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Compile Data Set for Download or QSAR

Found 182 hits with Last Name = 'tran' and Initial = 'vt'   
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 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)


Article DOI: 10.1073/pnas.75.12.6290
BindingDB Entry DOI: 10.7270/Q2FN14P6
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)


Article DOI: 10.1073/pnas.75.12.6290
BindingDB Entry DOI: 10.7270/Q2FN14P6
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)


Article DOI: 10.1073/pnas.75.12.6290
BindingDB Entry DOI: 10.7270/Q2FN14P6
More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM81470
PNG
(CAS_14677 | Methdilazine | NSC_14677 | US9504692, ...)
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)


Article DOI: 10.1073/pnas.75.12.6290
BindingDB Entry DOI: 10.7270/Q2FN14P6
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)


Article DOI: 10.1073/pnas.75.12.6290
BindingDB Entry DOI: 10.7270/Q2FN14P6
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)


Article DOI: 10.1073/pnas.75.12.6290
BindingDB Entry DOI: 10.7270/Q2FN14P6
More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM50017721
PNG
(1-Methyl-4-(5H-dibenzo(a,d)cycloheptenylidene)pipe...)
Show SMILES [#6]-[#7]-1-[#6]-[#6]\[#6](-[#6]-[#6]-1)=[#6]-1/c2ccccc2-[#6]=[#6]-c2ccccc-12 |c:16|
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)


Article DOI: 10.1073/pnas.75.12.6290
BindingDB Entry DOI: 10.7270/Q2FN14P6
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)


Article DOI: 10.1073/pnas.75.12.6290
BindingDB Entry DOI: 10.7270/Q2FN14P6
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Rattus norvegicus (rat))
BDBM104992
PNG
(US8575364, 1)
Show SMILES COc1ccc(cc1OC1CNC1)-c1ccccc1C(F)(F)F
Show InChI InChI=1S/C17H16F3NO2/c1-22-15-7-6-11(8-16(15)23-12-9-21-10-12)13-4-2-3-5-14(13)17(18,19)20/h2-8,12,21H,9-10H2,1H3
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3.79n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was performed using membrane fractions prepared from the HEK-293 cell line recombinantly expressing rat 5-HT7 receptors (NCBI access...


US Patent US8957059 (2015)


BindingDB Entry DOI: 10.7270/Q22Z1472
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Rattus norvegicus (rat))
BDBM104992
PNG
(US8575364, 1)
Show SMILES COc1ccc(cc1OC1CNC1)-c1ccccc1C(F)(F)F
Show InChI InChI=1S/C17H16F3NO2/c1-22-15-7-6-11(8-16(15)23-12-9-21-10-12)13-4-2-3-5-14(13)17(18,19)20/h2-8,12,21H,9-10H2,1H3
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3.79n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Compound affinity for the rat 5-HT7 receptor subtype was evaluated by competitive radioligand binding assay using 5-carboxamido[H3]typtamine ([3H]5-C...


US Patent US8575364 (2013)


BindingDB Entry DOI: 10.7270/Q2J9651G
More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM50020712
PNG
(10,11-dihydro-5-(gamma-dimethylaminopropylidene)-5...)
Show SMILES [#6]-[#7](-[#6])-[#6]-[#6]\[#6]=[#6]-1/c2ccccc2-[#6]-[#6]-c2ccccc-12
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)


Article DOI: 10.1073/pnas.75.12.6290
BindingDB Entry DOI: 10.7270/Q2FN14P6
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Rattus norvegicus (rat))
BDBM105008
PNG
(US8575364, 17)
Show SMILES COc1ccc(cc1OC1CNC1)-c1ccccc1Cl
Show InChI InChI=1S/C16H16ClNO2/c1-19-15-7-6-11(13-4-2-3-5-14(13)17)8-16(15)20-12-9-18-10-12/h2-8,12,18H,9-10H2,1H3
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4.42n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Compound affinity for the rat 5-HT7 receptor subtype was evaluated by competitive radioligand binding assay using 5-carboxamido[H3]typtamine ([3H]5-C...


US Patent US8575364 (2013)


BindingDB Entry DOI: 10.7270/Q2J9651G
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Rattus norvegicus (rat))
BDBM105008
PNG
(US8575364, 17)
Show SMILES COc1ccc(cc1OC1CNC1)-c1ccccc1Cl
Show InChI InChI=1S/C16H16ClNO2/c1-19-15-7-6-11(13-4-2-3-5-14(13)17)8-16(15)20-12-9-18-10-12/h2-8,12,18H,9-10H2,1H3
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4.42n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was performed using membrane fractions prepared from the HEK-293 cell line recombinantly expressing rat 5-HT7 receptors (NCBI access...


US Patent US8957059 (2015)


BindingDB Entry DOI: 10.7270/Q22Z1472
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)


Article DOI: 10.1073/pnas.75.12.6290
BindingDB Entry DOI: 10.7270/Q2FN14P6
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)


Article DOI: 10.1073/pnas.75.12.6290
BindingDB Entry DOI: 10.7270/Q2FN14P6
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)


Article DOI: 10.1073/pnas.75.12.6290
BindingDB Entry DOI: 10.7270/Q2FN14P6
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Rattus norvegicus (rat))
BDBM105034
PNG
(US8575364, 43)
Show SMILES COc1ccc(cc1C1CCNC1)-c1ccccc1C
Show InChI InChI=1S/C18H21NO/c1-13-5-3-4-6-16(13)14-7-8-18(20-2)17(11-14)15-9-10-19-12-15/h3-8,11,15,19H,9-10,12H2,1-2H3
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5.46n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Compound affinity for the rat 5-HT7 receptor subtype was evaluated by competitive radioligand binding assay using 5-carboxamido[H3]typtamine ([3H]5-C...


US Patent US8575364 (2013)


BindingDB Entry DOI: 10.7270/Q2J9651G
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Rattus norvegicus (rat))
BDBM105034
PNG
(US8575364, 43)
Show SMILES COc1ccc(cc1C1CCNC1)-c1ccccc1C
Show InChI InChI=1S/C18H21NO/c1-13-5-3-4-6-16(13)14-7-8-18(20-2)17(11-14)15-9-10-19-12-15/h3-8,11,15,19H,9-10,12H2,1-2H3
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5.46n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was performed using membrane fractions prepared from the HEK-293 cell line recombinantly expressing rat 5-HT7 receptors (NCBI access...


US Patent US8957059 (2015)


BindingDB Entry DOI: 10.7270/Q22Z1472
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)


Article DOI: 10.1073/pnas.75.12.6290
BindingDB Entry DOI: 10.7270/Q2FN14P6
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Rattus norvegicus (rat))
BDBM105038
PNG
(US8575364, 47)
Show SMILES COc1ccc(cc1C1CCNC1)-c1ccccc1C(F)(F)F
Show InChI InChI=1S/C18H18F3NO/c1-23-17-7-6-12(10-15(17)13-8-9-22-11-13)14-4-2-3-5-16(14)18(19,20)21/h2-7,10,13,22H,8-9,11H2,1H3
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7.98n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was performed using membrane fractions prepared from the HEK-293 cell line recombinantly expressing rat 5-HT7 receptors (NCBI access...


US Patent US8957059 (2015)


BindingDB Entry DOI: 10.7270/Q22Z1472
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Rattus norvegicus (rat))
BDBM105038
PNG
(US8575364, 47)
Show SMILES COc1ccc(cc1C1CCNC1)-c1ccccc1C(F)(F)F
Show InChI InChI=1S/C18H18F3NO/c1-23-17-7-6-12(10-15(17)13-8-9-22-11-13)14-4-2-3-5-16(14)18(19,20)21/h2-7,10,13,22H,8-9,11H2,1H3
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7.98n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Compound affinity for the rat 5-HT7 receptor subtype was evaluated by competitive radioligand binding assay using 5-carboxamido[H3]typtamine ([3H]5-C...


US Patent US8575364 (2013)


BindingDB Entry DOI: 10.7270/Q2J9651G
More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM81452
PNG
(CAS_91533 | Dimethindene | NSC_91533)
Show SMILES CC(C1=C(CCN(C)C)Cc2ccccc12)c1ccccn1 |c:2|
Show InChI InChI=1S/C20H24N2/c1-15(19-10-6-7-12-21-19)20-17(11-13-22(2)3)14-16-8-4-5-9-18(16)20/h4-10,12,15H,11,13-14H2,1-3H3
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8n/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)


Article DOI: 10.1073/pnas.75.12.6290
BindingDB Entry DOI: 10.7270/Q2FN14P6
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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8n/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)


Article DOI: 10.1073/pnas.75.12.6290
BindingDB Entry DOI: 10.7270/Q2FN14P6
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Rattus norvegicus (rat))
BDBM104997
PNG
(US8575364, 6)
Show SMILES COc1ccc(cc1OC1CNC1)-c1c(C)cccc1C
Show InChI InChI=1S/C18H21NO2/c1-12-5-4-6-13(2)18(12)14-7-8-16(20-3)17(9-14)21-15-10-19-11-15/h4-9,15,19H,10-11H2,1-3H3
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8.20n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was performed using membrane fractions prepared from the HEK-293 cell line recombinantly expressing rat 5-HT7 receptors (NCBI access...


US Patent US8957059 (2015)


BindingDB Entry DOI: 10.7270/Q22Z1472
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Rattus norvegicus (rat))
BDBM104997
PNG
(US8575364, 6)
Show SMILES COc1ccc(cc1OC1CNC1)-c1c(C)cccc1C
Show InChI InChI=1S/C18H21NO2/c1-12-5-4-6-13(2)18(12)14-7-8-16(20-3)17(9-14)21-15-10-19-11-15/h4-9,15,19H,10-11H2,1-3H3
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8.20n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Compound affinity for the rat 5-HT7 receptor subtype was evaluated by competitive radioligand binding assay using 5-carboxamido[H3]typtamine ([3H]5-C...


US Patent US8575364 (2013)


BindingDB Entry DOI: 10.7270/Q2J9651G
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Rattus norvegicus (rat))
BDBM105015
PNG
(US8575364, 24)
Show SMILES Clc1ccc(cc1OC1CNC1)-c1ccccc1Cl
Show InChI InChI=1S/C15H13Cl2NO/c16-13-4-2-1-3-12(13)10-5-6-14(17)15(7-10)19-11-8-18-9-11/h1-7,11,18H,8-9H2
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8.89n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Compound affinity for the rat 5-HT7 receptor subtype was evaluated by competitive radioligand binding assay using 5-carboxamido[H3]typtamine ([3H]5-C...


US Patent US8575364 (2013)


BindingDB Entry DOI: 10.7270/Q2J9651G
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Rattus norvegicus (rat))
BDBM105015
PNG
(US8575364, 24)
Show SMILES Clc1ccc(cc1OC1CNC1)-c1ccccc1Cl
Show InChI InChI=1S/C15H13Cl2NO/c16-13-4-2-1-3-12(13)10-5-6-14(17)15(7-10)19-11-8-18-9-11/h1-7,11,18H,8-9H2
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8.89n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was performed using membrane fractions prepared from the HEK-293 cell line recombinantly expressing rat 5-HT7 receptors (NCBI access...


US Patent US8957059 (2015)


BindingDB Entry DOI: 10.7270/Q22Z1472
More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM50329371
PNG
(1-((4-chlorophenyl)(phenyl)methyl)-4-methylpiperaz...)
Show SMILES CN1CCN(CC1)C(c1ccccc1)c1ccc(Cl)cc1
Show InChI InChI=1S/C18H21ClN2/c1-20-11-13-21(14-12-20)18(15-5-3-2-4-6-15)16-7-9-17(19)10-8-16/h2-10,18H,11-14H2,1H3
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9n/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)


Article DOI: 10.1073/pnas.75.12.6290
BindingDB Entry DOI: 10.7270/Q2FN14P6
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Rattus norvegicus (rat))
BDBM104998
PNG
(US8575364, 7)
Show SMILES COc1ccc(cc1OC1CNC1)-c1ccccc1OC(F)(F)F
Show InChI InChI=1S/C17H16F3NO3/c1-22-15-7-6-11(8-16(15)23-12-9-21-10-12)13-4-2-3-5-14(13)24-17(18,19)20/h2-8,12,21H,9-10H2,1H3
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10n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Compound affinity for the rat 5-HT7 receptor subtype was evaluated by competitive radioligand binding assay using 5-carboxamido[H3]typtamine ([3H]5-C...


US Patent US8575364 (2013)


BindingDB Entry DOI: 10.7270/Q2J9651G
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Rattus norvegicus (rat))
BDBM104998
PNG
(US8575364, 7)
Show SMILES COc1ccc(cc1OC1CNC1)-c1ccccc1OC(F)(F)F
Show InChI InChI=1S/C17H16F3NO3/c1-22-15-7-6-11(8-16(15)23-12-9-21-10-12)13-4-2-3-5-14(13)24-17(18,19)20/h2-8,12,21H,9-10H2,1H3
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10n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was performed using membrane fractions prepared from the HEK-293 cell line recombinantly expressing rat 5-HT7 receptors (NCBI access...


US Patent US8957059 (2015)


BindingDB Entry DOI: 10.7270/Q22Z1472
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Rattus norvegicus (rat))
BDBM105016
PNG
(US8575364, 25)
Show SMILES FC(F)(F)c1ccccc1-c1ccc(Cl)c(OC2CNC2)c1
Show InChI InChI=1S/C16H13ClF3NO/c17-14-6-5-10(7-15(14)22-11-8-21-9-11)12-3-1-2-4-13(12)16(18,19)20/h1-7,11,21H,8-9H2
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10.5n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Compound affinity for the rat 5-HT7 receptor subtype was evaluated by competitive radioligand binding assay using 5-carboxamido[H3]typtamine ([3H]5-C...


US Patent US8575364 (2013)


BindingDB Entry DOI: 10.7270/Q2J9651G
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Rattus norvegicus (rat))
BDBM105016
PNG
(US8575364, 25)
Show SMILES FC(F)(F)c1ccccc1-c1ccc(Cl)c(OC2CNC2)c1
Show InChI InChI=1S/C16H13ClF3NO/c17-14-6-5-10(7-15(14)22-11-8-21-9-11)12-3-1-2-4-13(12)16(18,19)20/h1-7,11,21H,8-9H2
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10.5n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was performed using membrane fractions prepared from the HEK-293 cell line recombinantly expressing rat 5-HT7 receptors (NCBI access...


US Patent US8957059 (2015)


BindingDB Entry DOI: 10.7270/Q22Z1472
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Rattus norvegicus (rat))
BDBM104995
PNG
(US8575364, 4)
Show SMILES COc1ccc(cc1OC1CNC1)-c1cccc(C)c1C
Show InChI InChI=1S/C18H21NO2/c1-12-5-4-6-16(13(12)2)14-7-8-17(20-3)18(9-14)21-15-10-19-11-15/h4-9,15,19H,10-11H2,1-3H3
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11n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was performed using membrane fractions prepared from the HEK-293 cell line recombinantly expressing rat 5-HT7 receptors (NCBI access...


US Patent US8957059 (2015)


BindingDB Entry DOI: 10.7270/Q22Z1472
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Rattus norvegicus (rat))
BDBM104995
PNG
(US8575364, 4)
Show SMILES COc1ccc(cc1OC1CNC1)-c1cccc(C)c1C
Show InChI InChI=1S/C18H21NO2/c1-12-5-4-6-16(13(12)2)14-7-8-17(20-3)18(9-14)21-15-10-19-11-15/h4-9,15,19H,10-11H2,1-3H3
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11n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Compound affinity for the rat 5-HT7 receptor subtype was evaluated by competitive radioligand binding assay using 5-carboxamido[H3]typtamine ([3H]5-C...


US Patent US8575364 (2013)


BindingDB Entry DOI: 10.7270/Q2J9651G
More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM81465
PNG
(BROMODIPHENHYDRAMINE | Bromodiphen-hydramine | CAS...)
Show SMILES CN(C)CCOC(c1ccccc1)c1ccc(Br)cc1
Show InChI InChI=1S/C17H20BrNO/c1-19(2)12-13-20-17(14-6-4-3-5-7-14)15-8-10-16(18)11-9-15/h3-11,17H,12-13H2,1-2H3
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13n/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)


Article DOI: 10.1073/pnas.75.12.6290
BindingDB Entry DOI: 10.7270/Q2FN14P6
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Rattus norvegicus (rat))
BDBM104999
PNG
(US8575364, 8)
Show SMILES COc1ccc(cc1OC1CNC1)-c1ccccc1C
Show InChI InChI=1S/C17H19NO2/c1-12-5-3-4-6-15(12)13-7-8-16(19-2)17(9-13)20-14-10-18-11-14/h3-9,14,18H,10-11H2,1-2H3
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13.5n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was performed using membrane fractions prepared from the HEK-293 cell line recombinantly expressing rat 5-HT7 receptors (NCBI access...


US Patent US8957059 (2015)


BindingDB Entry DOI: 10.7270/Q22Z1472
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Rattus norvegicus (rat))
BDBM104999
PNG
(US8575364, 8)
Show SMILES COc1ccc(cc1OC1CNC1)-c1ccccc1C
Show InChI InChI=1S/C17H19NO2/c1-12-5-3-4-6-15(12)13-7-8-16(19-2)17(9-13)20-14-10-18-11-14/h3-9,14,18H,10-11H2,1-2H3
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13.5n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Compound affinity for the rat 5-HT7 receptor subtype was evaluated by competitive radioligand binding assay using 5-carboxamido[H3]typtamine ([3H]5-C...


US Patent US8575364 (2013)


BindingDB Entry DOI: 10.7270/Q2J9651G
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Rattus norvegicus (rat))
BDBM105017
PNG
(US8575364, 26)
Show SMILES Cc1ccccc1-c1ccc(Cl)c(OC2CNC2)c1
Show InChI InChI=1S/C16H16ClNO/c1-11-4-2-3-5-14(11)12-6-7-15(17)16(8-12)19-13-9-18-10-13/h2-8,13,18H,9-10H2,1H3
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15.5n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was performed using membrane fractions prepared from the HEK-293 cell line recombinantly expressing rat 5-HT7 receptors (NCBI access...


US Patent US8957059 (2015)


BindingDB Entry DOI: 10.7270/Q22Z1472
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Rattus norvegicus (rat))
BDBM105017
PNG
(US8575364, 26)
Show SMILES Cc1ccccc1-c1ccc(Cl)c(OC2CNC2)c1
Show InChI InChI=1S/C16H16ClNO/c1-11-4-2-3-5-14(11)12-6-7-15(17)16(8-12)19-13-9-18-10-13/h2-8,13,18H,9-10H2,1H3
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15.5n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Compound affinity for the rat 5-HT7 receptor subtype was evaluated by competitive radioligand binding assay using 5-carboxamido[H3]typtamine ([3H]5-C...


US Patent US8575364 (2013)


BindingDB Entry DOI: 10.7270/Q2J9651G
More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
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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17n/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)


Article DOI: 10.1073/pnas.75.12.6290
BindingDB Entry DOI: 10.7270/Q2FN14P6
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Rattus norvegicus (rat))
BDBM104996
PNG
(US8575364, 5)
Show SMILES COc1ccc(cc1OC1CNC1)-c1cccc(F)c1C
Show InChI InChI=1S/C17H18FNO2/c1-11-14(4-3-5-15(11)18)12-6-7-16(20-2)17(8-12)21-13-9-19-10-13/h3-8,13,19H,9-10H2,1-2H3
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19n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Compound affinity for the rat 5-HT7 receptor subtype was evaluated by competitive radioligand binding assay using 5-carboxamido[H3]typtamine ([3H]5-C...


US Patent US8575364 (2013)


BindingDB Entry DOI: 10.7270/Q2J9651G
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Rattus norvegicus (rat))
BDBM105035
PNG
(US8575364, 44)
Show SMILES COc1ccc(cc1C1CCNC1)-c1cccc(F)c1C
Show InChI InChI=1S/C18H20FNO/c1-12-15(4-3-5-17(12)19)13-6-7-18(21-2)16(10-13)14-8-9-20-11-14/h3-7,10,14,20H,8-9,11H2,1-2H3
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19n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Compound affinity for the rat 5-HT7 receptor subtype was evaluated by competitive radioligand binding assay using 5-carboxamido[H3]typtamine ([3H]5-C...


US Patent US8575364 (2013)


BindingDB Entry DOI: 10.7270/Q2J9651G
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Rattus norvegicus (rat))
BDBM104996
PNG
(US8575364, 5)
Show SMILES COc1ccc(cc1OC1CNC1)-c1cccc(F)c1C
Show InChI InChI=1S/C17H18FNO2/c1-11-14(4-3-5-15(11)18)12-6-7-16(20-2)17(8-12)21-13-9-19-10-13/h3-8,13,19H,9-10H2,1-2H3
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19n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was performed using membrane fractions prepared from the HEK-293 cell line recombinantly expressing rat 5-HT7 receptors (NCBI access...


US Patent US8957059 (2015)


BindingDB Entry DOI: 10.7270/Q22Z1472
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Rattus norvegicus (rat))
BDBM105035
PNG
(US8575364, 44)
Show SMILES COc1ccc(cc1C1CCNC1)-c1cccc(F)c1C
Show InChI InChI=1S/C18H20FNO/c1-12-15(4-3-5-17(12)19)13-6-7-18(21-2)16(10-13)14-8-9-20-11-14/h3-7,10,14,20H,8-9,11H2,1-2H3
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19n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was performed using membrane fractions prepared from the HEK-293 cell line recombinantly expressing rat 5-HT7 receptors (NCBI access...


US Patent US8957059 (2015)


BindingDB Entry DOI: 10.7270/Q22Z1472
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Rattus norvegicus (rat))
BDBM105039
PNG
(US8575364, 48)
Show SMILES COc1ccc(cc1C1CCNC1)-c1ccccc1OC(F)(F)F
Show InChI InChI=1S/C18H18F3NO2/c1-23-16-7-6-12(10-15(16)13-8-9-22-11-13)14-4-2-3-5-17(14)24-18(19,20)21/h2-7,10,13,22H,8-9,11H2,1H3
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19.8n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was performed using membrane fractions prepared from the HEK-293 cell line recombinantly expressing rat 5-HT7 receptors (NCBI access...


US Patent US8957059 (2015)


BindingDB Entry DOI: 10.7270/Q22Z1472
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Rattus norvegicus (rat))
BDBM105039
PNG
(US8575364, 48)
Show SMILES COc1ccc(cc1C1CCNC1)-c1ccccc1OC(F)(F)F
Show InChI InChI=1S/C18H18F3NO2/c1-23-16-7-6-12(10-15(16)13-8-9-22-11-13)14-4-2-3-5-17(14)24-18(19,20)21/h2-7,10,13,22H,8-9,11H2,1H3
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19.8n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Compound affinity for the rat 5-HT7 receptor subtype was evaluated by competitive radioligand binding assay using 5-carboxamido[H3]typtamine ([3H]5-C...


US Patent US8575364 (2013)


BindingDB Entry DOI: 10.7270/Q2J9651G
More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM50002338
PNG
((Thioridazine)10-[2-(1-Methyl-piperidin-2-yl)-ethy...)
Show SMILES CSc1ccc2Sc3ccccc3N(CCC3CCCCN3C)c2c1
Show InChI InChI=1S/C21H26N2S2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(24-2)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3
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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)


Article DOI: 10.1073/pnas.75.12.6290
BindingDB Entry DOI: 10.7270/Q2FN14P6
More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM50089147
PNG
(2-Methyl-9-phenyl-2,3,4,9-tetrahydro-1H-indeno[2,1...)
Show SMILES CN1CCC2=C(C1)C(c1ccccc21)c1ccccc1 |c:4|
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/h2-10,19H,11-13H2,1H3
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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)


Article DOI: 10.1073/pnas.75.12.6290
BindingDB Entry DOI: 10.7270/Q2FN14P6
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Rattus norvegicus (rat))
BDBM104993
PNG
(US8575364, 2)
Show SMILES COc1ccc(cc1OC1CNC1)-c1ccc(F)cc1C
Show InChI InChI=1S/C17H18FNO2/c1-11-7-13(18)4-5-15(11)12-3-6-16(20-2)17(8-12)21-14-9-19-10-14/h3-8,14,19H,9-10H2,1-2H3
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21n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was performed using membrane fractions prepared from the HEK-293 cell line recombinantly expressing rat 5-HT7 receptors (NCBI access...


US Patent US8957059 (2015)


BindingDB Entry DOI: 10.7270/Q22Z1472
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Rattus norvegicus (rat))
BDBM104993
PNG
(US8575364, 2)
Show SMILES COc1ccc(cc1OC1CNC1)-c1ccc(F)cc1C
Show InChI InChI=1S/C17H18FNO2/c1-11-7-13(18)4-5-15(11)12-3-6-16(20-2)17(8-12)21-14-9-19-10-14/h3-8,14,19H,9-10H2,1-2H3
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21n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Compound affinity for the rat 5-HT7 receptor subtype was evaluated by competitive radioligand binding assay using 5-carboxamido[H3]typtamine ([3H]5-C...


US Patent US8575364 (2013)


BindingDB Entry DOI: 10.7270/Q2J9651G
More data for this
Ligand-Target Pair
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