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PubMed code 23488743

Compile data set for download or QSAR
Found 30 hits of Enzyme Inhibition Constant Data   
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
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (human))
BDBM248048
PNG
(5-(1-(3-cyclopentenylbenzyl)piperidin-4-yl)-1H-ben...)
Show SMILES O=c1[nH]c2ccc(cc2[nH]1)C1CCN(Cc2cccc(c2)C2=CCCC2)CC1
Show InChI InChI=1S/C24H27N3O/c28-24-25-22-9-8-21(15-23(22)26-24)19-10-12-27(13-11-19)16-17-4-3-7-20(14-17)18-5-1-2-6-18/h3-5,7-9,14-15,19H,1-2,6,10-13,16H2,(H2,25,26,28)
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1.20 -53.0n/an/an/an/an/a7.437



King Fahd University of Petroleum & Minerals



Assay Description
Human-cloned 5-HT1A serotonin receptors stably expressed in HEK293-EBNA cells (Perkin-Elmer, Waltham, MA) were radiolabeled with 1.0nM [3H]-8-OH-DPAT...


J Enzyme Inhib Med Chem 29: 281-91 (2014)


Article DOI: 10.3109/14756366.2013.776556
BindingDB Entry DOI: 10.7270/Q2SN07WV
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (human))
BDBM248055
PNG
(5-(4-((5-cyclopentenylpyridin-3-yl)methyl)piperazi...)
Show SMILES O=c1[nH]c2ccc(cc2[nH]1)N1CCN(Cc2cncc(c2)C2=CCCC2)CC1
Show InChI InChI=1S/C22H25N5O/c28-22-24-20-6-5-19(12-21(20)25-22)27-9-7-26(8-10-27)15-16-11-18(14-23-13-16)17-3-1-2-4-17/h3,5-6,11-14H,1-2,4,7-10,15H2,(H2,24,25,28)
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1.70 -52.1n/an/an/an/an/a7.437



King Fahd University of Petroleum & Minerals



Assay Description
Human-cloned 5-HT1A serotonin receptors stably expressed in HEK293-EBNA cells (Perkin-Elmer, Waltham, MA) were radiolabeled with 1.0nM [3H]-8-OH-DPAT...


J Enzyme Inhib Med Chem 29: 281-91 (2014)


Article DOI: 10.3109/14756366.2013.776556
BindingDB Entry DOI: 10.7270/Q2SN07WV
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM21398
PNG
(4-[4-(4-Chloro-phenyl)-4-hydroxy-piperidin-1-yl]-1...)
Show SMILES OC1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C21H23ClFNO2/c22-18-7-5-17(6-8-18)21(26)11-14-24(15-12-21)13-1-2-20(25)16-3-9-19(23)10-4-16/h3-10,26H,1-2,11-15H2
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2.92 -48.7n/an/an/an/an/a7.425



King Fahd University of Petroleum & Minerals



Assay Description
Human-cloned dopamine D2L receptors stably expressed in C6 rat glioma cells (kindly donated by Professor Roberto Maggio, Università di L'Aquil...


J Enzyme Inhib Med Chem 29: 281-91 (2014)


Article DOI: 10.3109/14756366.2013.776556
BindingDB Entry DOI: 10.7270/Q2SN07WV
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (human))
BDBM248054
PNG
(5-(4-(3-cyclopentenylbenzyl)piperazin-1-yl)-1H-ben...)
Show SMILES O=c1[nH]c2ccc(cc2[nH]1)N1CCN(Cc2cccc(c2)C2=CCCC2)CC1
Show InChI InChI=1S/C23H26N4O/c28-23-24-21-9-8-20(15-22(21)25-23)27-12-10-26(11-13-27)16-17-4-3-7-19(14-17)18-5-1-2-6-18/h3-5,7-9,14-15H,1-2,6,10-13,16H2,(H2,24,25,28)
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3.10 -50.5n/an/an/an/an/a7.437



King Fahd University of Petroleum & Minerals



Assay Description
Human-cloned 5-HT1A serotonin receptors stably expressed in HEK293-EBNA cells (Perkin-Elmer, Waltham, MA) were radiolabeled with 1.0nM [3H]-8-OH-DPAT...


J Enzyme Inhib Med Chem 29: 281-91 (2014)


Article DOI: 10.3109/14756366.2013.776556
BindingDB Entry DOI: 10.7270/Q2SN07WV
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM248055
PNG
(5-(4-((5-cyclopentenylpyridin-3-yl)methyl)piperazi...)
Show SMILES O=c1[nH]c2ccc(cc2[nH]1)N1CCN(Cc2cncc(c2)C2=CCCC2)CC1
Show InChI InChI=1S/C22H25N5O/c28-22-24-20-6-5-19(12-21(20)25-22)27-9-7-26(8-10-27)15-16-11-18(14-23-13-16)17-3-1-2-4-17/h3,5-6,11-14H,1-2,4,7-10,15H2,(H2,24,25,28)
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3.10 -48.6n/an/an/an/an/a7.425



King Fahd University of Petroleum & Minerals



Assay Description
Human-cloned dopamine D2L receptors stably expressed in C6 rat glioma cells (kindly donated by Professor Roberto Maggio, Università di L'Aquil...


J Enzyme Inhib Med Chem 29: 281-91 (2014)


Article DOI: 10.3109/14756366.2013.776556
BindingDB Entry DOI: 10.7270/Q2SN07WV
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM248049
PNG
(5-(1-((5-cyclopentenylpyridin-3-yl)methyl)piperidi...)
Show SMILES O=c1[nH]c2ccc(cc2[nH]1)C1CCN(Cc2cncc(c2)C2=CCCC2)CC1
Show InChI InChI=1S/C23H26N4O/c28-23-25-21-6-5-19(12-22(21)26-23)18-7-9-27(10-8-18)15-16-11-20(14-24-13-16)17-3-1-2-4-17/h3,5-6,11-14,18H,1-2,4,7-10,15H2,(H2,25,26,28)
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4.26 -47.8n/an/an/an/an/a7.425



King Fahd University of Petroleum & Minerals



Assay Description
Human-cloned dopamine D2L receptors stably expressed in C6 rat glioma cells (kindly donated by Professor Roberto Maggio, Università di L'Aquil...


J Enzyme Inhib Med Chem 29: 281-91 (2014)


Article DOI: 10.3109/14756366.2013.776556
BindingDB Entry DOI: 10.7270/Q2SN07WV
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (human))
BDBM248052
PNG
(5-(4-((5-phenylpyridin-3-yl)methyl)piperazin-1-yl)...)
Show SMILES O=c1[nH]c2ccc(cc2[nH]1)N1CCN(Cc2cncc(c2)-c2ccccc2)CC1
Show InChI InChI=1S/C23H23N5O/c29-23-25-21-7-6-20(13-22(21)26-23)28-10-8-27(9-11-28)16-17-12-19(15-24-14-17)18-4-2-1-3-5-18/h1-7,12-15H,8-11,16H2,(H2,25,26,29)
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5.30 -49.1n/an/an/an/an/a7.437



King Fahd University of Petroleum & Minerals



Assay Description
Human-cloned 5-HT1A serotonin receptors stably expressed in HEK293-EBNA cells (Perkin-Elmer, Waltham, MA) were radiolabeled with 1.0nM [3H]-8-OH-DPAT...


J Enzyme Inhib Med Chem 29: 281-91 (2014)


Article DOI: 10.3109/14756366.2013.776556
BindingDB Entry DOI: 10.7270/Q2SN07WV
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (human))
BDBM248049
PNG
(5-(1-((5-cyclopentenylpyridin-3-yl)methyl)piperidi...)
Show SMILES O=c1[nH]c2ccc(cc2[nH]1)C1CCN(Cc2cncc(c2)C2=CCCC2)CC1
Show InChI InChI=1S/C23H26N4O/c28-23-25-21-6-5-19(12-22(21)26-23)18-7-9-27(10-8-18)15-16-11-20(14-24-13-16)17-3-1-2-4-17/h3,5-6,11-14,18H,1-2,4,7-10,15H2,(H2,25,26,28)
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6.30 -48.7n/an/an/an/an/a7.437



King Fahd University of Petroleum & Minerals



Assay Description
Human-cloned 5-HT1A serotonin receptors stably expressed in HEK293-EBNA cells (Perkin-Elmer, Waltham, MA) were radiolabeled with 1.0nM [3H]-8-OH-DPAT...


J Enzyme Inhib Med Chem 29: 281-91 (2014)


Article DOI: 10.3109/14756366.2013.776556
BindingDB Entry DOI: 10.7270/Q2SN07WV
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (human))
BDBM248046
PNG
(5-(1-((5-phenylpyridin-3-yl)methyl)piperidin-4-yl)...)
Show SMILES O=c1[nH]c2ccc(cc2[nH]1)C1CCN(Cc2cncc(c2)-c2ccccc2)CC1
Show InChI InChI=1S/C24H24N4O/c29-24-26-22-7-6-20(13-23(22)27-24)19-8-10-28(11-9-19)16-17-12-21(15-25-14-17)18-4-2-1-3-5-18/h1-7,12-15,19H,8-11,16H2,(H2,26,27,29)
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6.72 -48.5n/an/an/an/an/a7.437



King Fahd University of Petroleum & Minerals



Assay Description
Human-cloned 5-HT1A serotonin receptors stably expressed in HEK293-EBNA cells (Perkin-Elmer, Waltham, MA) were radiolabeled with 1.0nM [3H]-8-OH-DPAT...


J Enzyme Inhib Med Chem 29: 281-91 (2014)


Article DOI: 10.3109/14756366.2013.776556
BindingDB Entry DOI: 10.7270/Q2SN07WV
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (human))
BDBM50241119
PNG
(7-(4-Biphenyl-3-ylmethyl-piperazin-1-yl)-3H-benzoo...)
Show SMILES O=c1[nH]c2cccc(N3CCN(Cc4cccc(c4)-c4ccccc4)CC3)c2o1
Show InChI InChI=1S/C24H23N3O2/c28-24-25-21-10-5-11-22(23(21)29-24)27-14-12-26(13-15-27)17-18-6-4-9-20(16-18)19-7-2-1-3-8-19/h1-11,16H,12-15,17H2,(H,25,28)
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7.19 -48.3n/an/an/an/an/a7.437



King Fahd University of Petroleum & Minerals



Assay Description
Human-cloned 5-HT1A serotonin receptors stably expressed in HEK293-EBNA cells (Perkin-Elmer, Waltham, MA) were radiolabeled with 1.0nM [3H]-8-OH-DPAT...


J Enzyme Inhib Med Chem 29: 281-91 (2014)


Article DOI: 10.3109/14756366.2013.776556
BindingDB Entry DOI: 10.7270/Q2SN07WV
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM248048
PNG
(5-(1-(3-cyclopentenylbenzyl)piperidin-4-yl)-1H-ben...)
Show SMILES O=c1[nH]c2ccc(cc2[nH]1)C1CCN(Cc2cccc(c2)C2=CCCC2)CC1
Show InChI InChI=1S/C24H27N3O/c28-24-25-22-9-8-21(15-23(22)26-24)19-10-12-27(13-11-19)16-17-4-3-7-20(14-17)18-5-1-2-6-18/h3-5,7-9,14-15,19H,1-2,6,10-13,16H2,(H2,25,26,28)
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8.12 -46.2n/an/an/an/an/a7.425



King Fahd University of Petroleum & Minerals



Assay Description
Human-cloned dopamine D2L receptors stably expressed in C6 rat glioma cells (kindly donated by Professor Roberto Maggio, Università di L'Aquil...


J Enzyme Inhib Med Chem 29: 281-91 (2014)


Article DOI: 10.3109/14756366.2013.776556
BindingDB Entry DOI: 10.7270/Q2SN07WV
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM248056
PNG
(1-(2,3-dihydro-1,4-benzodioxin-5-yl)-4-[[5-(4-fluo...)
Show SMILES Fc1ccc(cc1)-c1cncc(CN2CCN(CC2)c2cccc3OCCOc23)c1
Show InChI InChI=1S/C24H24FN3O2/c25-21-6-4-19(5-7-21)20-14-18(15-26-16-20)17-27-8-10-28(11-9-27)22-2-1-3-23-24(22)30-13-12-29-23/h1-7,14-16H,8-13,17H2
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8.40 -46.1n/an/an/an/an/a7.425



King Fahd University of Petroleum & Minerals



Assay Description
Human-cloned dopamine D2L receptors stably expressed in C6 rat glioma cells (kindly donated by Professor Roberto Maggio, Università di L'Aquil...


J Enzyme Inhib Med Chem 29: 281-91 (2014)


Article DOI: 10.3109/14756366.2013.776556
BindingDB Entry DOI: 10.7270/Q2SN07WV
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (human))
BDBM248056
PNG
(1-(2,3-dihydro-1,4-benzodioxin-5-yl)-4-[[5-(4-fluo...)
Show SMILES Fc1ccc(cc1)-c1cncc(CN2CCN(CC2)c2cccc3OCCOc23)c1
Show InChI InChI=1S/C24H24FN3O2/c25-21-6-4-19(5-7-21)20-14-18(15-26-16-20)17-27-8-10-28(11-9-27)22-2-1-3-23-24(22)30-13-12-29-23/h1-7,14-16H,8-13,17H2
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8.64 -47.9n/an/an/an/an/a7.437



King Fahd University of Petroleum & Minerals



Assay Description
Human-cloned 5-HT1A serotonin receptors stably expressed in HEK293-EBNA cells (Perkin-Elmer, Waltham, MA) were radiolabeled with 1.0nM [3H]-8-OH-DPAT...


J Enzyme Inhib Med Chem 29: 281-91 (2014)


Article DOI: 10.3109/14756366.2013.776556
BindingDB Entry DOI: 10.7270/Q2SN07WV
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50241119
PNG
(7-(4-Biphenyl-3-ylmethyl-piperazin-1-yl)-3H-benzoo...)
Show SMILES O=c1[nH]c2cccc(N3CCN(Cc4cccc(c4)-c4ccccc4)CC3)c2o1
Show InChI InChI=1S/C24H23N3O2/c28-24-25-21-10-5-11-22(23(21)29-24)27-14-12-26(13-15-27)17-18-6-4-9-20(16-18)19-7-2-1-3-8-19/h1-11,16H,12-15,17H2,(H,25,28)
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8.81 -46.0n/an/an/an/an/a7.425



King Fahd University of Petroleum & Minerals



Assay Description
Human-cloned dopamine D2L receptors stably expressed in C6 rat glioma cells (kindly donated by Professor Roberto Maggio, Università di L'Aquil...


J Enzyme Inhib Med Chem 29: 281-91 (2014)


Article DOI: 10.3109/14756366.2013.776556
BindingDB Entry DOI: 10.7270/Q2SN07WV
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (human))
BDBM248047
PNG
(5-(1-((5-(4-Fluorophenyl)pyridin-3-yl)methyl)piper...)
Show SMILES Fc1ccc(cc1)-c1cncc(CN2CCC(CC2)c2ccc3[nH]c(=O)[nH]c3c2)c1
Show InChI InChI=1S/C24H23FN4O/c25-21-4-1-17(2-5-21)20-11-16(13-26-14-20)15-29-9-7-18(8-10-29)19-3-6-22-23(12-19)28-24(30)27-22/h1-6,11-14,18H,7-10,15H2,(H2,27,28,30)
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9.42 -47.7n/an/an/an/an/a7.437



King Fahd University of Petroleum & Minerals



Assay Description
Human-cloned 5-HT1A serotonin receptors stably expressed in HEK293-EBNA cells (Perkin-Elmer, Waltham, MA) were radiolabeled with 1.0nM [3H]-8-OH-DPAT...


J Enzyme Inhib Med Chem 29: 281-91 (2014)


Article DOI: 10.3109/14756366.2013.776556
BindingDB Entry DOI: 10.7270/Q2SN07WV
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (human))
BDBM10755
PNG
(14C-5-hydroxy tryptamine creatinine disulfate | 2-...)
Show SMILES NCCc1c[nH]c2ccc(O)cc12
Show InChI InChI=1S/C10H12N2O/c11-4-3-7-6-12-10-2-1-8(13)5-9(7)10/h1-2,5-6,12-13H,3-4,11H2
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10 -47.5n/an/an/an/an/a7.437



King Fahd University of Petroleum & Minerals



Assay Description
Human-cloned 5-HT1A serotonin receptors stably expressed in HEK293-EBNA cells (Perkin-Elmer, Waltham, MA) were radiolabeled with 1.0nM [3H]-8-OH-DPAT...


J Enzyme Inhib Med Chem 29: 281-91 (2014)


Article DOI: 10.3109/14756366.2013.776556
BindingDB Entry DOI: 10.7270/Q2SN07WV
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM248054
PNG
(5-(4-(3-cyclopentenylbenzyl)piperazin-1-yl)-1H-ben...)
Show SMILES O=c1[nH]c2ccc(cc2[nH]1)N1CCN(Cc2cccc(c2)C2=CCCC2)CC1
Show InChI InChI=1S/C23H26N4O/c28-23-24-21-9-8-20(15-22(21)25-23)27-12-10-26(11-13-27)16-17-4-3-7-19(14-17)18-5-1-2-6-18/h3-5,7-9,14-15H,1-2,6,10-13,16H2,(H2,24,25,28)
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10.4 -45.6n/an/an/an/an/a7.425



King Fahd University of Petroleum & Minerals



Assay Description
Human-cloned dopamine D2L receptors stably expressed in C6 rat glioma cells (kindly donated by Professor Roberto Maggio, Università di L'Aquil...


J Enzyme Inhib Med Chem 29: 281-91 (2014)


Article DOI: 10.3109/14756366.2013.776556
BindingDB Entry DOI: 10.7270/Q2SN07WV
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (human))
BDBM248053
PNG
(5-(4-((5-(4-fluorophenyl)pyridin-3-yl)methyl)piper...)
Show SMILES Fc1ccc(cc1)-c1cncc(CN2CCN(CC2)c2ccc3[nH]c(=O)[nH]c3c2)c1
Show InChI InChI=1S/C23H22FN5O/c24-19-3-1-17(2-4-19)18-11-16(13-25-14-18)15-28-7-9-29(10-8-28)20-5-6-21-22(12-20)27-23(30)26-21/h1-6,11-14H,7-10,15H2,(H2,26,27,30)
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11.4 -47.2n/an/an/an/an/a7.437



King Fahd University of Petroleum & Minerals



Assay Description
Human-cloned 5-HT1A serotonin receptors stably expressed in HEK293-EBNA cells (Perkin-Elmer, Waltham, MA) were radiolabeled with 1.0nM [3H]-8-OH-DPAT...


J Enzyme Inhib Med Chem 29: 281-91 (2014)


Article DOI: 10.3109/14756366.2013.776556
BindingDB Entry DOI: 10.7270/Q2SN07WV
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM248052
PNG
(5-(4-((5-phenylpyridin-3-yl)methyl)piperazin-1-yl)...)
Show SMILES O=c1[nH]c2ccc(cc2[nH]1)N1CCN(Cc2cncc(c2)-c2ccccc2)CC1
Show InChI InChI=1S/C23H23N5O/c29-23-25-21-7-6-20(13-22(21)26-23)28-10-8-27(9-11-28)16-17-12-19(15-24-14-17)18-4-2-1-3-5-18/h1-7,12-15H,8-11,16H2,(H2,25,26,29)
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12.6 -45.1n/an/an/an/an/a7.425



King Fahd University of Petroleum & Minerals



Assay Description
Human-cloned dopamine D2L receptors stably expressed in C6 rat glioma cells (kindly donated by Professor Roberto Maggio, Università di L'Aquil...


J Enzyme Inhib Med Chem 29: 281-91 (2014)


Article DOI: 10.3109/14756366.2013.776556
BindingDB Entry DOI: 10.7270/Q2SN07WV
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (human))
BDBM248045
PNG
(5-(1-((4'-Fluorobiphenyl-4-yl)methyl)piperidin...)
Show SMILES Fc1ccc(cc1)-c1ccc(CN2CCC(CC2)c2ccc3[nH]c(=O)[nH]c3c2)cc1
Show InChI InChI=1S/C25H24FN3O/c26-22-8-5-19(6-9-22)18-3-1-17(2-4-18)16-29-13-11-20(12-14-29)21-7-10-23-24(15-21)28-25(30)27-23/h1-10,15,20H,11-14,16H2,(H2,27,28,30)
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16.2 -46.3n/an/an/an/an/a7.437



King Fahd University of Petroleum & Minerals



Assay Description
Human-cloned 5-HT1A serotonin receptors stably expressed in HEK293-EBNA cells (Perkin-Elmer, Waltham, MA) were radiolabeled with 1.0nM [3H]-8-OH-DPAT...


J Enzyme Inhib Med Chem 29: 281-91 (2014)


Article DOI: 10.3109/14756366.2013.776556
BindingDB Entry DOI: 10.7270/Q2SN07WV
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM248046
PNG
(5-(1-((5-phenylpyridin-3-yl)methyl)piperidin-4-yl)...)
Show SMILES O=c1[nH]c2ccc(cc2[nH]1)C1CCN(Cc2cncc(c2)-c2ccccc2)CC1
Show InChI InChI=1S/C24H24N4O/c29-24-26-22-7-6-20(13-23(22)27-24)19-8-10-28(11-9-19)16-17-12-21(15-25-14-17)18-4-2-1-3-5-18/h1-7,12-15,19H,8-11,16H2,(H2,26,27,29)
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18.5 -44.1n/an/an/an/an/a7.425



King Fahd University of Petroleum & Minerals



Assay Description
Human-cloned dopamine D2L receptors stably expressed in C6 rat glioma cells (kindly donated by Professor Roberto Maggio, Università di L'Aquil...


J Enzyme Inhib Med Chem 29: 281-91 (2014)


Article DOI: 10.3109/14756366.2013.776556
BindingDB Entry DOI: 10.7270/Q2SN07WV
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM248047
PNG
(5-(1-((5-(4-Fluorophenyl)pyridin-3-yl)methyl)piper...)
Show SMILES Fc1ccc(cc1)-c1cncc(CN2CCC(CC2)c2ccc3[nH]c(=O)[nH]c3c2)c1
Show InChI InChI=1S/C24H23FN4O/c25-21-4-1-17(2-5-21)20-11-16(13-26-14-20)15-29-9-7-18(8-10-29)19-3-6-22-23(12-19)28-24(30)27-22/h1-6,11-14,18H,7-10,15H2,(H2,27,28,30)
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24.6 -43.4n/an/an/an/an/a7.425



King Fahd University of Petroleum & Minerals



Assay Description
Human-cloned dopamine D2L receptors stably expressed in C6 rat glioma cells (kindly donated by Professor Roberto Maggio, Università di L'Aquil...


J Enzyme Inhib Med Chem 29: 281-91 (2014)


Article DOI: 10.3109/14756366.2013.776556
BindingDB Entry DOI: 10.7270/Q2SN07WV
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (human))
BDBM248051
PNG
(5-(4-((4'-fluorobiphenyl-4-yl)methyl)piperazin...)
Show SMILES Fc1ccc(cc1)-c1ccc(CN2CCN(CC2)c2ccc3[nH]c(=O)[nH]c3c2)cc1
Show InChI InChI=1S/C24H23FN4O/c25-20-7-5-19(6-8-20)18-3-1-17(2-4-18)16-28-11-13-29(14-12-28)21-9-10-22-23(15-21)27-24(30)26-22/h1-10,15H,11-14,16H2,(H2,26,27,30)
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27.2 -44.9n/an/an/an/an/a7.437



King Fahd University of Petroleum & Minerals



Assay Description
Human-cloned 5-HT1A serotonin receptors stably expressed in HEK293-EBNA cells (Perkin-Elmer, Waltham, MA) were radiolabeled with 1.0nM [3H]-8-OH-DPAT...


J Enzyme Inhib Med Chem 29: 281-91 (2014)


Article DOI: 10.3109/14756366.2013.776556
BindingDB Entry DOI: 10.7270/Q2SN07WV
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (human))
BDBM248044
PNG
(5-(1-(biphenyl-4-ylmethyl)piperidin-4-yl)-1H-benzo...)
Show SMILES O=c1[nH]c2ccc(cc2[nH]1)C1CCN(Cc2ccc(cc2)-c2ccccc2)CC1
Show InChI InChI=1S/C25H25N3O/c29-25-26-23-11-10-22(16-24(23)27-25)21-12-14-28(15-13-21)17-18-6-8-20(9-7-18)19-4-2-1-3-5-19/h1-11,16,21H,12-15,17H2,(H2,26,27,29)
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34.2 -44.3n/an/an/an/an/a7.437



King Fahd University of Petroleum & Minerals



Assay Description
Human-cloned 5-HT1A serotonin receptors stably expressed in HEK293-EBNA cells (Perkin-Elmer, Waltham, MA) were radiolabeled with 1.0nM [3H]-8-OH-DPAT...


J Enzyme Inhib Med Chem 29: 281-91 (2014)


Article DOI: 10.3109/14756366.2013.776556
BindingDB Entry DOI: 10.7270/Q2SN07WV
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM248045
PNG
(5-(1-((4'-Fluorobiphenyl-4-yl)methyl)piperidin...)
Show SMILES Fc1ccc(cc1)-c1ccc(CN2CCC(CC2)c2ccc3[nH]c(=O)[nH]c3c2)cc1
Show InChI InChI=1S/C25H24FN3O/c26-22-8-5-19(6-9-22)18-3-1-17(2-4-18)16-29-13-11-20(12-14-29)21-7-10-23-24(15-21)28-25(30)27-23/h1-10,15,20H,11-14,16H2,(H2,27,28,30)
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34.4 -42.6n/an/an/an/an/a7.425



King Fahd University of Petroleum & Minerals



Assay Description
Human-cloned dopamine D2L receptors stably expressed in C6 rat glioma cells (kindly donated by Professor Roberto Maggio, Università di L'Aquil...


J Enzyme Inhib Med Chem 29: 281-91 (2014)


Article DOI: 10.3109/14756366.2013.776556
BindingDB Entry DOI: 10.7270/Q2SN07WV
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM248050
PNG
(5-(4-(biphenyl-4-ylmethyl)piperazin-1-yl)-1H-benzo...)
Show SMILES O=c1[nH]c2ccc(cc2[nH]1)N1CCN(Cc2ccc(cc2)-c2ccccc2)CC1
Show InChI InChI=1S/C24H24N4O/c29-24-25-22-11-10-21(16-23(22)26-24)28-14-12-27(13-15-28)17-18-6-8-20(9-7-18)19-4-2-1-3-5-19/h1-11,16H,12-15,17H2,(H2,25,26,29)
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42.2 -42.1n/an/an/an/an/a7.425



King Fahd University of Petroleum & Minerals



Assay Description
Human-cloned dopamine D2L receptors stably expressed in C6 rat glioma cells (kindly donated by Professor Roberto Maggio, Università di L'Aquil...


J Enzyme Inhib Med Chem 29: 281-91 (2014)


Article DOI: 10.3109/14756366.2013.776556
BindingDB Entry DOI: 10.7270/Q2SN07WV
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (human))
BDBM248050
PNG
(5-(4-(biphenyl-4-ylmethyl)piperazin-1-yl)-1H-benzo...)
Show SMILES O=c1[nH]c2ccc(cc2[nH]1)N1CCN(Cc2ccc(cc2)-c2ccccc2)CC1
Show InChI InChI=1S/C24H24N4O/c29-24-25-22-11-10-21(16-23(22)26-24)28-14-12-27(13-15-28)17-18-6-8-20(9-7-18)19-4-2-1-3-5-19/h1-11,16H,12-15,17H2,(H2,25,26,29)
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46.3 -43.5n/an/an/an/an/a7.437



King Fahd University of Petroleum & Minerals



Assay Description
Human-cloned 5-HT1A serotonin receptors stably expressed in HEK293-EBNA cells (Perkin-Elmer, Waltham, MA) were radiolabeled with 1.0nM [3H]-8-OH-DPAT...


J Enzyme Inhib Med Chem 29: 281-91 (2014)


Article DOI: 10.3109/14756366.2013.776556
BindingDB Entry DOI: 10.7270/Q2SN07WV
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM248051
PNG
(5-(4-((4'-fluorobiphenyl-4-yl)methyl)piperazin...)
Show SMILES Fc1ccc(cc1)-c1ccc(CN2CCN(CC2)c2ccc3[nH]c(=O)[nH]c3c2)cc1
Show InChI InChI=1S/C24H23FN4O/c25-20-7-5-19(6-8-20)18-3-1-17(2-4-18)16-28-11-13-29(14-12-28)21-9-10-22-23(15-21)27-24(30)26-22/h1-10,15H,11-14,16H2,(H2,26,27,30)
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62.6 -41.1n/an/an/an/an/a7.425



King Fahd University of Petroleum & Minerals



Assay Description
Human-cloned dopamine D2L receptors stably expressed in C6 rat glioma cells (kindly donated by Professor Roberto Maggio, Università di L'Aquil...


J Enzyme Inhib Med Chem 29: 281-91 (2014)


Article DOI: 10.3109/14756366.2013.776556
BindingDB Entry DOI: 10.7270/Q2SN07WV
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM248053
PNG
(5-(4-((5-(4-fluorophenyl)pyridin-3-yl)methyl)piper...)
Show SMILES Fc1ccc(cc1)-c1cncc(CN2CCN(CC2)c2ccc3[nH]c(=O)[nH]c3c2)c1
Show InChI InChI=1S/C23H22FN5O/c24-19-3-1-17(2-4-19)18-11-16(13-25-14-18)15-28-7-9-29(10-8-28)20-5-6-21-22(12-20)27-23(30)26-21/h1-6,11-14H,7-10,15H2,(H2,26,27,30)
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82 -40.4n/an/an/an/an/a7.425



King Fahd University of Petroleum & Minerals



Assay Description
Human-cloned dopamine D2L receptors stably expressed in C6 rat glioma cells (kindly donated by Professor Roberto Maggio, Università di L'Aquil...


J Enzyme Inhib Med Chem 29: 281-91 (2014)


Article DOI: 10.3109/14756366.2013.776556
BindingDB Entry DOI: 10.7270/Q2SN07WV
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM248044
PNG
(5-(1-(biphenyl-4-ylmethyl)piperidin-4-yl)-1H-benzo...)
Show SMILES O=c1[nH]c2ccc(cc2[nH]1)C1CCN(Cc2ccc(cc2)-c2ccccc2)CC1
Show InChI InChI=1S/C25H25N3O/c29-25-26-23-11-10-22(16-24(23)27-25)21-12-14-28(15-13-21)17-18-6-8-20(9-7-18)19-4-2-1-3-5-19/h1-11,16,21H,12-15,17H2,(H2,26,27,29)
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96.2 -40.0n/an/an/an/an/a7.425



King Fahd University of Petroleum & Minerals



Assay Description
Human-cloned dopamine D2L receptors stably expressed in C6 rat glioma cells (kindly donated by Professor Roberto Maggio, Università di L'Aquil...


J Enzyme Inhib Med Chem 29: 281-91 (2014)


Article DOI: 10.3109/14756366.2013.776556
BindingDB Entry DOI: 10.7270/Q2SN07WV
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%