curated by ChEMBL


Assay Description
Inhibition of [3H]-mepyramine binding to the histamine receptor in guinea pig cortex


J Med Chem 34: 1314-28 (1991)


BindingDB Entry DOI: 10.7270/Q23F4NMG
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50019601
PNG
(1-(2-Ethoxy-ethyl)-2-(4-pentyl-piperazin-1-yl)-1H-...)
Show SMILES CCCCCN1CCN(CC1)c1nc2ccccc2n1CCOCC
Show InChI InChI=1S/C20H32N4O/c1-3-5-8-11-22-12-14-23(15-13-22)20-21-18-9-6-7-10-19(18)24(20)16-17-25-4-2/h6-7,9-10H,3-5,8,11-17H2,1-2H3
UniProtKB/SwissProt

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n/an/a 30n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of histamine-induced contractions in guinea pig ileum


J Med Chem 29: 1178-83 (1987)


BindingDB Entry DOI: 10.7270/Q2QR4XPC
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50019592
PNG
(1-(2-Ethoxy-ethyl)-2-(4-phenethyl-piperazin-1-yl)-...)
Show SMILES CCOCCn1c(nc2ccccc12)N1CCN(CCc2ccccc2)CC1
Show InChI InChI=1S/C23H30N4O/c1-2-28-19-18-27-22-11-7-6-10-21(22)24-23(27)26-16-14-25(15-17-26)13-12-20-8-4-3-5-9-20/h3-11H,2,12-19H2,1H3
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n/an/a 31n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of histamine-induced contractions in guinea pig ileum


J Med Chem 29: 1178-83 (1987)


BindingDB Entry DOI: 10.7270/Q2QR4XPC
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50156893
PNG
(2-(2-{4-[1-(2-Ethoxy-ethyl)-1H-indol-3-yl]-piperid...)
Show SMILES CCOCCn1cc(C2CCN(CCOc3cc(OC)ccc3C(O)=O)CC2)c2ccccc12
Show InChI InChI=1S/C27H34N2O5/c1-3-33-16-15-29-19-24(22-6-4-5-7-25(22)29)20-10-12-28(13-11-20)14-17-34-26-18-21(32-2)8-9-23(26)27(30)31/h4-9,18-20H,3,10-17H2,1-2H3,(H,30,31)
UniProtKB/SwissProt

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n/an/a 34n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Displacement of [3H]mepyramine from histamine H1 receptor in guinea pig cerebellum membranes


J Med Chem 47: 6326-37 (2004)


Article DOI: 10.1021/jm0498203
BindingDB Entry DOI: 10.7270/Q2HM57XC
More data for this
Ligand-Target Pair
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