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Compile Data Set for Download or QSAR

Found 320 hits Enz. Inhib. hit(s) with Target = 'Histamine H1 receptor' AND taxid = 10116   
Target
(Institution)
LigandTarget
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 H1 receptor


(RAT)
BDBM35254
PNG
(2-methyl-4-(4-methylpiperazin-1-yl)-10H-thieno[2,3...)
Show SMILES CN1CCN(CC1)C1=Nc2ccccc2Nc2sc(C)cc12
Show InChI InChI=1S/C17H20N4S/c1-12-11-13-16(21-9-7-20(2)8-10-21)18-14-5-3-4-6-15(14)19-17(13)22-12/h3-6,11,19H,7-10H2,1-2H3
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0.300n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Half-maximal inhibition of [3H]7-OH-DPAT binding to Histamine H1 receptor in rat tissue homogenate


J Med Chem 45: 344-59 (2002)

More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM50115644
PNG
((+/-)-12-Methyl-1,2,3,4,9,13b-hexahydro-2,4a,5-tri...)
Show SMILES CN1CCN2C(C1)c1ccccc1Cc1cccnc21
Show InChI InChI=1S/C17H19N3/c1-19-9-10-20-16(12-19)15-7-3-2-5-13(15)11-14-6-4-8-18-17(14)20/h2-8,16H,9-12H2,1H3
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0.320n/an/an/an/an/an/an/an/a



Organon International

Curated by PDSP Ki Database




Neuropharmacology 27: 399-408 (1988)

More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM50115644
PNG
((+/-)-12-Methyl-1,2,3,4,9,13b-hexahydro-2,4a,5-tri...)
Show SMILES CN1CCN2C(C1)c1ccccc1Cc1cccnc21
Show InChI InChI=1S/C17H19N3/c1-19-9-10-20-16(12-19)15-7-3-2-5-13(15)11-14-6-4-8-18-17(14)20/h2-8,16H,9-12H2,1H3
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0.5n/an/an/an/an/an/an/an/a



Organon International

Curated by PDSP Ki Database




Neuropharmacology 27: 399-408 (1988)

More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM50115644
PNG
((+/-)-12-Methyl-1,2,3,4,9,13b-hexahydro-2,4a,5-tri...)
Show SMILES CN1CCN2C(C1)c1ccccc1Cc1cccnc21
Show InChI InChI=1S/C17H19N3/c1-19-9-10-20-16(12-19)15-7-3-2-5-13(15)11-14-6-4-8-18-17(14)20/h2-8,16H,9-12H2,1H3
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0.630n/an/an/an/an/an/an/an/a



Organon International

Curated by PDSP Ki Database




Neuropharmacology 27: 399-408 (1988)

More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM50079527
PNG
((3E)-3-dibenzo[b,e]oxepin-11(6H)-ylidene-N,N-dimet...)
Show SMILES CN(C)CC\C=C1\c2ccccc2COc2ccccc12
Show InChI InChI=1S/C19H21NO/c1-20(2)13-7-11-17-16-9-4-3-8-15(16)14-21-19-12-6-5-10-18(17)19/h3-6,8-12H,7,13-14H2,1-2H3/b17-11-
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0.700n/an/an/an/an/an/an/an/a



TBA

Curated by PDSP Ki Database




Proc Natl Acad Sci U S A 75: 6290-4 (1978)

More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM35256
PNG
((S)-mianserin | Lerivon | MIANSERIN | MIANSERIN (+...)
Show SMILES CN1CCN2[C@H](C1)c1ccccc1Cc1ccccc21
Show InChI InChI=1S/C18H20N2/c1-19-10-11-20-17-9-5-3-7-15(17)12-14-6-2-4-8-16(14)18(20)13-19/h2-9,18H,10-13H2,1H3/t18-/m1/s1
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1n/an/an/an/an/an/an/an/a



Organon International

Curated by PDSP Ki Database




Neuropharmacology 27: 399-408 (1988)

More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM50025124
PNG
(3-{2-[4-(4-Fluoro-benzoyl)-piperidin-1-yl]-ethyl}-...)
Show SMILES Oc1ccc2c(c1)[nH]c(=O)n(CCN1CCC(CC1)C(=O)c1ccc(F)cc1)c2=O
Show InChI InChI=1S/C22H22FN3O4/c23-16-3-1-14(2-4-16)20(28)15-7-9-25(10-8-15)11-12-26-21(29)18-6-5-17(27)13-19(18)24-22(26)30/h1-6,13,15,27H,7-12H2,(H,24,30)
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1.22n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Compound was evaluated for binding activity against [3H]-pyrilamine as radioligand for Histamine H1 receptor


J Med Chem 29: 1663-8 (1986)

More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM50062261
PNG
(CHEMBL829 | Dimethyl-(2-methyl-3-phenothiazin-10-y...)
Show SMILES CC(CN(C)C)CN1c2ccccc2Sc2ccccc12
Show InChI InChI=1S/C18H22N2S/c1-14(12-19(2)3)13-20-15-8-4-6-10-17(15)21-18-11-7-5-9-16(18)20/h4-11,14H,12-13H2,1-3H3
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1.30n/an/an/an/an/an/an/an/a



TBA

Curated by PDSP Ki Database




Proc Natl Acad Sci U S A 75: 6290-4 (1978)

More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM81472
PNG
(CAS_10646 | NSC_10646 | Pyrathiazine)
Show SMILES C(CN1c2ccccc2Sc2ccccc12)N1CCCC1
Show InChI InChI=1S/C18H20N2S/c1-3-9-17-15(7-1)20(14-13-19-11-5-6-12-19)16-8-2-4-10-18(16)21-17/h1-4,7-10H,5-6,11-14H2
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1.5n/an/an/an/an/an/an/an/a



TBA

Curated by PDSP Ki Database




Proc Natl Acad Sci U S A 75: 6290-4 (1978)

More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM35256
PNG
((S)-mianserin | Lerivon | MIANSERIN | MIANSERIN (+...)
Show SMILES CN1CCN2[C@H](C1)c1ccccc1Cc1ccccc21
Show InChI InChI=1S/C18H20N2/c1-19-10-11-20-17-9-5-3-7-15(17)12-14-6-2-4-8-16(14)18(20)13-19/h2-9,18H,10-13H2,1H3/t18-/m1/s1
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1.78n/an/an/an/an/an/an/an/a



Organon International

Curated by PDSP Ki Database




Neuropharmacology 27: 399-408 (1988)

More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
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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2n/an/an/an/an/an/an/an/a



The Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Ability to displace [3H]-Pyrilamine from histamine H1 receptor in male SpragueDawley rat brain membranes


Bioorg Med Chem Lett 13: 1959-61 (2003)

More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM84994
PNG
(CAS_163091 | NSC_163091 | ORG-5222)
Show SMILES CN1CC2C(C1)c1cc(Cl)ccc1Oc1ccccc21
Show InChI InChI=1S/C17H16ClNO/c1-19-9-14-12-4-2-3-5-16(12)20-17-7-6-11(18)8-13(17)15(14)10-19/h2-8,14-15H,9-10H2,1H3
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2n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by PDSP Ki Database




Neuropsychopharmacology 14: 87-96 (1996)

More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM50010859
PNG
(CHEMBL11 | IMIPRAMINE HYDROCHLORIDE | IMIPRAMINE P...)
Show SMILES CN(C)CCCN1c2ccccc2CCc2ccccc12
Show InChI InChI=1S/C19H24N2/c1-20(2)14-7-15-21-18-10-5-3-8-16(18)12-13-17-9-4-6-11-19(17)21/h3-6,8-11H,7,12-15H2,1-2H3
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2n/an/an/an/an/an/an/an/a



Novo Industri A/S

Curated by PDSP Ki Database




Eur J Pharmacol 166: 493-504 (1989)

More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM81464
PNG
(2-[(4-chlorophenyl)-(2-pyridyl)methoxy]ethyl-dimet...)
Show SMILES CN(C)CCOC(c1ccc(Cl)cc1)c1ccccn1
Show InChI InChI=1S/C16H19ClN2O/c1-19(2)11-12-20-16(15-5-3-4-10-18-15)13-6-8-14(17)9-7-13/h3-10,16H,11-12H2,1-2H3
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2.30n/an/an/an/an/an/an/an/a



TBA

Curated by PDSP Ki Database




Proc Natl Acad Sci U S A 75: 6290-4 (1978)

More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM81470
PNG
(CAS_14677 | Methdilazine | NSC_14677)
Show SMILES CN1CCC(CN2c3ccccc3Sc3ccccc23)C1
Show InChI InChI=1S/C18H20N2S/c1-19-11-10-14(12-19)13-20-15-6-2-4-8-17(15)21-18-9-5-3-7-16(18)20/h2-9,14H,10-13H2,1H3
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2.30n/an/an/an/an/an/an/an/a



TBA

Curated by PDSP Ki Database




Proc Natl Acad Sci U S A 75: 6290-4 (1978)

More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM50137980
PNG
(1-Methyl-9-(4-methyl-piperazin-1-yl)-4-thia-10a-az...)
Show SMILES CN1CCN(CC1)C1=Cn2c(C)ccc2Sc2ccccc12
Show InChI InChI=1S/C18H21N3S/c1-14-7-8-18-21(14)13-16(20-11-9-19(2)10-12-20)15-5-3-4-6-17(15)22-18/h3-8,13H,9-12H2,1-2H3
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2.70n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
In vitro binding affinity towards Histamine H1 receptor of rat frontal cortex homogenate by using radioligand [3H]pyrilamine


J Med Chem 47: 143-57 (2003)

More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM50137976
PNG
(9-(4-Methyl-piperazin-1-yl)-4-thia-10a-aza-benzo[f...)
Show SMILES CN1CCN(CC1)C1=Cn2cccc2Sc2ccccc12
Show InChI InChI=1S/C17H19N3S/c1-18-9-11-19(12-10-18)15-13-20-8-4-7-17(20)21-16-6-3-2-5-14(15)16/h2-8,13H,9-12H2,1H3
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2.70n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
In vitro binding affinity towards Histamine H1 receptor of rat frontal cortex homogenate by using radioligand [3H]pyrilamine


J Med Chem 47: 143-57 (2003)

More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM50017696
PNG
((2-dimethylamino-2-methyl)ethyl-N-dibenzoparathiaz...)
Show SMILES CC(CN1c2ccccc2Sc2ccccc12)N(C)C
Show InChI InChI=1S/C17H20N2S/c1-13(18(2)3)12-19-14-8-4-6-10-16(14)20-17-11-7-5-9-15(17)19/h4-11,13H,12H2,1-3H3
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2.90n/an/an/an/an/an/an/an/a



TBA

Curated by PDSP Ki Database




Proc Natl Acad Sci U S A 75: 6290-4 (1978)

More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM50001884
PNG
(2-[4-(4-Methyl-benzyl)-piperazin-1-yl]-1-(2-methyl...)
Show SMILES CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2ccccc12
Show InChI InChI=1S/C18H19ClN4/c1-22-8-10-23(11-9-22)18-14-4-2-3-5-15(14)20-16-7-6-13(19)12-17(16)21-18/h2-7,12,20H,8-11H2,1H3
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2.90n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
In vitro binding affinity towards Histamine H1 receptor of rat frontal cortex homogenate by using radioligand [3H]pyrilamine


J Med Chem 47: 143-57 (2003)

More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM50111631
PNG
(6-[2-(4-Benzyl-piperidin-1-yl)-ethyl]-3-methyl-3H-...)
Show SMILES Cn1c2ccc(CCN3CCC(Cc4ccccc4)CC3)cc2sc1=O
Show InChI InChI=1S/C22H26N2OS/c1-23-20-8-7-18(16-21(20)26-22(23)25)9-12-24-13-10-19(11-14-24)15-17-5-3-2-4-6-17/h2-8,16,19H,9-15H2,1H3
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3n/an/an/an/an/an/an/an/a



Université de Lille 2

Curated by ChEMBL


Assay Description
Displacement of [3H]- pyrilamine from rat brain membrane Histamine H1 receptor


Bioorg Med Chem Lett 12: 1149-52 (2002)

More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM50017721
PNG
(1-Methyl-4-(5H-dibenzo(a,d)cycloheptenylidene)pipe...)
Show SMILES CN1CCC(CC1)=C1c2ccccc2C=Cc2ccccc12
Show InChI InChI=1S/C21H21N/c1-22-14-12-18(13-15-22)21-19-8-4-2-6-16(19)10-11-17-7-3-5-9-20(17)21/h2-11H,12-15H2,1H3
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3.10n/an/an/an/an/an/an/an/a



TBA

Curated by PDSP Ki Database




Proc Natl Acad Sci U S A 75: 6290-4 (1978)

More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM50241333
PNG
(4-(benzhydryloxy)-1-methylpiperidine | CHEMBL1492 ...)
Show SMILES CN1CCC(CC1)OC(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C19H23NO/c1-20-14-12-18(13-15-20)21-19(16-8-4-2-5-9-16)17-10-6-3-7-11-17/h2-11,18-19H,12-15H2,1H3
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3.20n/an/an/an/an/an/an/an/a



TBA

Curated by PDSP Ki Database




Proc Natl Acad Sci U S A 75: 6290-4 (1978)

More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM22868
PNG
(11-(1-methylpiperidin-4-ylidene)-6,11-dihydro-5H-b...)
Show SMILES CN1CCC(CC1)=C1c2ccccc2CCc2cccnc12
Show InChI InChI=1S/C20H22N2/c1-22-13-10-16(11-14-22)19-18-7-3-2-5-15(18)8-9-17-6-4-12-21-20(17)19/h2-7,12H,8-11,13-14H2,1H3
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3.90n/an/an/an/an/an/an/an/a



Schering-Plough Corporation

Curated by ChEMBL


Assay Description
Binding affinity to histamine H1 receptor in rat brain membranes was evaluated using [3H]-pyrilamine as radioligand


J Med Chem 34: 457-61 (1991)

More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM50017696
PNG
((2-dimethylamino-2-methyl)ethyl-N-dibenzoparathiaz...)
Show SMILES CC(CN1c2ccccc2Sc2ccccc12)N(C)C
Show InChI InChI=1S/C17H20N2S/c1-13(18(2)3)12-19-14-8-4-6-10-16(14)20-17-11-7-5-9-15(17)19/h4-11,13H,12H2,1-3H3
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4n/an/an/an/an/an/an/an/a



Boehringer Ingelheim Italia

Curated by PDSP Ki Database




Naunyn Schmiedebergs Arch Pharmacol 352: 276-82 (1995)

More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM82548
PNG
(CAS_897-15-4 | Dothiepin | NSC_3155)
Show SMILES CN(C)CCC=C1c2ccccc2CSc2ccccc12
Show InChI InChI=1S/C19H21NS/c1-20(2)13-7-11-17-16-9-4-3-8-15(16)14-21-19-12-6-5-10-18(17)19/h3-6,8-12H,7,13-14H2,1-2H3
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4n/an/an/an/an/an/an/an/a



TBA

Curated by PDSP Ki Database




Cell Mol Neurobiol 19: 467-89 (1999)

More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM35256
PNG
((S)-mianserin | Lerivon | MIANSERIN | MIANSERIN (+...)
Show SMILES CN1CCN2[C@H](C1)c1ccccc1Cc1ccccc21
Show InChI InChI=1S/C18H20N2/c1-19-10-11-20-17-9-5-3-7-15(17)12-14-6-2-4-8-16(14)18(20)13-19/h2-9,18H,10-13H2,1H3/t18-/m1/s1
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4.07n/an/an/an/an/an/an/an/a



Organon International

Curated by PDSP Ki Database




Neuropharmacology 27: 399-408 (1988)

More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM50020712
PNG
(10,11-dihydro-5-(gamma-dimethylaminopropylidene)-5...)
Show SMILES CN(C)CCC=C1c2ccccc2CCc2ccccc12
Show InChI InChI=1S/C20H23N/c1-21(2)15-7-12-20-18-10-5-3-8-16(18)13-14-17-9-4-6-11-19(17)20/h3-6,8-12H,7,13-15H2,1-2H3
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4.10n/an/an/an/an/an/an/an/a



TBA

Curated by PDSP Ki Database




Proc Natl Acad Sci U S A 75: 6290-4 (1978)

More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM35254
PNG
(2-methyl-4-(4-methylpiperazin-1-yl)-10H-thieno[2,3...)
Show SMILES CN1CCN(CC1)C1=Nc2ccccc2Nc2sc(C)cc12
Show InChI InChI=1S/C17H20N4S/c1-12-11-13-16(21-9-7-20(2)8-10-21)18-14-5-3-4-6-15(14)19-17(13)22-12/h3-6,11,19H,7-10H2,1-2H3
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4.30n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
In vitro binding affinity towards Histamine H1 receptor of rat frontal cortex homogenate by using radioligand [3H]pyrilamine


J Med Chem 47: 143-57 (2003)

More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM50108592
PNG
((+/-)9-(4-Ethyl-piperazin-1-yl)-7-fluoro-9,10-dihy...)
Show SMILES CCN1CCN(CC1)C1Cn2cccc2Sc2ccc(F)cc12
Show InChI InChI=1S/C18H22FN3S/c1-2-20-8-10-21(11-9-20)16-13-22-7-3-4-18(22)23-17-6-5-14(19)12-15(16)17/h3-7,12,16H,2,8-11,13H2,1H3
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4.30n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Half-maximal inhibition of [3H]pyrilamine binding to Histamine H1 receptor in rat frontal cortex homogenate


J Med Chem 45: 344-59 (2002)

More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
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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4.5n/an/an/an/an/an/an/an/a



TBA

Curated by PDSP Ki Database




Proc Natl Acad Sci U S A 75: 6290-4 (1978)

More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM81469
PNG
(CAS_91-80-5 | Methapyrilene | NSC_4098)
Show SMILES CN(C)CCN(Cc1cccs1)c1ccccn1
Show InChI InChI=1S/C14H19N3S/c1-16(2)9-10-17(12-13-6-5-11-18-13)14-7-3-4-8-15-14/h3-8,11H,9-10,12H2,1-2H3
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4.5n/an/an/an/an/an/an/an/a



TBA

Curated by PDSP Ki Database




Proc Natl Acad Sci U S A 75: 6290-4 (1978)

More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM50409601
PNG
(CHEMBL2111783)
Show SMILES CN1CCN(CC1)[C@H]1Cn2cccc2Sc2ccc(F)cc12
Show InChI InChI=1S/C17H20FN3S/c1-19-7-9-20(10-8-19)15-12-21-6-2-3-17(21)22-16-5-4-13(18)11-14(15)16/h2-6,11,15H,7-10,12H2,1H3/t15-/m0/s1
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4.60n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Half-maximal inhibition of [3H]pyrilamine binding to Histamine H1 receptor in rat frontal cortex homogenate


J Med Chem 45: 344-59 (2002)

More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM50330747
PNG
((-)-1-((1S)-5',11'-Dihydrospiro[cyclopentane-1,10'...)
Show SMILES OC(=O)C1CCN(CC1)C1CC[C@@]2(C1)Cc1ccccc1Cc1ccccc21
Show InChI InChI=1S/C25H29NO2/c27-24(28)18-10-13-26(14-11-18)22-9-12-25(17-22)16-21-7-2-1-5-19(21)15-20-6-3-4-8-23(20)25/h1-8,18,22H,9-17H2,(H,27,28)/t22?,25-/m0/s1
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4.68n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [3H]pyrilamine from histamine H1 receptor in Sprague-Dawley rat cortical membrane by liquid scintillation counting


J Med Chem 53: 7778-95 (2010)

More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM50017666
PNG
(1-(p-bromophenyl)-1-(2-pyridyl)-3-dimethylaminopro...)
Show SMILES CN(C)CCC(c1ccc(Br)cc1)c1ccccn1
Show InChI InChI=1S/C16H19BrN2/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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4.70n/an/an/an/an/an/an/an/a



TBA

Curated by PDSP Ki Database




Proc Natl Acad Sci U S A 75: 6290-4 (1978)

More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM50001884
PNG
(2-[4-(4-Methyl-benzyl)-piperazin-1-yl]-1-(2-methyl...)
Show SMILES CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2ccccc12
Show InChI InChI=1S/C18H19ClN4/c1-22-8-10-23(11-9-22)18-14-4-2-3-5-15(14)20-16-7-6-13(19)12-17(16)21-18/h2-7,12,20H,8-11H2,1H3
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5n/an/an/an/an/an/an/an/a



Yamanouchi Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Compound was tested for the binding affinity against rat cortical H1 receptor by radioligand [3H]-pyrilamine binding assay.


J Med Chem 39: 2764-72 (1996)

More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM50330752
PNG
(3-((1S)-5',11'-Dihydrospiro[cyclopentane-1,10'-dib...)
Show SMILES OC(=O)[C@]12C[C@H]1CN(C2)C1CC[C@@]2(C1)Cc1ccccc1Cc1ccccc21
Show InChI InChI=1S/C25H27NO2/c27-23(28)25-13-20(25)15-26(16-25)21-9-10-24(14-21)12-19-7-2-1-5-17(19)11-18-6-3-4-8-22(18)24/h1-8,20-21H,9-16H2,(H,27,28)/t20-,21?,24-,25-/m0/s1
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5.37n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [3H]pyrilamine from histamine H1 receptor in Sprague-Dawley rat cortical membrane by liquid scintillation counting


J Med Chem 53: 7778-95 (2010)

More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
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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5.5n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Binding affinity against Histamine H1 receptor using receptor binding assay in rat brain membranes


Bioorg Med Chem Lett 8: 3469-74 (1999)

More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
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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5.5n/an/an/an/an/an/an/an/a



Schering-Plough Corporation

Curated by ChEMBL


Assay Description
Binding affinity to histamine H1 receptor in rat brain membranes was evaluated using [3H]-pyrilamine as radioligand


J Med Chem 34: 457-61 (1991)

More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM50292411
PNG
((E)-2-(3-(pyrrolidin-1-yl)-1-p-tolylprop-1-enyl)py...)
Show SMILES Cc1ccc(cc1)C(=C/CN1CCCC1)\c1ccccn1
Show InChI InChI=1S/C19H22N2/c1-16-7-9-17(10-8-16)18(19-6-2-3-12-20-19)11-15-21-13-4-5-14-21/h2-3,6-12H,4-5,13-15H2,1H3/b18-11+
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5.60n/an/an/an/an/an/an/an/a



TBA

Curated by PDSP Ki Database




Proc Natl Acad Sci U S A 75: 6290-4 (1978)

More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM82479
PNG
(CAS_132539-06-1 | NSC_4585 | OLANZAPINE)
Show SMILES CN1CCN(CC1)C1=c2cc(C)sc2=Nc2ccccc2N1
Show InChI InChI=1S/C17H20N4S/c1-12-11-13-16(21-9-7-20(2)8-10-21)18-14-5-3-4-6-15(14)19-17(13)22-12/h3-6,11,18H,7-10H2,1-2H3
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5.60n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by PDSP Ki Database




Neuropsychopharmacology 18: 63-101 (1998)

More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM50330751
PNG
(1-((1S)-5',11'-Dihydrospiro[cyclopentane-1,10'-dib...)
Show SMILES OC(=O)C1CN(C1)C1CC[C@@]2(C1)Cc1ccccc1Cc1ccccc21
Show InChI InChI=1S/C23H25NO2/c25-22(26)19-14-24(15-19)20-9-10-23(13-20)12-18-7-2-1-5-16(18)11-17-6-3-4-8-21(17)23/h1-8,19-20H,9-15H2,(H,25,26)/t20?,23-/m0/s1
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5.62n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [3H]pyrilamine from histamine H1 receptor in Sprague-Dawley rat cortical membrane by liquid scintillation counting


J Med Chem 53: 7778-95 (2010)

More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM22869
PNG
(6-chloro-10-(4-methylpiperazin-1-yl)-2,9-diazatric...)
Show SMILES CN1CCN(CC1)C1=c2ccccc2=Nc2ccc(Cl)cc2N1
Show InChI InChI=1S/C18H19ClN4/c1-22-8-10-23(11-9-22)18-14-4-2-3-5-15(14)20-16-7-6-13(19)12-17(16)21-18/h2-7,12,21H,8-11H2,1H3
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6n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by PDSP Ki Database




Neuropsychopharmacology 14: 87-96 (1996)

More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM50128888
PNG
(CHEMBL58973 | [3-(4-Chloro-phenyl)-3-pyridin-2-yl-...)
Show SMILES CN(CCCCCc1cnc[nH]1)CCC(c1ccc(Cl)cc1)c1ccccn1
Show InChI InChI=1S/C23H29ClN4/c1-28(15-6-2-3-7-21-17-25-18-27-21)16-13-22(23-8-4-5-14-26-23)19-9-11-20(24)12-10-19/h4-5,8-12,14,17-18,22H,2-3,6-7,13,15-16H2,1H3,(H,25,27)
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6n/an/an/an/an/an/an/an/a



The Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Ability to displace [3H]-Pyrilamine from histamine H1 receptor in male SpragueDawley rat brain membranes


Bioorg Med Chem Lett 13: 1959-61 (2003)

More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM50063449
PNG
(8-Chloro-11-piperazin-1-yl-6,11-dihydro-5H-benzo[5...)
Show SMILES Clc1ccc2C(N3CCNCC3)c3ncccc3CCc2c1
Show InChI InChI=1S/C18H20ClN3/c19-15-5-6-16-14(12-15)4-3-13-2-1-7-21-17(13)18(16)22-10-8-20-9-11-22/h1-2,5-7,12,18,20H,3-4,8-11H2
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6.40n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Binding affinity against Histamine H1 receptor using receptor binding assay in rat brain membranes


Bioorg Med Chem Lett 8: 3469-74 (1999)

More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM50073184
PNG
(8-Chloro-11-(4-methyl-piperazin-1-yl)-6,11-dihydro...)
Show SMILES CN1CCN(CC1)C1c2ccc(Cl)cc2CCc2cccnc12
Show InChI InChI=1S/C19H22ClN3/c1-22-9-11-23(12-10-22)19-17-7-6-16(20)13-15(17)5-4-14-3-2-8-21-18(14)19/h2-3,6-8,13,19H,4-5,9-12H2,1H3
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6.5n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Binding affinity against Histamine H1 receptor using receptor binding assay in rat brain membranes


Bioorg Med Chem Lett 8: 3469-74 (1999)

More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM82479
PNG
(CAS_132539-06-1 | NSC_4585 | OLANZAPINE)
Show SMILES CN1CCN(CC1)C1=c2cc(C)sc2=Nc2ccccc2N1
Show InChI InChI=1S/C17H20N4S/c1-12-11-13-16(21-9-7-20(2)8-10-21)18-14-5-3-4-6-15(14)19-17(13)22-12/h3-6,11,18H,7-10H2,1-2H3
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7n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by PDSP Ki Database




Schizophr Res 37: 107-22 (1999)

More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM82479
PNG
(CAS_132539-06-1 | NSC_4585 | OLANZAPINE)
Show SMILES CN1CCN(CC1)C1=c2cc(C)sc2=Nc2ccccc2N1
Show InChI InChI=1S/C17H20N4S/c1-12-11-13-16(21-9-7-20(2)8-10-21)18-14-5-3-4-6-15(14)19-17(13)22-12/h3-6,11,18H,7-10H2,1-2H3
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7n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by PDSP Ki Database




Neuropsychopharmacology 14: 87-96 (1996)

More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM50128875
PNG
(CHEMBL292195 | [3-(4-Chloro-phenyl)-3-pyridin-2-yl...)
Show SMILES CN(CCCCc1cnc[nH]1)CCC(c1ccc(Cl)cc1)c1ccccn1
Show InChI InChI=1S/C22H27ClN4/c1-27(14-5-3-6-20-16-24-17-26-20)15-12-21(22-7-2-4-13-25-22)18-8-10-19(23)11-9-18/h2,4,7-11,13,16-17,21H,3,5-6,12,14-15H2,1H3,(H,24,26)
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7n/an/an/an/an/an/an/an/a



The Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Ability to displace [3H]-Pyrilamine from histamine H1 receptor in male SpragueDawley rat brain membranes


Bioorg Med Chem Lett 13: 1959-61 (2003)

More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM50111627
PNG
(6-[2-(4-Benzyl-piperazin-1-yl)-ethyl]-3-methyl-3H-...)
Show SMILES Cn1c2ccc(CCN3CCN(Cc4ccccc4)CC3)cc2sc1=O
Show InChI InChI=1S/C21H25N3OS/c1-22-19-8-7-17(15-20(19)26-21(22)25)9-10-23-11-13-24(14-12-23)16-18-5-3-2-4-6-18/h2-8,15H,9-14,16H2,1H3
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7n/an/an/an/an/an/an/an/a



Université de Lille 2

Curated by ChEMBL


Assay Description
Displacement of [3H]- pyrilamine from rat brain membrane Histamine H1 receptor


Bioorg Med Chem Lett 12: 1149-52 (2002)

More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM50108591
PNG
((+/-)2-[4-(7-Fluoro-9,10-dihydro-4-thia-10a-aza-be...)
Show SMILES OCCN1CCN(CC1)C1Cn2cccc2Sc2ccc(F)cc12
Show InChI InChI=1S/C18H22FN3OS/c19-14-3-4-17-15(12-14)16(13-22-5-1-2-18(22)24-17)21-8-6-20(7-9-21)10-11-23/h1-5,12,16,23H,6-11,13H2
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7.10n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Half-maximal inhibition of [3H]pyrilamine binding to Histamine H1 receptor in rat frontal cortex homogenate


J Med Chem 45: 344-59 (2002)

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Ligand-Target Pair
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