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PubMed code 18072730

Compile data set for download or QSAR
Found 48 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
D(3) dopamine receptor


(Homo sapiens (Human))		BDBM50229783
PNG
(6-[(2-(4-(2,3-dichlorophenyl)piperazin-1-yl)ethyl)...)
Show SMILES CCCN(CCN1CCN(CC1)c1cccc(Cl)c1Cl)C1CCc2c(O)cccc2C1 |w:20.21|
Show InChI InChI=1S/C25H33Cl2N3O/c1-2-11-29(20-9-10-21-19(18-20)5-3-8-24(21)31)15-12-28-13-16-30(17-14-28)23-7-4-6-22(26)25(23)27/h3-8,20,31H,2,9-18H2,1H3
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 0.450n/an/an/an/an/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human cloned dopamine D3 receptor expressed in HEK293 cells

J Med Chem 51: 101-17 (2008)


Article DOI: 10.1021/jm070860r
BindingDB Entry DOI: 10.7270/Q2VQ32FD
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))		BDBM50229776
PNG
(6-[(2-(4-(2-methoxyphenyl)piperazin-1-yl)ethyl)(pr...)
Show SMILES CCCN(CCN1CCN(CC1)c1ccccc1OC)C1CCc2c(O)cccc2C1 |w:20.21|
Show InChI InChI=1S/C26H37N3O2/c1-3-13-28(22-11-12-23-21(20-22)7-6-9-25(23)30)17-14-27-15-18-29(19-16-27)24-8-4-5-10-26(24)31-2/h4-10,22,30H,3,11-20H2,1-2H3
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 0.460n/an/an/an/an/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human cloned dopamine D3 receptor expressed in HEK293 cells

J Med Chem 51: 101-17 (2008)


Article DOI: 10.1021/jm070860r
BindingDB Entry DOI: 10.7270/Q2VQ32FD
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))		BDBM50229776
PNG
(6-[(2-(4-(2-methoxyphenyl)piperazin-1-yl)ethyl)(pr...)
Show SMILES CCCN(CCN1CCN(CC1)c1ccccc1OC)C1CCc2c(O)cccc2C1 |w:20.21|
Show InChI InChI=1S/C26H37N3O2/c1-3-13-28(22-11-12-23-21(20-22)7-6-9-25(23)30)17-14-27-15-18-29(19-16-27)24-8-4-5-10-26(24)31-2/h4-10,22,30H,3,11-20H2,1-2H3
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 0.460n/an/an/an/an/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human cloned dopamine D3 receptor expressed in HEK293 cells

J Med Chem 51: 101-17 (2008)


Article DOI: 10.1021/jm070860r
BindingDB Entry DOI: 10.7270/Q2VQ32FD
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))		BDBM50109927
PNG
((+)-7-[(4-(4-phenylpiperazin-1-yl)butyl)(propyl)am...)
Show SMILES CCCN(CCCCN1CCN(CC1)c1ccccc1)C1CCc2ccc(O)cc2C1
Show InChI InChI=1S/C27H39N3O/c1-2-14-29(26-12-10-23-11-13-27(31)22-24(23)21-26)16-7-6-15-28-17-19-30(20-18-28)25-8-4-3-5-9-25/h3-5,8-9,11,13,22,26,31H,2,6-7,10,12,14-21H2,1H3
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 0.740n/an/an/an/an/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human cloned dopamine D3 receptor expressed in HEK293 cells

J Med Chem 51: 101-17 (2008)


Article DOI: 10.1021/jm070860r
BindingDB Entry DOI: 10.7270/Q2VQ32FD
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))		BDBM50109927
PNG
((+)-7-[(4-(4-phenylpiperazin-1-yl)butyl)(propyl)am...)
Show SMILES CCCN(CCCCN1CCN(CC1)c1ccccc1)C1CCc2ccc(O)cc2C1
Show InChI InChI=1S/C27H39N3O/c1-2-14-29(26-12-10-23-11-13-27(31)22-24(23)21-26)16-7-6-15-28-17-19-30(20-18-28)25-8-4-3-5-9-25/h3-5,8-9,11,13,22,26,31H,2,6-7,10,12,14-21H2,1H3
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 0.740n/an/an/an/an/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human cloned dopamine D3 receptor expressed in HEK293 cells

J Med Chem 51: 101-17 (2008)


Article DOI: 10.1021/jm070860r
BindingDB Entry DOI: 10.7270/Q2VQ32FD
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))		BDBM50109931
PNG
((+)-7-{[4-(4-phenylpiperazin-1-yl)butyl]prop-2-yny...)
Show SMILES Oc1ccc2CCC(Cc2c1)N(CCCCN1CCN(CC1)c1ccccc1)CC#C
Show InChI InChI=1S/C27H35N3O/c1-2-14-29(26-12-10-23-11-13-27(31)22-24(23)21-26)16-7-6-15-28-17-19-30(20-18-28)25-8-4-3-5-9-25/h1,3-5,8-9,11,13,22,26,31H,6-7,10,12,14-21H2
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 0.760n/an/an/an/an/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human cloned dopamine D3 receptor expressed in HEK293 cells

J Med Chem 51: 101-17 (2008)


Article DOI: 10.1021/jm070860r
BindingDB Entry DOI: 10.7270/Q2VQ32FD
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))		BDBM50109931
PNG
((+)-7-{[4-(4-phenylpiperazin-1-yl)butyl]prop-2-yny...)
Show SMILES Oc1ccc2CCC(Cc2c1)N(CCCCN1CCN(CC1)c1ccccc1)CC#C
Show InChI InChI=1S/C27H35N3O/c1-2-14-29(26-12-10-23-11-13-27(31)22-24(23)21-26)16-7-6-15-28-17-19-30(20-18-28)25-8-4-3-5-9-25/h1,3-5,8-9,11,13,22,26,31H,6-7,10,12,14-21H2
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 0.760n/an/an/an/an/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human cloned dopamine D3 receptor expressed in HEK293 cells

J Med Chem 51: 101-17 (2008)


Article DOI: 10.1021/jm070860r
BindingDB Entry DOI: 10.7270/Q2VQ32FD
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))		BDBM50229775
PNG
((+)-6-[(2-(4-phenylpiperazin-1-yl)ethyl)(propyl)am...)
Show SMILES CCCN(CCN1CCN(CC1)c1ccccc1)C1CCc2c(O)cccc2C1 |w:18.19|
Show InChI InChI=1S/C25H35N3O/c1-2-13-27(23-11-12-24-21(20-23)7-6-10-25(24)29)17-14-26-15-18-28(19-16-26)22-8-4-3-5-9-22/h3-10,23,29H,2,11-20H2,1H3
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 0.800n/an/an/an/an/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human cloned dopamine D3 receptor expressed in HEK293 cells

J Med Chem 51: 101-17 (2008)


Article DOI: 10.1021/jm070860r
BindingDB Entry DOI: 10.7270/Q2VQ32FD
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))		BDBM50229775
PNG
((+)-6-[(2-(4-phenylpiperazin-1-yl)ethyl)(propyl)am...)
Show SMILES CCCN(CCN1CCN(CC1)c1ccccc1)C1CCc2c(O)cccc2C1 |w:18.19|
Show InChI InChI=1S/C25H35N3O/c1-2-13-27(23-11-12-24-21(20-23)7-6-10-25(24)29)17-14-26-15-18-28(19-16-26)22-8-4-3-5-9-22/h3-10,23,29H,2,11-20H2,1H3
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 0.820n/an/an/an/an/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human cloned dopamine D3 receptor expressed in HEK293 cells

J Med Chem 51: 101-17 (2008)


Article DOI: 10.1021/jm070860r
BindingDB Entry DOI: 10.7270/Q2VQ32FD
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))		BDBM50229775
PNG
((+)-6-[(2-(4-phenylpiperazin-1-yl)ethyl)(propyl)am...)
Show SMILES CCCN(CCN1CCN(CC1)c1ccccc1)C1CCc2c(O)cccc2C1 |w:18.19|
Show InChI InChI=1S/C25H35N3O/c1-2-13-27(23-11-12-24-21(20-23)7-6-10-25(24)29)17-14-26-15-18-28(19-16-26)22-8-4-3-5-9-22/h3-10,23,29H,2,11-20H2,1H3
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 0.820n/an/an/an/an/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human cloned dopamine D3 receptor expressed in HEK293 cells

J Med Chem 51: 101-17 (2008)


Article DOI: 10.1021/jm070860r
BindingDB Entry DOI: 10.7270/Q2VQ32FD
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))		BDBM50229778
PNG
(6-[(2-(4-phenylpiperazin-1-yl)ethyl)(propyl)amino]...)
Show SMILES CCCN(CCN1CCN(CC1)c1ccccc1)C1CCc2cc(O)c(O)cc2C1 |w:18.19|
Show InChI InChI=1S/C25H35N3O2/c1-2-10-27(23-9-8-20-18-24(29)25(30)19-21(20)17-23)14-11-26-12-15-28(16-13-26)22-6-4-3-5-7-22/h3-7,18-19,23,29-30H,2,8-17H2,1H3
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 1.39n/an/an/an/an/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human cloned dopamine D3 receptor expressed in HEK293 cells

J Med Chem 51: 101-17 (2008)


Article DOI: 10.1021/jm070860r
BindingDB Entry DOI: 10.7270/Q2VQ32FD
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))		BDBM50109926
PNG
(7-((2-(4-phenylpiperazin-1-yl)ethyl)(propyl)amino)...)
Show SMILES CCCN(CCN1CCN(CC1)c1ccccc1)C1CCc2ccc(O)cc2C1
Show InChI InChI=1S/C25H35N3O/c1-2-12-27(24-10-8-21-9-11-25(29)20-22(21)19-24)16-13-26-14-17-28(18-15-26)23-6-4-3-5-7-23/h3-7,9,11,20,24,29H,2,8,10,12-19H2,1H3
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 1.56n/an/an/an/an/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human cloned dopamine D3 receptor expressed in HEK293 cells

J Med Chem 51: 101-17 (2008)


Article DOI: 10.1021/jm070860r
BindingDB Entry DOI: 10.7270/Q2VQ32FD
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))		BDBM50054067
PNG
((2R)-7-Dipropylamino-5,6,7,8-tetrahydro-naphthalen...)
Show SMILES CCCN(CCC)[C@@H]1CCc2ccc(O)cc2C1
Show InChI InChI=1S/C16H25NO/c1-3-9-17(10-4-2)15-7-5-13-6-8-16(18)12-14(13)11-15/h6,8,12,15,18H,3-5,7,9-11H2,1-2H3/t15-/m1/s1
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 2.35n/an/an/an/an/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human cloned dopamine D3 receptor expressed in HEK293 cells

J Med Chem 51: 101-17 (2008)


Article DOI: 10.1021/jm070860r
BindingDB Entry DOI: 10.7270/Q2VQ32FD
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))		BDBM50229776
PNG
(6-[(2-(4-(2-methoxyphenyl)piperazin-1-yl)ethyl)(pr...)
Show SMILES CCCN(CCN1CCN(CC1)c1ccccc1OC)C1CCc2c(O)cccc2C1 |w:20.21|
Show InChI InChI=1S/C26H37N3O2/c1-3-13-28(22-11-12-23-21(20-22)7-6-9-25(23)30)17-14-27-15-18-29(19-16-27)24-8-4-5-10-26(24)31-2/h4-10,22,30H,3,11-20H2,1-2H3
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 2.80n/an/an/an/an/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human cloned dopamine D3 receptor expressed in HEK293 cells

J Med Chem 51: 101-17 (2008)


Article DOI: 10.1021/jm070860r
BindingDB Entry DOI: 10.7270/Q2VQ32FD
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))		BDBM50229782
PNG
(6-[(4-(4-phenylpiperazin-1-yl)butyl)(propyl)amino]...)
Show SMILES CCCN(CCCCN1CCN(CC1)c1ccccc1)C1CCc2cc(O)c(O)cc2C1 |w:20.21|
Show InChI InChI=1S/C27H39N3O2/c1-2-12-29(25-11-10-22-20-26(31)27(32)21-23(22)19-25)14-7-6-13-28-15-17-30(18-16-28)24-8-4-3-5-9-24/h3-5,8-9,20-21,25,31-32H,2,6-7,10-19H2,1H3
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 2.89n/an/an/an/an/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human cloned dopamine D3 receptor expressed in HEK293 cells

J Med Chem 51: 101-17 (2008)


Article DOI: 10.1021/jm070860r
BindingDB Entry DOI: 10.7270/Q2VQ32FD
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50229776
PNG
(6-[(2-(4-(2-methoxyphenyl)piperazin-1-yl)ethyl)(pr...)
Show SMILES CCCN(CCN1CCN(CC1)c1ccccc1OC)C1CCc2c(O)cccc2C1 |w:20.21|
Show InChI InChI=1S/C26H37N3O2/c1-3-13-28(22-11-12-23-21(20-22)7-6-9-25(23)30)17-14-27-15-18-29(19-16-27)24-8-4-5-10-26(24)31-2/h4-10,22,30H,3,11-20H2,1-2H3
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 9.56n/an/an/an/an/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human cloned dopamine D2L receptor expressed in HEK293 cells

J Med Chem 51: 101-17 (2008)


Article DOI: 10.1021/jm070860r
BindingDB Entry DOI: 10.7270/Q2VQ32FD
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50229776
PNG
(6-[(2-(4-(2-methoxyphenyl)piperazin-1-yl)ethyl)(pr...)
Show SMILES CCCN(CCN1CCN(CC1)c1ccccc1OC)C1CCc2c(O)cccc2C1 |w:20.21|
Show InChI InChI=1S/C26H37N3O2/c1-3-13-28(22-11-12-23-21(20-22)7-6-9-25(23)30)17-14-27-15-18-29(19-16-27)24-8-4-5-10-26(24)31-2/h4-10,22,30H,3,11-20H2,1-2H3
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 9.56n/an/an/an/an/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human cloned dopamine D2L receptor expressed in HEK293 cells

J Med Chem 51: 101-17 (2008)


Article DOI: 10.1021/jm070860r
BindingDB Entry DOI: 10.7270/Q2VQ32FD
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))		BDBM50229780
PNG
(7-[(3-(4-phenylpiperazin-1-yl)propyl)(propyl)amino...)
Show SMILES CCCN(CCCN1CCN(CC1)c1ccccc1)C1CCc2ccc(O)cc2C1 |w:19.20|
Show InChI InChI=1S/C26H37N3O/c1-2-13-28(25-11-9-22-10-12-26(30)21-23(22)20-25)15-6-14-27-16-18-29(19-17-27)24-7-4-3-5-8-24/h3-5,7-8,10,12,21,25,30H,2,6,9,11,13-20H2,1H3
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 10.3n/an/an/an/an/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human cloned dopamine D3 receptor expressed in HEK293 cells

J Med Chem 51: 101-17 (2008)


Article DOI: 10.1021/jm070860r
BindingDB Entry DOI: 10.7270/Q2VQ32FD
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))		BDBM50229784
PNG
(8-[(2-(4-phenylpiperazin-1-yl)ethyl)(propyl)amino]...)
Show SMILES CCCN(CCN1CCN(CC1)c1ccccc1)C1CCc2ccc3NC(=O)Cc3c2C1 |w:18.19|
Show InChI InChI=1S/C27H36N4O/c1-2-12-30(16-13-29-14-17-31(18-15-29)22-6-4-3-5-7-22)23-10-8-21-9-11-26-25(24(21)19-23)20-27(32)28-26/h3-7,9,11,23H,2,8,10,12-20H2,1H3,(H,28,32)
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 10.9n/an/an/an/an/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human cloned dopamine D3 receptor expressed in HEK293 cells

J Med Chem 51: 101-17 (2008)


Article DOI: 10.1021/jm070860r
BindingDB Entry DOI: 10.7270/Q2VQ32FD
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))		BDBM50229779
PNG
(6-[(2-(4-phenylpiperazin-1-yl)ethyl)(propyl)amino]...)
Show SMILES CCCN(CCN1CCN(CC1)c1ccccc1)C1CCc2cc(O)ccc2C1 |w:18.19|
Show InChI InChI=1S/C25H35N3O/c1-2-12-27(24-10-8-22-20-25(29)11-9-21(22)19-24)16-13-26-14-17-28(18-15-26)23-6-4-3-5-7-23/h3-7,9,11,20,24,29H,2,8,10,12-19H2,1H3
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 11.2n/an/an/an/an/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human cloned dopamine D3 receptor expressed in HEK293 cells

J Med Chem 51: 101-17 (2008)


Article DOI: 10.1021/jm070860r
BindingDB Entry DOI: 10.7270/Q2VQ32FD
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50229783
PNG
(6-[(2-(4-(2,3-dichlorophenyl)piperazin-1-yl)ethyl)...)
Show SMILES CCCN(CCN1CCN(CC1)c1cccc(Cl)c1Cl)C1CCc2c(O)cccc2C1 |w:20.21|
Show InChI InChI=1S/C25H33Cl2N3O/c1-2-11-29(20-9-10-21-19(18-20)5-3-8-24(21)31)15-12-28-13-16-30(17-14-28)23-7-4-6-22(26)25(23)27/h3-8,20,31H,2,9-18H2,1H3
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 14.6n/an/an/an/an/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human cloned dopamine D2L receptor expressed in HEK293 cells

J Med Chem 51: 101-17 (2008)


Article DOI: 10.1021/jm070860r
BindingDB Entry DOI: 10.7270/Q2VQ32FD
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50109927
PNG
((+)-7-[(4-(4-phenylpiperazin-1-yl)butyl)(propyl)am...)
Show SMILES CCCN(CCCCN1CCN(CC1)c1ccccc1)C1CCc2ccc(O)cc2C1
Show InChI InChI=1S/C27H39N3O/c1-2-14-29(26-12-10-23-11-13-27(31)22-24(23)21-26)16-7-6-15-28-17-19-30(20-18-28)25-8-4-3-5-9-25/h3-5,8-9,11,13,22,26,31H,2,6-7,10,12,14-21H2,1H3
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 19.3n/an/an/an/an/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human cloned dopamine D2L receptor expressed in HEK293 cells

J Med Chem 51: 101-17 (2008)


Article DOI: 10.1021/jm070860r
BindingDB Entry DOI: 10.7270/Q2VQ32FD
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50109927
PNG
((+)-7-[(4-(4-phenylpiperazin-1-yl)butyl)(propyl)am...)
Show SMILES CCCN(CCCCN1CCN(CC1)c1ccccc1)C1CCc2ccc(O)cc2C1
Show InChI InChI=1S/C27H39N3O/c1-2-14-29(26-12-10-23-11-13-27(31)22-24(23)21-26)16-7-6-15-28-17-19-30(20-18-28)25-8-4-3-5-9-25/h3-5,8-9,11,13,22,26,31H,2,6-7,10,12,14-21H2,1H3
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 19.4n/an/an/an/an/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human cloned dopamine D2L receptor expressed in HEK293 cells

J Med Chem 51: 101-17 (2008)


Article DOI: 10.1021/jm070860r
BindingDB Entry DOI: 10.7270/Q2VQ32FD
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50229782
PNG
(6-[(4-(4-phenylpiperazin-1-yl)butyl)(propyl)amino]...)
Show SMILES CCCN(CCCCN1CCN(CC1)c1ccccc1)C1CCc2cc(O)c(O)cc2C1 |w:20.21|
Show InChI InChI=1S/C27H39N3O2/c1-2-12-29(25-11-10-22-20-26(31)27(32)21-23(22)19-25)14-7-6-13-28-15-17-30(18-16-28)24-8-4-3-5-9-24/h3-5,8-9,20-21,25,31-32H,2,6-7,10-19H2,1H3
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 21.7n/an/an/an/an/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human cloned dopamine D2L receptor expressed in HEK293 cells

J Med Chem 51: 101-17 (2008)


Article DOI: 10.1021/jm070860r
BindingDB Entry DOI: 10.7270/Q2VQ32FD
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))		BDBM50229781
PNG
(CHEMBL252342 | N2-[2-(4-phenylpiperazin-1-yl)ethyl...)
Show SMILES CCCN(CCN1CCN(CC1)c1ccccc1)C1CCc2ccc(N)cc2C1 |w:18.19|
Show InChI InChI=1S/C25H36N4/c1-2-12-28(25-11-9-21-8-10-23(26)19-22(21)20-25)16-13-27-14-17-29(18-15-27)24-6-4-3-5-7-24/h3-8,10,19,25H,2,9,11-18,20,26H2,1H3
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 22.2n/an/an/an/an/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human cloned dopamine D3 receptor expressed in HEK293 cells

J Med Chem 51: 101-17 (2008)


Article DOI: 10.1021/jm070860r
BindingDB Entry DOI: 10.7270/Q2VQ32FD
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))		BDBM50229777
PNG
(7-[(2-(4-phenylpiperazin-1-yl)ethyl)(2-(thiophen-2...)
Show SMILES Oc1ccc2CCC(Cc2c1)N(CCN1CCN(CC1)c1ccccc1)CCc1cccs1 |w:7.12|
Show InChI InChI=1S/C28H35N3OS/c32-27-11-9-23-8-10-26(21-24(23)22-27)30(13-12-28-7-4-20-33-28)17-14-29-15-18-31(19-16-29)25-5-2-1-3-6-25/h1-7,9,11,20,22,26,32H,8,10,12-19,21H2
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 23.9n/an/an/an/an/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human cloned dopamine D3 receptor expressed in HEK293 cells

J Med Chem 51: 101-17 (2008)


Article DOI: 10.1021/jm070860r
BindingDB Entry DOI: 10.7270/Q2VQ32FD
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50229777
PNG
(7-[(2-(4-phenylpiperazin-1-yl)ethyl)(2-(thiophen-2...)
Show SMILES Oc1ccc2CCC(Cc2c1)N(CCN1CCN(CC1)c1ccccc1)CCc1cccs1 |w:7.12|
Show InChI InChI=1S/C28H35N3OS/c32-27-11-9-23-8-10-26(21-24(23)22-27)30(13-12-28-7-4-20-33-28)17-14-29-15-18-31(19-16-29)25-5-2-1-3-6-25/h1-7,9,11,20,22,26,32H,8,10,12-19,21H2
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 24.6n/an/an/an/an/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human cloned dopamine D2L receptor expressed in HEK293 cells

J Med Chem 51: 101-17 (2008)


Article DOI: 10.1021/jm070860r
BindingDB Entry DOI: 10.7270/Q2VQ32FD
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50229775
PNG
((+)-6-[(2-(4-phenylpiperazin-1-yl)ethyl)(propyl)am...)
Show SMILES CCCN(CCN1CCN(CC1)c1ccccc1)C1CCc2c(O)cccc2C1 |w:18.19|
Show InChI InChI=1S/C25H35N3O/c1-2-13-27(23-11-12-24-21(20-23)7-6-10-25(24)29)17-14-26-15-18-28(19-16-26)22-8-4-3-5-9-22/h3-10,23,29H,2,11-20H2,1H3
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 26n/an/an/an/an/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human cloned dopamine D2L receptor expressed in HEK293 cells

J Med Chem 51: 101-17 (2008)


Article DOI: 10.1021/jm070860r
BindingDB Entry DOI: 10.7270/Q2VQ32FD
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50229775
PNG
((+)-6-[(2-(4-phenylpiperazin-1-yl)ethyl)(propyl)am...)
Show SMILES CCCN(CCN1CCN(CC1)c1ccccc1)C1CCc2c(O)cccc2C1 |w:18.19|
Show InChI InChI=1S/C25H35N3O/c1-2-13-27(23-11-12-24-21(20-23)7-6-10-25(24)29)17-14-26-15-18-28(19-16-26)22-8-4-3-5-9-22/h3-10,23,29H,2,11-20H2,1H3
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 26n/an/an/an/an/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human cloned dopamine D2L receptor expressed in HEK293 cells

J Med Chem 51: 101-17 (2008)


Article DOI: 10.1021/jm070860r
BindingDB Entry DOI: 10.7270/Q2VQ32FD
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50109931
PNG
((+)-7-{[4-(4-phenylpiperazin-1-yl)butyl]prop-2-yny...)
Show SMILES Oc1ccc2CCC(Cc2c1)N(CCCCN1CCN(CC1)c1ccccc1)CC#C
Show InChI InChI=1S/C27H35N3O/c1-2-14-29(26-12-10-23-11-13-27(31)22-24(23)21-26)16-7-6-15-28-17-19-30(20-18-28)25-8-4-3-5-9-25/h1,3-5,8-9,11,13,22,26,31H,6-7,10,12,14-21H2
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 32.9n/an/an/an/an/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human cloned dopamine D2L receptor expressed in HEK293 cells

J Med Chem 51: 101-17 (2008)


Article DOI: 10.1021/jm070860r
BindingDB Entry DOI: 10.7270/Q2VQ32FD
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50109931
PNG
((+)-7-{[4-(4-phenylpiperazin-1-yl)butyl]prop-2-yny...)
Show SMILES Oc1ccc2CCC(Cc2c1)N(CCCCN1CCN(CC1)c1ccccc1)CC#C
Show InChI InChI=1S/C27H35N3O/c1-2-14-29(26-12-10-23-11-13-27(31)22-24(23)21-26)16-7-6-15-28-17-19-30(20-18-28)25-8-4-3-5-9-25/h1,3-5,8-9,11,13,22,26,31H,6-7,10,12,14-21H2
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 32.9n/an/an/an/an/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human cloned dopamine D2L receptor expressed in HEK293 cells

J Med Chem 51: 101-17 (2008)


Article DOI: 10.1021/jm070860r
BindingDB Entry DOI: 10.7270/Q2VQ32FD
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50229776
PNG
(6-[(2-(4-(2-methoxyphenyl)piperazin-1-yl)ethyl)(pr...)
Show SMILES CCCN(CCN1CCN(CC1)c1ccccc1OC)C1CCc2c(O)cccc2C1 |w:20.21|
Show InChI InChI=1S/C26H37N3O2/c1-3-13-28(22-11-12-23-21(20-22)7-6-9-25(23)30)17-14-27-15-18-29(19-16-27)24-8-4-5-10-26(24)31-2/h4-10,22,30H,3,11-20H2,1-2H3
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 35.8n/an/an/an/an/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human cloned dopamine D2L receptor expressed in HEK293 cells

J Med Chem 51: 101-17 (2008)


Article DOI: 10.1021/jm070860r
BindingDB Entry DOI: 10.7270/Q2VQ32FD
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50229778
PNG
(6-[(2-(4-phenylpiperazin-1-yl)ethyl)(propyl)amino]...)
Show SMILES CCCN(CCN1CCN(CC1)c1ccccc1)C1CCc2cc(O)c(O)cc2C1 |w:18.19|
Show InChI InChI=1S/C25H35N3O2/c1-2-10-27(23-9-8-20-18-24(29)25(30)19-21(20)17-23)14-11-26-12-15-28(16-13-26)22-6-4-3-5-7-22/h3-7,18-19,23,29-30H,2,8-17H2,1H3
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 70.3n/an/an/an/an/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human cloned dopamine D2L receptor expressed in HEK293 cells

J Med Chem 51: 101-17 (2008)


Article DOI: 10.1021/jm070860r
BindingDB Entry DOI: 10.7270/Q2VQ32FD
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50229784
PNG
(8-[(2-(4-phenylpiperazin-1-yl)ethyl)(propyl)amino]...)
Show SMILES CCCN(CCN1CCN(CC1)c1ccccc1)C1CCc2ccc3NC(=O)Cc3c2C1 |w:18.19|
Show InChI InChI=1S/C27H36N4O/c1-2-12-30(16-13-29-14-17-31(18-15-29)22-6-4-3-5-7-22)23-10-8-21-9-11-26-25(24(21)19-23)20-27(32)28-26/h3-7,9,11,23H,2,8,10,12-20H2,1H3,(H,28,32)
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 90.6n/an/an/an/an/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human cloned dopamine D2L receptor expressed in HEK293 cells

J Med Chem 51: 101-17 (2008)


Article DOI: 10.1021/jm070860r
BindingDB Entry DOI: 10.7270/Q2VQ32FD
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50109926
PNG
(7-((2-(4-phenylpiperazin-1-yl)ethyl)(propyl)amino)...)
Show SMILES CCCN(CCN1CCN(CC1)c1ccccc1)C1CCc2ccc(O)cc2C1
Show InChI InChI=1S/C25H35N3O/c1-2-12-27(24-10-8-21-9-11-25(29)20-22(21)19-24)16-13-26-14-17-28(18-15-26)23-6-4-3-5-7-23/h3-7,9,11,20,24,29H,2,8,10,12-19H2,1H3
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 142n/an/an/an/an/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human cloned dopamine D2L receptor expressed in HEK293 cells

J Med Chem 51: 101-17 (2008)


Article DOI: 10.1021/jm070860r
BindingDB Entry DOI: 10.7270/Q2VQ32FD
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50229780
PNG
(7-[(3-(4-phenylpiperazin-1-yl)propyl)(propyl)amino...)
Show SMILES CCCN(CCCN1CCN(CC1)c1ccccc1)C1CCc2ccc(O)cc2C1 |w:19.20|
Show InChI InChI=1S/C26H37N3O/c1-2-13-28(25-11-9-22-10-12-26(30)21-23(22)20-25)15-6-14-27-16-18-29(19-17-27)24-7-4-3-5-8-24/h3-5,7-8,10,12,21,25,30H,2,6,9,11,13-20H2,1H3
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 167n/an/an/an/an/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human cloned dopamine D2L receptor expressed in HEK293 cells

J Med Chem 51: 101-17 (2008)


Article DOI: 10.1021/jm070860r
BindingDB Entry DOI: 10.7270/Q2VQ32FD
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50054067
PNG
((2R)-7-Dipropylamino-5,6,7,8-tetrahydro-naphthalen...)
Show SMILES CCCN(CCC)[C@@H]1CCc2ccc(O)cc2C1
Show InChI InChI=1S/C16H25NO/c1-3-9-17(10-4-2)15-7-5-13-6-8-16(18)12-14(13)11-15/h6,8,12,15,18H,3-5,7,9-11H2,1-2H3/t15-/m1/s1
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 202n/an/an/an/an/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human cloned dopamine D2L receptor expressed in HEK293 cells

J Med Chem 51: 101-17 (2008)


Article DOI: 10.1021/jm070860r
BindingDB Entry DOI: 10.7270/Q2VQ32FD
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50229775
PNG
((+)-6-[(2-(4-phenylpiperazin-1-yl)ethyl)(propyl)am...)
Show SMILES CCCN(CCN1CCN(CC1)c1ccccc1)C1CCc2c(O)cccc2C1 |w:18.19|
Show InChI InChI=1S/C25H35N3O/c1-2-13-27(23-11-12-24-21(20-23)7-6-10-25(24)29)17-14-26-15-18-28(19-16-26)22-8-4-3-5-9-22/h3-10,23,29H,2,11-20H2,1H3
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 238n/an/an/an/an/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human cloned dopamine D2L receptor expressed in HEK293 cells

J Med Chem 51: 101-17 (2008)


Article DOI: 10.1021/jm070860r
BindingDB Entry DOI: 10.7270/Q2VQ32FD
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50229781
PNG
(CHEMBL252342 | N2-[2-(4-phenylpiperazin-1-yl)ethyl...)
Show SMILES CCCN(CCN1CCN(CC1)c1ccccc1)C1CCc2ccc(N)cc2C1 |w:18.19|
Show InChI InChI=1S/C25H36N4/c1-2-12-28(25-11-9-21-8-10-23(26)19-22(21)20-25)16-13-27-14-17-29(18-15-27)24-6-4-3-5-7-24/h3-8,10,19,25H,2,9,11-18,20,26H2,1H3
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 638n/an/an/an/an/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human cloned dopamine D2L receptor expressed in HEK293 cells

J Med Chem 51: 101-17 (2008)


Article DOI: 10.1021/jm070860r
BindingDB Entry DOI: 10.7270/Q2VQ32FD
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50229779
PNG
(6-[(2-(4-phenylpiperazin-1-yl)ethyl)(propyl)amino]...)
Show SMILES CCCN(CCN1CCN(CC1)c1ccccc1)C1CCc2cc(O)ccc2C1 |w:18.19|
Show InChI InChI=1S/C25H35N3O/c1-2-12-27(24-10-8-22-20-25(29)11-9-21(22)19-24)16-13-26-14-17-28(18-15-26)23-6-4-3-5-7-23/h3-7,9,11,20,24,29H,2,8,10,12-19H2,1H3
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 649n/an/an/an/an/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human cloned dopamine D2L receptor expressed in HEK293 cells

J Med Chem 51: 101-17 (2008)


Article DOI: 10.1021/jm070860r
BindingDB Entry DOI: 10.7270/Q2VQ32FD
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))		BDBM50229775
PNG
((+)-6-[(2-(4-phenylpiperazin-1-yl)ethyl)(propyl)am...)
Show SMILES CCCN(CCN1CCN(CC1)c1ccccc1)C1CCc2c(O)cccc2C1 |w:18.19|
Show InChI InChI=1S/C25H35N3O/c1-2-13-27(23-11-12-24-21(20-23)7-6-10-25(24)29)17-14-26-15-18-28(19-16-26)22-8-4-3-5-9-22/h3-10,23,29H,2,11-20H2,1H3
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n/an/an/an/a 0.120n/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Agonist activity at human cloned dopamine D3 receptor expressed in AtT-20 cells assessed as stimulation of [35S]GTPgammaS binding

J Med Chem 51: 101-17 (2008)


Article DOI: 10.1021/jm070860r
BindingDB Entry DOI: 10.7270/Q2VQ32FD
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50109926
PNG
(7-((2-(4-phenylpiperazin-1-yl)ethyl)(propyl)amino)...)
Show SMILES CCCN(CCN1CCN(CC1)c1ccccc1)C1CCc2ccc(O)cc2C1
Show InChI InChI=1S/C25H35N3O/c1-2-12-27(24-10-8-21-9-11-25(29)20-22(21)19-24)16-13-26-14-17-28(18-15-26)23-6-4-3-5-7-23/h3-7,9,11,20,24,29H,2,8,10,12-19H2,1H3
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n/an/an/an/a 12.2n/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Agonist activity at human cloned dopamine D2L receptor expressed in CHO cells assessed as stimulation of [35S]GTPgammaS binding

J Med Chem 51: 101-17 (2008)


Article DOI: 10.1021/jm070860r
BindingDB Entry DOI: 10.7270/Q2VQ32FD
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50229776
PNG
(6-[(2-(4-(2-methoxyphenyl)piperazin-1-yl)ethyl)(pr...)
Show SMILES CCCN(CCN1CCN(CC1)c1ccccc1OC)C1CCc2c(O)cccc2C1 |w:20.21|
Show InChI InChI=1S/C26H37N3O2/c1-3-13-28(22-11-12-23-21(20-22)7-6-9-25(23)30)17-14-27-15-18-29(19-16-27)24-8-4-5-10-26(24)31-2/h4-10,22,30H,3,11-20H2,1-2H3
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n/an/an/an/a 1.56n/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Agonist activity at human cloned dopamine D2L receptor expressed in CHO cells assessed as stimulation of [35S]GTPgammaS binding

J Med Chem 51: 101-17 (2008)


Article DOI: 10.1021/jm070860r
BindingDB Entry DOI: 10.7270/Q2VQ32FD
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50229775
PNG
((+)-6-[(2-(4-phenylpiperazin-1-yl)ethyl)(propyl)am...)
Show SMILES CCCN(CCN1CCN(CC1)c1ccccc1)C1CCc2c(O)cccc2C1 |w:18.19|
Show InChI InChI=1S/C25H35N3O/c1-2-13-27(23-11-12-24-21(20-23)7-6-10-25(24)29)17-14-26-15-18-28(19-16-26)22-8-4-3-5-9-22/h3-10,23,29H,2,11-20H2,1H3
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n/an/an/an/a 2.22n/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Agonist activity at human cloned dopamine D2L receptor expressed in CHO cells assessed as stimulation of [35S]GTPgammaS binding

J Med Chem 51: 101-17 (2008)


Article DOI: 10.1021/jm070860r
BindingDB Entry DOI: 10.7270/Q2VQ32FD
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))		BDBM50229776
PNG
(6-[(2-(4-(2-methoxyphenyl)piperazin-1-yl)ethyl)(pr...)
Show SMILES CCCN(CCN1CCN(CC1)c1ccccc1OC)C1CCc2c(O)cccc2C1 |w:20.21|
Show InChI InChI=1S/C26H37N3O2/c1-3-13-28(22-11-12-23-21(20-22)7-6-9-25(23)30)17-14-27-15-18-29(19-16-27)24-8-4-5-10-26(24)31-2/h4-10,22,30H,3,11-20H2,1-2H3
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n/an/an/an/a 0.0800n/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Agonist activity at human cloned dopamine D3 receptor expressed in AtT-20 cells assessed as stimulation of [35S]GTPgammaS binding

J Med Chem 51: 101-17 (2008)


Article DOI: 10.1021/jm070860r
BindingDB Entry DOI: 10.7270/Q2VQ32FD
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))		BDBM55121
PNG
(3-HYDROXYTYRAMINE HYDROCHLORIDE | 4-(2-aminoethyl)...)
Show SMILES NCCc1ccc(O)c(O)c1
Show InChI InChI=1S/C8H11NO2/c9-4-3-6-1-2-7(10)8(11)5-6/h1-2,5,10-11H,3-4,9H2
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n/an/an/an/a 8.53n/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Agonist activity at human cloned dopamine D3 receptor expressed in AtT-20 cells assessed as stimulation of [35S]GTPgammaS binding

J Med Chem 51: 101-17 (2008)


Article DOI: 10.1021/jm070860r
BindingDB Entry DOI: 10.7270/Q2VQ32FD
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))		BDBM50109926
PNG
(7-((2-(4-phenylpiperazin-1-yl)ethyl)(propyl)amino)...)
Show SMILES CCCN(CCN1CCN(CC1)c1ccccc1)C1CCc2ccc(O)cc2C1
Show InChI InChI=1S/C25H35N3O/c1-2-12-27(24-10-8-21-9-11-25(29)20-22(21)19-24)16-13-26-14-17-28(18-15-26)23-6-4-3-5-7-23/h3-7,9,11,20,24,29H,2,8,10,12-19H2,1H3
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n/an/an/an/a 0.690n/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Agonist activity at human cloned dopamine D3 receptor expressed in AtT-20 cells assessed as stimulation of [35S]GTPgammaS binding

J Med Chem 51: 101-17 (2008)


Article DOI: 10.1021/jm070860r
BindingDB Entry DOI: 10.7270/Q2VQ32FD
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM55121
PNG
(3-HYDROXYTYRAMINE HYDROCHLORIDE | 4-(2-aminoethyl)...)
Show SMILES NCCc1ccc(O)c(O)c1
Show InChI InChI=1S/C8H11NO2/c9-4-3-6-1-2-7(10)8(11)5-6/h1-2,5,10-11H,3-4,9H2
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n/an/an/an/a 209n/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Agonist activity at human cloned dopamine D2L receptor expressed in CHO cells assessed as stimulation of [35S]GTPgammaS binding

J Med Chem 51: 101-17 (2008)


Article DOI: 10.1021/jm070860r
BindingDB Entry DOI: 10.7270/Q2VQ32FD
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%