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Compile Data Set for Download or QSAR

Found 24 hits with Last Name = 'el sayed' and Initial = 'o'   
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(1B) dopamine receptor


(Homo sapiens (Human))
BDBM50313917
PNG
(6-Methyl-5,6,7,8,13,15-hexahydro-4H-indolo[4,3a,3-...)
Show SMILES CN1CCc2ccccc2Cc2c[nH]c3cccc(CC1)c23
Show InChI InChI=1S/C20H22N2/c1-22-11-9-15-5-2-3-6-17(15)13-18-14-21-19-8-4-7-16(10-12-22)20(18)19/h2-8,14,21H,9-13H2,1H3
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2.5n/an/an/an/an/an/an/an/a



Friedrich-Schiller-Universit£t Jena

Curated by ChEMBL


Assay Description
Displacement of [3H]radioligand from human recombinant dopamine D5 receptor expressed in HEK293 cells by microplate scintillation counting


J Med Chem 53: 2646-50 (2010)


Article DOI: 10.1021/jm901291r
BindingDB Entry DOI: 10.7270/Q2SJ1KRJ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50313917
PNG
(6-Methyl-5,6,7,8,13,15-hexahydro-4H-indolo[4,3a,3-...)
Show SMILES CN1CCc2ccccc2Cc2c[nH]c3cccc(CC1)c23
Show InChI InChI=1S/C20H22N2/c1-22-11-9-15-5-2-3-6-17(15)13-18-14-21-19-8-4-7-16(10-12-22)20(18)19/h2-8,14,21H,9-13H2,1H3
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4n/an/an/an/an/an/an/an/a



Friedrich-Schiller-Universit£t Jena

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human recombinant dopamine D2L receptor expressed in HEK293 cells by microplate scintillation counting


J Med Chem 53: 2646-50 (2010)


Article DOI: 10.1021/jm901291r
BindingDB Entry DOI: 10.7270/Q2SJ1KRJ
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(Homo sapiens (Human))
BDBM50313917
PNG
(6-Methyl-5,6,7,8,13,15-hexahydro-4H-indolo[4,3a,3-...)
Show SMILES CN1CCc2ccccc2Cc2c[nH]c3cccc(CC1)c23
Show InChI InChI=1S/C20H22N2/c1-22-11-9-15-5-2-3-6-17(15)13-18-14-21-19-8-4-7-16(10-12-22)20(18)19/h2-8,14,21H,9-13H2,1H3
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4.20n/an/an/an/an/an/an/an/a



Friedrich-Schiller-Universit£t Jena

Curated by ChEMBL


Assay Description
Displacement of [3H]SCH23390 from human recombinant dopamine D1 receptor expressed in HEK293 cells by microplate scintillation counting


J Med Chem 53: 2646-50 (2010)


Article DOI: 10.1021/jm901291r
BindingDB Entry DOI: 10.7270/Q2SJ1KRJ
More data for this
Ligand-Target Pair
D(1B) dopamine receptor


(Homo sapiens (Human))
BDBM50313916
PNG
(7-Methyl-6,7,8,9,10,15-hexahydroindolo[2,3-f][3]be...)
Show SMILES CN1CCc2[nH]c3ccccc3c2Cc2ccccc2CC1
Show InChI InChI=1S/C20H22N2/c1-22-12-10-15-6-2-3-7-16(15)14-18-17-8-4-5-9-19(17)21-20(18)11-13-22/h2-9,21H,10-14H2,1H3
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10.3n/an/an/an/an/an/an/an/a



Friedrich-Schiller-Universit£t Jena

Curated by ChEMBL


Assay Description
Displacement of [3H]radioligand from human recombinant dopamine D5 receptor expressed in HEK293 cells by microplate scintillation counting


J Med Chem 53: 2646-50 (2010)


Article DOI: 10.1021/jm901291r
BindingDB Entry DOI: 10.7270/Q2SJ1KRJ
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(Homo sapiens (Human))
BDBM50313916
PNG
(7-Methyl-6,7,8,9,10,15-hexahydroindolo[2,3-f][3]be...)
Show SMILES CN1CCc2[nH]c3ccccc3c2Cc2ccccc2CC1
Show InChI InChI=1S/C20H22N2/c1-22-12-10-15-6-2-3-7-16(15)14-18-17-8-4-5-9-19(17)21-20(18)11-13-22/h2-9,21H,10-14H2,1H3
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28.5n/an/an/an/an/an/an/an/a



Friedrich-Schiller-Universit£t Jena

Curated by ChEMBL


Assay Description
Displacement of [3H]SCH23390 from human recombinant dopamine D1 receptor expressed in HEK293 cells by microplate scintillation counting


J Med Chem 53: 2646-50 (2010)


Article DOI: 10.1021/jm901291r
BindingDB Entry DOI: 10.7270/Q2SJ1KRJ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50313917
PNG
(6-Methyl-5,6,7,8,13,15-hexahydro-4H-indolo[4,3a,3-...)
Show SMILES CN1CCc2ccccc2Cc2c[nH]c3cccc(CC1)c23
Show InChI InChI=1S/C20H22N2/c1-22-11-9-15-5-2-3-6-17(15)13-18-14-21-19-8-4-7-16(10-12-22)20(18)19/h2-8,14,21H,9-13H2,1H3
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42.9n/an/an/an/an/an/an/an/a



Friedrich-Schiller-Universit£t Jena

Curated by ChEMBL


Assay Description
Displacement of [3H]radioligand from human recombinant dopamine D3 receptor expressed in HEK293 cells by microplate scintillation counting


J Med Chem 53: 2646-50 (2010)


Article DOI: 10.1021/jm901291r
BindingDB Entry DOI: 10.7270/Q2SJ1KRJ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50313916
PNG
(7-Methyl-6,7,8,9,10,15-hexahydroindolo[2,3-f][3]be...)
Show SMILES CN1CCc2[nH]c3ccccc3c2Cc2ccccc2CC1
Show InChI InChI=1S/C20H22N2/c1-22-12-10-15-6-2-3-7-16(15)14-18-17-8-4-5-9-19(17)21-20(18)11-13-22/h2-9,21H,10-14H2,1H3
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55.1n/an/an/an/an/an/an/an/a



Friedrich-Schiller-Universit£t Jena

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human recombinant dopamine D2L receptor expressed in HEK293 cells by microplate scintillation counting


J Med Chem 53: 2646-50 (2010)


Article DOI: 10.1021/jm901291r
BindingDB Entry DOI: 10.7270/Q2SJ1KRJ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50313916
PNG
(7-Methyl-6,7,8,9,10,15-hexahydroindolo[2,3-f][3]be...)
Show SMILES CN1CCc2[nH]c3ccccc3c2Cc2ccccc2CC1
Show InChI InChI=1S/C20H22N2/c1-22-12-10-15-6-2-3-7-16(15)14-18-17-8-4-5-9-19(17)21-20(18)11-13-22/h2-9,21H,10-14H2,1H3
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513n/an/an/an/an/an/an/an/a



Friedrich-Schiller-Universit£t Jena

Curated by ChEMBL


Assay Description
Displacement of [3H]radioligand from human recombinant dopamine D3 receptor expressed in HEK293 cells by microplate scintillation counting


J Med Chem 53: 2646-50 (2010)


Article DOI: 10.1021/jm901291r
BindingDB Entry DOI: 10.7270/Q2SJ1KRJ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50313913
PNG
(5,6,8,9,10,14c-Hexahydroindolo[3',2':3,4,]pyrido[2...)
Show SMILES C1Cc2[nH]c3ccccc3c2C2N1CCc1ccccc21
Show InChI InChI=1S/C19H18N2/c1-2-6-14-13(5-1)9-11-21-12-10-17-18(19(14)21)15-7-3-4-8-16(15)20-17/h1-8,19-20H,9-12H2
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1.48E+3n/an/an/an/an/an/an/an/a



Friedrich-Schiller-Universit£t Jena

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human recombinant dopamine D2L receptor expressed in HEK293 cells by microplate scintillation counting


J Med Chem 53: 2646-50 (2010)


Article DOI: 10.1021/jm901291r
BindingDB Entry DOI: 10.7270/Q2SJ1KRJ
More data for this
Ligand-Target Pair
D(1B) dopamine receptor


(Homo sapiens (Human))
BDBM50313914
PNG
(2,6,7,9,10,14b-Hexahydroindolo[3',4':3,4,5]azepino...)
Show SMILES C1Cc2ccccc2C2N1CCc1cccc3[nH]cc2c13
Show InChI InChI=1S/C19H18N2/c1-2-6-15-13(4-1)8-10-21-11-9-14-5-3-7-17-18(14)16(12-20-17)19(15)21/h1-7,12,19-20H,8-11H2
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1.53E+3n/an/an/an/an/an/an/an/a



Friedrich-Schiller-Universit£t Jena

Curated by ChEMBL


Assay Description
Displacement of [3H]radioligand from human recombinant dopamine D5 receptor expressed in HEK293 cells by microplate scintillation counting


J Med Chem 53: 2646-50 (2010)


Article DOI: 10.1021/jm901291r
BindingDB Entry DOI: 10.7270/Q2SJ1KRJ
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(Homo sapiens (Human))
BDBM50313914
PNG
(2,6,7,9,10,14b-Hexahydroindolo[3',4':3,4,5]azepino...)
Show SMILES C1Cc2ccccc2C2N1CCc1cccc3[nH]cc2c13
Show InChI InChI=1S/C19H18N2/c1-2-6-15-13(4-1)8-10-21-11-9-14-5-3-7-17-18(14)16(12-20-17)19(15)21/h1-7,12,19-20H,8-11H2
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1.84E+3n/an/an/an/an/an/an/an/a



Friedrich-Schiller-Universit£t Jena

Curated by ChEMBL


Assay Description
Displacement of [3H]SCH23390 from human recombinant dopamine D1 receptor expressed in HEK293 cells by microplate scintillation counting


J Med Chem 53: 2646-50 (2010)


Article DOI: 10.1021/jm901291r
BindingDB Entry DOI: 10.7270/Q2SJ1KRJ
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(Homo sapiens (Human))
BDBM50313913
PNG
(5,6,8,9,10,14c-Hexahydroindolo[3',2':3,4,]pyrido[2...)
Show SMILES C1Cc2[nH]c3ccccc3c2C2N1CCc1ccccc21
Show InChI InChI=1S/C19H18N2/c1-2-6-14-13(5-1)9-11-21-12-10-17-18(19(14)21)15-7-3-4-8-16(15)20-17/h1-8,19-20H,9-12H2
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2.10E+3n/an/an/an/an/an/an/an/a



Friedrich-Schiller-Universit£t Jena

Curated by ChEMBL


Assay Description
Displacement of [3H]SCH23390 from human recombinant dopamine D1 receptor expressed in HEK293 cells by microplate scintillation counting


J Med Chem 53: 2646-50 (2010)


Article DOI: 10.1021/jm901291r
BindingDB Entry DOI: 10.7270/Q2SJ1KRJ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50313914
PNG
(2,6,7,9,10,14b-Hexahydroindolo[3',4':3,4,5]azepino...)
Show SMILES C1Cc2ccccc2C2N1CCc1cccc3[nH]cc2c13
Show InChI InChI=1S/C19H18N2/c1-2-6-15-13(4-1)8-10-21-11-9-14-5-3-7-17-18(14)16(12-20-17)19(15)21/h1-7,12,19-20H,8-11H2
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4.46E+3n/an/an/an/an/an/an/an/a



Friedrich-Schiller-Universit£t Jena

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human recombinant dopamine D2L receptor expressed in HEK293 cells by microplate scintillation counting


J Med Chem 53: 2646-50 (2010)


Article DOI: 10.1021/jm901291r
BindingDB Entry DOI: 10.7270/Q2SJ1KRJ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50313918
PNG
(5-Methyl-4,5,6,7-tetrahydroindolo[4,3a,3-ef][3]ben...)
Show SMILES CN1CCc2ccccc2Cc2c[nH]c3cccc(C1)c23
Show InChI InChI=1S/C19H20N2/c1-21-10-9-14-5-2-3-6-15(14)11-17-12-20-18-8-4-7-16(13-21)19(17)18/h2-8,12,20H,9-11,13H2,1H3
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>1.00E+4n/an/an/an/an/an/an/an/a



Friedrich-Schiller-Universit£t Jena

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human recombinant dopamine D2L receptor expressed in HEK293 cells by microplate scintillation counting


J Med Chem 53: 2646-50 (2010)


Article DOI: 10.1021/jm901291r
BindingDB Entry DOI: 10.7270/Q2SJ1KRJ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50313918
PNG
(5-Methyl-4,5,6,7-tetrahydroindolo[4,3a,3-ef][3]ben...)
Show SMILES CN1CCc2ccccc2Cc2c[nH]c3cccc(C1)c23
Show InChI InChI=1S/C19H20N2/c1-21-10-9-14-5-2-3-6-15(14)11-17-12-20-18-8-4-7-16(13-21)19(17)18/h2-8,12,20H,9-11,13H2,1H3
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>1.00E+4n/an/an/an/an/an/an/an/a



Friedrich-Schiller-Universit£t Jena

Curated by ChEMBL


Assay Description
Displacement of [3H]radioligand from human recombinant dopamine D3 receptor expressed in HEK293 cells by microplate scintillation counting


J Med Chem 53: 2646-50 (2010)


Article DOI: 10.1021/jm901291r
BindingDB Entry DOI: 10.7270/Q2SJ1KRJ
More data for this
Ligand-Target Pair
D(1B) dopamine receptor


(Homo sapiens (Human))
BDBM50313918
PNG
(5-Methyl-4,5,6,7-tetrahydroindolo[4,3a,3-ef][3]ben...)
Show SMILES CN1CCc2ccccc2Cc2c[nH]c3cccc(C1)c23
Show InChI InChI=1S/C19H20N2/c1-21-10-9-14-5-2-3-6-15(14)11-17-12-20-18-8-4-7-16(13-21)19(17)18/h2-8,12,20H,9-11,13H2,1H3
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>1.00E+4n/an/an/an/an/an/an/an/a



Friedrich-Schiller-Universit£t Jena

Curated by ChEMBL


Assay Description
Displacement of [3H]radioligand from human recombinant dopamine D5 receptor expressed in HEK293 cells by microplate scintillation counting


J Med Chem 53: 2646-50 (2010)


Article DOI: 10.1021/jm901291r
BindingDB Entry DOI: 10.7270/Q2SJ1KRJ
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(Homo sapiens (Human))
BDBM50313918
PNG
(5-Methyl-4,5,6,7-tetrahydroindolo[4,3a,3-ef][3]ben...)
Show SMILES CN1CCc2ccccc2Cc2c[nH]c3cccc(C1)c23
Show InChI InChI=1S/C19H20N2/c1-21-10-9-14-5-2-3-6-15(14)11-17-12-20-18-8-4-7-16(13-21)19(17)18/h2-8,12,20H,9-11,13H2,1H3
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>1.00E+4n/an/an/an/an/an/an/an/a



Friedrich-Schiller-Universit£t Jena

Curated by ChEMBL


Assay Description
Displacement of [3H]SCH23390 from human recombinant dopamine D1 receptor expressed in HEK293 cells by microplate scintillation counting


J Med Chem 53: 2646-50 (2010)


Article DOI: 10.1021/jm901291r
BindingDB Entry DOI: 10.7270/Q2SJ1KRJ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50313915
PNG
(2,8,9,13b-Tetrahydro-6H-isoquino[2,1-b]pyrrolo[4,3...)
Show SMILES C1Cc2ccccc2C2N1Cc1cccc3[nH]cc2c13
Show InChI InChI=1S/C18H16N2/c1-2-6-14-12(4-1)8-9-20-11-13-5-3-7-16-17(13)15(10-19-16)18(14)20/h1-7,10,18-19H,8-9,11H2
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>1.00E+4n/an/an/an/an/an/an/an/a



Friedrich-Schiller-Universit£t Jena

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human recombinant dopamine D2L receptor expressed in HEK293 cells by microplate scintillation counting


J Med Chem 53: 2646-50 (2010)


Article DOI: 10.1021/jm901291r
BindingDB Entry DOI: 10.7270/Q2SJ1KRJ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50313915
PNG
(2,8,9,13b-Tetrahydro-6H-isoquino[2,1-b]pyrrolo[4,3...)
Show SMILES C1Cc2ccccc2C2N1Cc1cccc3[nH]cc2c13
Show InChI InChI=1S/C18H16N2/c1-2-6-14-12(4-1)8-9-20-11-13-5-3-7-16-17(13)15(10-19-16)18(14)20/h1-7,10,18-19H,8-9,11H2
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>1.00E+4n/an/an/an/an/an/an/an/a



Friedrich-Schiller-Universit£t Jena

Curated by ChEMBL


Assay Description
Displacement of [3H]radioligand from human recombinant dopamine D3 receptor expressed in HEK293 cells by microplate scintillation counting


J Med Chem 53: 2646-50 (2010)


Article DOI: 10.1021/jm901291r
BindingDB Entry DOI: 10.7270/Q2SJ1KRJ
More data for this
Ligand-Target Pair
D(1B) dopamine receptor


(Homo sapiens (Human))
BDBM50313915
PNG
(2,8,9,13b-Tetrahydro-6H-isoquino[2,1-b]pyrrolo[4,3...)
Show SMILES C1Cc2ccccc2C2N1Cc1cccc3[nH]cc2c13
Show InChI InChI=1S/C18H16N2/c1-2-6-14-12(4-1)8-9-20-11-13-5-3-7-16-17(13)15(10-19-16)18(14)20/h1-7,10,18-19H,8-9,11H2
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>1.00E+4n/an/an/an/an/an/an/an/a



Friedrich-Schiller-Universit£t Jena

Curated by ChEMBL


Assay Description
Displacement of [3H]radioligand from human recombinant dopamine D5 receptor expressed in HEK293 cells by microplate scintillation counting


J Med Chem 53: 2646-50 (2010)


Article DOI: 10.1021/jm901291r
BindingDB Entry DOI: 10.7270/Q2SJ1KRJ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50313914
PNG
(2,6,7,9,10,14b-Hexahydroindolo[3',4':3,4,5]azepino...)
Show SMILES C1Cc2ccccc2C2N1CCc1cccc3[nH]cc2c13
Show InChI InChI=1S/C19H18N2/c1-2-6-15-13(4-1)8-10-21-11-9-14-5-3-7-17-18(14)16(12-20-17)19(15)21/h1-7,12,19-20H,8-11H2
PDB

UniProtKB/SwissProt

antibodypedia
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PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Friedrich-Schiller-Universit£t Jena

Curated by ChEMBL


Assay Description
Displacement of [3H]radioligand from human recombinant dopamine D3 receptor expressed in HEK293 cells by microplate scintillation counting


J Med Chem 53: 2646-50 (2010)


Article DOI: 10.1021/jm901291r
BindingDB Entry DOI: 10.7270/Q2SJ1KRJ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50313913
PNG
(5,6,8,9,10,14c-Hexahydroindolo[3',2':3,4,]pyrido[2...)
Show SMILES C1Cc2[nH]c3ccccc3c2C2N1CCc1ccccc21
Show InChI InChI=1S/C19H18N2/c1-2-6-14-13(5-1)9-11-21-12-10-17-18(19(14)21)15-7-3-4-8-16(15)20-17/h1-8,19-20H,9-12H2
PDB

UniProtKB/SwissProt

antibodypedia
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PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Friedrich-Schiller-Universit£t Jena

Curated by ChEMBL


Assay Description
Displacement of [3H]radioligand from human recombinant dopamine D3 receptor expressed in HEK293 cells by microplate scintillation counting


J Med Chem 53: 2646-50 (2010)


Article DOI: 10.1021/jm901291r
BindingDB Entry DOI: 10.7270/Q2SJ1KRJ
More data for this
Ligand-Target Pair
D(1B) dopamine receptor


(Homo sapiens (Human))
BDBM50313913
PNG
(5,6,8,9,10,14c-Hexahydroindolo[3',2':3,4,]pyrido[2...)
Show SMILES C1Cc2[nH]c3ccccc3c2C2N1CCc1ccccc21
Show InChI InChI=1S/C19H18N2/c1-2-6-14-13(5-1)9-11-21-12-10-17-18(19(14)21)15-7-3-4-8-16(15)20-17/h1-8,19-20H,9-12H2
PDB

UniProtKB/SwissProt

antibodypedia
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Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Friedrich-Schiller-Universit£t Jena

Curated by ChEMBL


Assay Description
Displacement of [3H]radioligand from human recombinant dopamine D5 receptor expressed in HEK293 cells by microplate scintillation counting


J Med Chem 53: 2646-50 (2010)


Article DOI: 10.1021/jm901291r
BindingDB Entry DOI: 10.7270/Q2SJ1KRJ
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(Homo sapiens (Human))
BDBM50313915
PNG
(2,8,9,13b-Tetrahydro-6H-isoquino[2,1-b]pyrrolo[4,3...)
Show SMILES C1Cc2ccccc2C2N1Cc1cccc3[nH]cc2c13
Show InChI InChI=1S/C18H16N2/c1-2-6-14-12(4-1)8-9-20-11-13-5-3-7-16-17(13)15(10-19-16)18(14)20/h1-7,10,18-19H,8-9,11H2
PDB

KEGG

UniProtKB/SwissProt

DrugBank
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Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Friedrich-Schiller-Universit£t Jena

Curated by ChEMBL


Assay Description
Displacement of [3H]SCH23390 from human recombinant dopamine D1 receptor expressed in HEK293 cells by microplate scintillation counting


J Med Chem 53: 2646-50 (2010)


Article DOI: 10.1021/jm901291r
BindingDB Entry DOI: 10.7270/Q2SJ1KRJ
More data for this
Ligand-Target Pair