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Compile Data Set for Download or QSAR

Found 105 hits Enz. Inhib. hit(s) with all data for entry = 50032390   
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))
BDBM50119386
PNG
(Benzo[b]thiophene-2-carboxylic acid {4-[4-(2-metho...)
Show SMILES COc1ccccc1N1CCN(CCCCNC(=O)c2cc3ccccc3s2)CC1
Show InChI InChI=1S/C24H29N3O2S/c1-29-21-10-4-3-9-20(21)27-16-14-26(15-17-27)13-7-6-12-25-24(28)23-18-19-8-2-5-11-22(19)30-23/h2-5,8-11,18H,6-7,12-17H2,1H3,(H,25,28)
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0.270n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]Spiperone from human dopamine D3 receptor expressed in CHO cells


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50188475
PNG
((R)-N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]...)
Show SMILES COc1ccccc1N1CCN(CCCCNC(=O)c2cc3CCc4ccc(CCc2cc3)cc4)CC1
Show InChI InChI=1S/C32H39N3O2/c1-37-31-7-3-2-6-30(31)35-22-20-34(21-23-35)19-5-4-18-33-32(36)29-24-27-13-12-25-8-10-26(11-9-25)14-16-28(29)17-15-27/h2-3,6-11,15,17,24H,4-5,12-14,16,18-23H2,1H3,(H,33,36)
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0.490n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]Spiperone from human dopamine D3 receptor expressed in CHO cells


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
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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0.870n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]Spiperone from human dopamine D2 short receptor expressed in CHO cells


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
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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1.10n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]Spiperone from human dopamine D2 long receptor expressed in CHO cells


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50328455
PNG
(CHEMBL1258382 | N-[4-[4-([2.2]Paracyclophan-4-yl)p...)
Show SMILES O=C(NCCCCN1CCN(CC1)c1cc2CCc3ccc(CCc1cc2)cc3)c1cc2ccccc2s1
Show InChI InChI=1S/C33H37N3OS/c37-33(32-24-29-5-1-2-6-31(29)38-32)34-17-3-4-18-35-19-21-36(22-20-35)30-23-27-12-11-25-7-9-26(10-8-25)13-15-28(30)16-14-27/h1-2,5-10,14,16,23-24H,3-4,11-13,15,17-22H2,(H,34,37)
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1.60n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]Spiperone from human dopamine D3 receptor expressed in CHO cells


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50328456
PNG
(CHEMBL1258383 | N-[4-[4-(2,5-Dimethylphenyl)pipera...)
Show SMILES Cc1ccc(C)c(c1)N1CCN(CCCCNC(=O)c2cc3ccccc3s2)CC1
Show InChI InChI=1S/C25H31N3OS/c1-19-9-10-20(2)22(17-19)28-15-13-27(14-16-28)12-6-5-11-26-25(29)24-18-21-7-3-4-8-23(21)30-24/h3-4,7-10,17-18H,5-6,11-16H2,1-2H3,(H,26,29)
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2.5n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]Spiperone from human dopamine D3 receptor expressed in CHO cells


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50328444
PNG
(4-[4-(2,5-Dimethylphenyl)-4-hydroxypiperidin-1-yl]...)
Show SMILES Cc1ccc(C)c(c1)C1(O)CCN(CCCC(=O)c2ccc(F)cc2)CC1
Show InChI InChI=1S/C23H28FNO2/c1-17-5-6-18(2)21(16-17)23(27)11-14-25(15-12-23)13-3-4-22(26)19-7-9-20(24)10-8-19/h5-10,16,27H,3-4,11-15H2,1-2H3
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3.40n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]Spiperone from human dopamine D2 long receptor expressed in CHO cells


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50328443
PNG
(1-(4-Fluorophenyl)-4-[4-([2.2]paracyclophan-4-yl)-...)
Show SMILES OC1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)c1cc2CCc3ccc(CCc1cc2)cc3
Show InChI InChI=1S/C31H34FNO2/c32-28-15-13-27(14-16-28)30(34)2-1-19-33-20-17-31(35,18-21-33)29-22-25-8-7-23-3-5-24(6-4-23)9-11-26(29)12-10-25/h3-6,10,12-16,22,35H,1-2,7-9,11,17-21H2
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3.60n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]Spiperone from human dopamine D2 short receptor expressed in CHO cells


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50328458
PNG
(CHEMBL1256171 | N-[4-[4-([2.2]Paracyclophan-4-yl)p...)
Show SMILES O=C(NCCCCN1CCN(CC1)c1cc2CCc3ccc(CCc1cc2)cc3)c1cc2CCc3ccc(CCc1cc2)cc3
Show InChI InChI=1S/C41H47N3O/c45-41(39-29-35-13-11-31-3-7-33(8-4-31)15-19-37(39)20-17-35)42-23-1-2-24-43-25-27-44(28-26-43)40-30-36-14-12-32-5-9-34(10-6-32)16-21-38(40)22-18-36/h3-10,17-18,20,22,29-30H,1-2,11-16,19,21,23-28H2,(H,42,45)
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4n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]Spiperone from human dopamine D3 receptor expressed in CHO cells


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50328453
PNG
(4-[4-([2.2]Paracyclophan-4-yl)piperazin-1-yl]-1-([...)
Show SMILES O=C(CCCN1CCC(CC1)c1cc2CCc3ccc(CCc1cc2)cc3)c1cc2CCc3ccc(CCc1cc2)cc3
Show InChI InChI=1S/C41H45NO/c43-41(40-29-35-14-12-31-5-9-33(10-6-31)16-20-37(40)22-18-35)2-1-25-42-26-23-38(24-27-42)39-28-34-13-11-30-3-7-32(8-4-30)15-19-36(39)21-17-34/h3-10,17-18,21-22,28-29,38H,1-2,11-16,19-20,23-27H2
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4.20n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]Spiperone from human dopamine D3 receptor expressed in CHO cells


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50328457
PNG
(CHEMBL1258494 | N-[4-[4-(2-Methoxyphenyl)piperazin...)
Show SMILES COc1ccccc1N1CCN(CCCCNC(=O)c2cc(C)ccc2C)CC1
Show InChI InChI=1S/C24H33N3O2/c1-19-10-11-20(2)21(18-19)24(28)25-12-6-7-13-26-14-16-27(17-15-26)22-8-4-5-9-23(22)29-3/h4-5,8-11,18H,6-7,12-17H2,1-3H3,(H,25,28)
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4.70n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]Spiperone from human dopamine D3 receptor expressed in CHO cells


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50328443
PNG
(1-(4-Fluorophenyl)-4-[4-([2.2]paracyclophan-4-yl)-...)
Show SMILES OC1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)c1cc2CCc3ccc(CCc1cc2)cc3
Show InChI InChI=1S/C31H34FNO2/c32-28-15-13-27(14-16-28)30(34)2-1-19-33-20-17-31(35,18-21-33)29-22-25-8-7-23-3-5-24(6-4-23)9-11-26(29)12-10-25/h3-6,10,12-16,22,35H,1-2,7-9,11,17-21H2
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4.80n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]Spiperone from human dopamine D2 long receptor expressed in CHO cells


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50328444
PNG
(4-[4-(2,5-Dimethylphenyl)-4-hydroxypiperidin-1-yl]...)
Show SMILES Cc1ccc(C)c(c1)C1(O)CCN(CCCC(=O)c2ccc(F)cc2)CC1
Show InChI InChI=1S/C23H28FNO2/c1-17-5-6-18(2)21(16-17)23(27)11-14-25(15-12-23)13-3-4-22(26)19-7-9-20(24)10-8-19/h5-10,16,27H,3-4,11-15H2,1-2H3
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6.5n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]Spiperone from human dopamine D2 short receptor expressed in CHO cells


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
More data for this
Ligand-Target Pair
D(3) 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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7.5n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]Spiperone from human dopamine D3 receptor expressed in CHO cells


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50328449
PNG
(4-[4-([2.2]Paracyclophan-4-yl)piperazin-1-yl]-1-(4...)
Show SMILES Fc1ccc(cc1)C(=O)CCCN1CCN(CC1)c1cc2CCc3ccc(CCc1cc2)cc3
Show InChI InChI=1S/C30H33FN2O/c31-28-15-13-27(14-16-28)30(34)2-1-17-32-18-20-33(21-19-32)29-22-25-8-7-23-3-5-24(6-4-23)9-11-26(29)12-10-25/h3-6,10,12-16,22H,1-2,7-9,11,17-21H2
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9.90n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]Spiperone from human dopamine D3 receptor expressed in CHO cells


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50328445
PNG
(4-[4-(4-Chlorophenyl)-4-hydroxypiperidin-1-yl]-1-(...)
Show SMILES OC1(CCN(CCCC(=O)c2cc3CCc4ccc(CCc2cc3)cc4)CC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C31H34ClNO2/c32-28-15-13-27(14-16-28)31(35)17-20-33(21-18-31)19-1-2-30(34)29-22-25-8-7-23-3-5-24(6-4-23)9-11-26(29)12-10-25/h3-6,10,12-16,22,35H,1-2,7-9,11,17-21H2
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13n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]Spiperone from human dopamine D2 short receptor expressed in CHO cells


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50328450
PNG
(4-[4-(2,5-Dimethylphenyl)piperazin-1-yl]-1-(4-fluo...)
Show SMILES Cc1ccc(C)c(c1)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1
Show InChI InChI=1S/C22H27FN2O/c1-17-5-6-18(2)21(16-17)25-14-12-24(13-15-25)11-3-4-22(26)19-7-9-20(23)10-8-19/h5-10,16H,3-4,11-15H2,1-2H3
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13n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]Spiperone from human dopamine D2 long receptor expressed in CHO cells


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50328447
PNG
(4-[4-(4-Chlorophenyl)-4-hydroxypiperidin-1-yl]-1-(...)
Show SMILES Cc1ccc(C)c(c1)C(=O)CCCN1CCC(O)(CC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C23H28ClNO2/c1-17-5-6-18(2)21(16-17)22(26)4-3-13-25-14-11-23(27,12-15-25)19-7-9-20(24)10-8-19/h5-10,16,27H,3-4,11-15H2,1-2H3
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15n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]Spiperone from human dopamine D2 long receptor expressed in CHO cells


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50328450
PNG
(4-[4-(2,5-Dimethylphenyl)piperazin-1-yl]-1-(4-fluo...)
Show SMILES Cc1ccc(C)c(c1)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1
Show InChI InChI=1S/C22H27FN2O/c1-17-5-6-18(2)21(16-17)25-14-12-24(13-15-25)11-3-4-22(26)19-7-9-20(23)10-8-19/h5-10,16H,3-4,11-15H2,1-2H3
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16n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]Spiperone from human dopamine D2 short receptor expressed in CHO cells


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50328445
PNG
(4-[4-(4-Chlorophenyl)-4-hydroxypiperidin-1-yl]-1-(...)
Show SMILES OC1(CCN(CCCC(=O)c2cc3CCc4ccc(CCc2cc3)cc4)CC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C31H34ClNO2/c32-28-15-13-27(14-16-28)31(35)17-20-33(21-18-31)19-1-2-30(34)29-22-25-8-7-23-3-5-24(6-4-23)9-11-26(29)12-10-25/h3-6,10,12-16,22,35H,1-2,7-9,11,17-21H2
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17n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]Spiperone from human dopamine D3 receptor expressed in CHO cells


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50328457
PNG
(CHEMBL1258494 | N-[4-[4-(2-Methoxyphenyl)piperazin...)
Show SMILES COc1ccccc1N1CCN(CCCCNC(=O)c2cc(C)ccc2C)CC1
Show InChI InChI=1S/C24H33N3O2/c1-19-10-11-20(2)21(18-19)24(28)25-12-6-7-13-26-14-16-27(17-15-26)22-8-4-5-9-23(22)29-3/h4-5,8-11,18H,6-7,12-17H2,1-3H3,(H,25,28)
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17n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]Spiperone from human dopamine D2 short receptor expressed in CHO cells


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50328453
PNG
(4-[4-([2.2]Paracyclophan-4-yl)piperazin-1-yl]-1-([...)
Show SMILES O=C(CCCN1CCC(CC1)c1cc2CCc3ccc(CCc1cc2)cc3)c1cc2CCc3ccc(CCc1cc2)cc3
Show InChI InChI=1S/C41H45NO/c43-41(40-29-35-14-12-31-5-9-33(10-6-31)16-20-37(40)22-18-35)2-1-25-42-26-23-38(24-27-42)39-28-34-13-11-30-3-7-32(8-4-30)15-19-36(39)21-17-34/h3-10,17-18,21-22,28-29,38H,1-2,11-16,19-20,23-27H2
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17n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]Spiperone from human dopamine D2 long receptor expressed in CHO cells


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50188475
PNG
((R)-N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]...)
Show SMILES COc1ccccc1N1CCN(CCCCNC(=O)c2cc3CCc4ccc(CCc2cc3)cc4)CC1
Show InChI InChI=1S/C32H39N3O2/c1-37-31-7-3-2-6-30(31)35-22-20-34(21-23-35)19-5-4-18-33-32(36)29-24-27-13-12-25-8-10-26(11-9-25)14-16-28(29)17-15-27/h2-3,6-11,15,17,24H,4-5,12-14,16,18-23H2,1H3,(H,33,36)
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18n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]Spiperone from human dopamine D2 short receptor expressed in CHO cells


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(PIG)
BDBM50328443
PNG
(1-(4-Fluorophenyl)-4-[4-([2.2]paracyclophan-4-yl)-...)
Show SMILES OC1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)c1cc2CCc3ccc(CCc1cc2)cc3
Show InChI InChI=1S/C31H34FNO2/c32-28-15-13-27(14-16-28)30(34)2-1-19-33-20-17-31(35,18-21-33)29-22-25-8-7-23-3-5-24(6-4-23)9-11-26(29)12-10-25/h3-6,10,12-16,22,35H,1-2,7-9,11,17-21H2
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19n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]Ketanserin from 5-HT2 receptor in pig cortex membranes


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50328449
PNG
(4-[4-([2.2]Paracyclophan-4-yl)piperazin-1-yl]-1-(4...)
Show SMILES Fc1ccc(cc1)C(=O)CCCN1CCN(CC1)c1cc2CCc3ccc(CCc1cc2)cc3
Show InChI InChI=1S/C30H33FN2O/c31-28-15-13-27(14-16-28)30(34)2-1-17-32-18-20-33(21-19-32)29-22-25-8-7-23-3-5-24(6-4-23)9-11-26(29)12-10-25/h3-6,10,12-16,22H,1-2,7-9,11,17-21H2
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19n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]Spiperone from human dopamine D2 long receptor expressed in CHO cells


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(Sus scrofa)
BDBM50328444
PNG
(4-[4-(2,5-Dimethylphenyl)-4-hydroxypiperidin-1-yl]...)
Show SMILES Cc1ccc(C)c(c1)C1(O)CCN(CCCC(=O)c2ccc(F)cc2)CC1
Show InChI InChI=1S/C23H28FNO2/c1-17-5-6-18(2)21(16-17)23(27)11-14-25(15-12-23)13-3-4-22(26)19-7-9-20(24)10-8-19/h5-10,16,27H,3-4,11-15H2,1-2H3
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19n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]SCH23390 from dopamine D1 receptor in pig striatal membranes


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50328445
PNG
(4-[4-(4-Chlorophenyl)-4-hydroxypiperidin-1-yl]-1-(...)
Show SMILES OC1(CCN(CCCC(=O)c2cc3CCc4ccc(CCc2cc3)cc4)CC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C31H34ClNO2/c32-28-15-13-27(14-16-28)31(35)17-20-33(21-18-31)19-1-2-30(34)29-22-25-8-7-23-3-5-24(6-4-23)9-11-26(29)12-10-25/h3-6,10,12-16,22,35H,1-2,7-9,11,17-21H2
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21n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]Spiperone from human dopamine D2 long receptor expressed in CHO cells


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50328449
PNG
(4-[4-([2.2]Paracyclophan-4-yl)piperazin-1-yl]-1-(4...)
Show SMILES Fc1ccc(cc1)C(=O)CCCN1CCN(CC1)c1cc2CCc3ccc(CCc1cc2)cc3
Show InChI InChI=1S/C30H33FN2O/c31-28-15-13-27(14-16-28)30(34)2-1-17-32-18-20-33(21-19-32)29-22-25-8-7-23-3-5-24(6-4-23)9-11-26(29)12-10-25/h3-6,10,12-16,22H,1-2,7-9,11,17-21H2
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22n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]Spiperone from human dopamine D2 short receptor expressed in CHO cells


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50328457
PNG
(CHEMBL1258494 | N-[4-[4-(2-Methoxyphenyl)piperazin...)
Show SMILES COc1ccccc1N1CCN(CCCCNC(=O)c2cc(C)ccc2C)CC1
Show InChI InChI=1S/C24H33N3O2/c1-19-10-11-20(2)21(18-19)24(28)25-12-6-7-13-26-14-16-27(17-15-26)22-8-4-5-9-23(22)29-3/h4-5,8-11,18H,6-7,12-17H2,1-3H3,(H,25,28)
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22n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]Spiperone from human dopamine D2 long receptor expressed in CHO cells


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50188475
PNG
((R)-N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]...)
Show SMILES COc1ccccc1N1CCN(CCCCNC(=O)c2cc3CCc4ccc(CCc2cc3)cc4)CC1
Show InChI InChI=1S/C32H39N3O2/c1-37-31-7-3-2-6-30(31)35-22-20-34(21-23-35)19-5-4-18-33-32(36)29-24-27-13-12-25-8-10-26(11-9-25)14-16-28(29)17-15-27/h2-3,6-11,15,17,24H,4-5,12-14,16,18-23H2,1H3,(H,33,36)
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24n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]Spiperone from human dopamine D2 long receptor expressed in CHO cells


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50328444
PNG
(4-[4-(2,5-Dimethylphenyl)-4-hydroxypiperidin-1-yl]...)
Show SMILES Cc1ccc(C)c(c1)C1(O)CCN(CCCC(=O)c2ccc(F)cc2)CC1
Show InChI InChI=1S/C23H28FNO2/c1-17-5-6-18(2)21(16-17)23(27)11-14-25(15-12-23)13-3-4-22(26)19-7-9-20(24)10-8-19/h5-10,16,27H,3-4,11-15H2,1-2H3
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27n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]Spiperone from human dopamine D3 receptor expressed in CHO cells


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50328459
PNG
(CHEMBL1258495 | N-[4-[4-(2,5-Dimethylphenyl)pipera...)
Show SMILES Cc1ccc(C)c(c1)N1CCN(CCCCNC(=O)c2cc(C)ccc2C)CC1
Show InChI InChI=1S/C25H35N3O/c1-19-7-9-21(3)23(17-19)25(29)26-11-5-6-12-27-13-15-28(16-14-27)24-18-20(2)8-10-22(24)4/h7-10,17-18H,5-6,11-16H2,1-4H3,(H,26,29)
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28n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]Spiperone from human dopamine D3 receptor expressed in CHO cells


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50328453
PNG
(4-[4-([2.2]Paracyclophan-4-yl)piperazin-1-yl]-1-([...)
Show SMILES O=C(CCCN1CCC(CC1)c1cc2CCc3ccc(CCc1cc2)cc3)c1cc2CCc3ccc(CCc1cc2)cc3
Show InChI InChI=1S/C41H45NO/c43-41(40-29-35-14-12-31-5-9-33(10-6-31)16-20-37(40)22-18-35)2-1-25-42-26-23-38(24-27-42)39-28-34-13-11-30-3-7-32(8-4-30)15-19-36(39)21-17-34/h3-10,17-18,21-22,28-29,38H,1-2,11-16,19-20,23-27H2
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30n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]Spiperone from human dopamine D2 short receptor expressed in CHO cells


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(PIG)
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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30n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]Ketanserin from 5-HT2 receptor in pig cortex membranes


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50328458
PNG
(CHEMBL1256171 | N-[4-[4-([2.2]Paracyclophan-4-yl)p...)
Show SMILES O=C(NCCCCN1CCN(CC1)c1cc2CCc3ccc(CCc1cc2)cc3)c1cc2CCc3ccc(CCc1cc2)cc3
Show InChI InChI=1S/C41H47N3O/c45-41(39-29-35-13-11-31-3-7-33(8-4-31)15-19-37(39)20-17-35)42-23-1-2-24-43-25-27-44(28-26-43)40-30-36-14-12-32-5-9-34(10-6-32)16-21-38(40)22-18-36/h3-10,17-18,20,22,29-30H,1-2,11-16,19,21,23-28H2,(H,42,45)
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32n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]Spiperone from human dopamine D2 long receptor expressed in CHO cells


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50328446
PNG
(4-[4-([2.2]Paracyclophan-4-yl)-4-hydroxypiperidin-...)
Show SMILES OC1(CCN(CCCC(=O)c2cc3CCc4ccc(CCc2cc3)cc4)CC1)c1cc2CCc3ccc(CCc1cc2)cc3
Show InChI InChI=1S/C41H45NO2/c43-40(38-28-34-13-11-30-3-7-32(8-4-30)15-19-36(38)20-17-34)2-1-25-42-26-23-41(44,24-27-42)39-29-35-14-12-31-5-9-33(10-6-31)16-21-37(39)22-18-35/h3-10,17-18,20,22,28-29,44H,1-2,11-16,19,21,23-27H2
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38n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]Spiperone from human dopamine D3 receptor expressed in CHO cells


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50328447
PNG
(4-[4-(4-Chlorophenyl)-4-hydroxypiperidin-1-yl]-1-(...)
Show SMILES Cc1ccc(C)c(c1)C(=O)CCCN1CCC(O)(CC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C23H28ClNO2/c1-17-5-6-18(2)21(16-17)22(26)4-3-13-25-14-11-23(27,12-15-25)19-7-9-20(24)10-8-19/h5-10,16,27H,3-4,11-15H2,1-2H3
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43n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]Spiperone from human dopamine D2 short receptor expressed in CHO cells


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50328448
PNG
(1-(2,5-Dimethylphenyl)-4-[4-(2,5-dimethylphenyl)-4...)
Show SMILES Cc1ccc(C)c(c1)C(=O)CCCN1CCC(O)(CC1)c1cc(C)ccc1C
Show InChI InChI=1S/C25H33NO2/c1-18-7-9-20(3)22(16-18)24(27)6-5-13-26-14-11-25(28,12-15-26)23-17-19(2)8-10-21(23)4/h7-10,16-17,28H,5-6,11-15H2,1-4H3
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46n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]Spiperone from human dopamine D2 short receptor expressed in CHO cells


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50328458
PNG
(CHEMBL1256171 | N-[4-[4-([2.2]Paracyclophan-4-yl)p...)
Show SMILES O=C(NCCCCN1CCN(CC1)c1cc2CCc3ccc(CCc1cc2)cc3)c1cc2CCc3ccc(CCc1cc2)cc3
Show InChI InChI=1S/C41H47N3O/c45-41(39-29-35-13-11-31-3-7-33(8-4-31)15-19-37(39)20-17-35)42-23-1-2-24-43-25-27-44(28-26-43)40-30-36-14-12-32-5-9-34(10-6-32)16-21-38(40)22-18-36/h3-10,17-18,20,22,29-30H,1-2,11-16,19,21,23-28H2,(H,42,45)
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48n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]Spiperone from human dopamine D2 short receptor expressed in CHO cells


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50328443
PNG
(1-(4-Fluorophenyl)-4-[4-([2.2]paracyclophan-4-yl)-...)
Show SMILES OC1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)c1cc2CCc3ccc(CCc1cc2)cc3
Show InChI InChI=1S/C31H34FNO2/c32-28-15-13-27(14-16-28)30(34)2-1-19-33-20-17-31(35,18-21-33)29-22-25-8-7-23-3-5-24(6-4-23)9-11-26(29)12-10-25/h3-6,10,12-16,22,35H,1-2,7-9,11,17-21H2
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53n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]Spiperone from human dopamine D3 receptor expressed in CHO cells


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50328448
PNG
(1-(2,5-Dimethylphenyl)-4-[4-(2,5-dimethylphenyl)-4...)
Show SMILES Cc1ccc(C)c(c1)C(=O)CCCN1CCC(O)(CC1)c1cc(C)ccc1C
Show InChI InChI=1S/C25H33NO2/c1-18-7-9-20(3)22(16-18)24(27)6-5-13-26-14-11-25(28,12-15-26)23-17-19(2)8-10-21(23)4/h7-10,16-17,28H,5-6,11-15H2,1-4H3
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55n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]Spiperone from human dopamine D2 long receptor expressed in CHO cells


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50155520
PNG
(4-[4-(4-Chloro-phenyl)-piperazin-1-yl]-1-(4-fluoro...)
Show SMILES Fc1ccc(cc1)C(=O)CCCN1CCN(CC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C20H22ClFN2O/c21-17-5-9-19(10-6-17)24-14-12-23(13-15-24)11-1-2-20(25)16-3-7-18(22)8-4-16/h3-10H,1-2,11-15H2
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61n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]Spiperone from human dopamine D2 short receptor expressed in CHO cells


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50155520
PNG
(4-[4-(4-Chloro-phenyl)-piperazin-1-yl]-1-(4-fluoro...)
Show SMILES Fc1ccc(cc1)C(=O)CCCN1CCN(CC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C20H22ClFN2O/c21-17-5-9-19(10-6-17)24-14-12-23(13-15-24)11-1-2-20(25)16-3-7-18(22)8-4-16/h3-10H,1-2,11-15H2
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63n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]Spiperone from human dopamine D2 long receptor expressed in CHO cells


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50328456
PNG
(CHEMBL1258383 | N-[4-[4-(2,5-Dimethylphenyl)pipera...)
Show SMILES Cc1ccc(C)c(c1)N1CCN(CCCCNC(=O)c2cc3ccccc3s2)CC1
Show InChI InChI=1S/C25H31N3OS/c1-19-9-10-20(2)22(17-19)28-15-13-27(14-16-28)12-6-5-11-26-25(29)24-18-21-7-3-4-8-23(21)30-24/h3-4,7-10,17-18H,5-6,11-16H2,1-2H3,(H,26,29)
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65n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]Spiperone from human dopamine D2 short receptor expressed in CHO cells


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50119386
PNG
(Benzo[b]thiophene-2-carboxylic acid {4-[4-(2-metho...)
Show SMILES COc1ccccc1N1CCN(CCCCNC(=O)c2cc3ccccc3s2)CC1
Show InChI InChI=1S/C24H29N3O2S/c1-29-21-10-4-3-9-20(21)27-16-14-26(15-17-27)13-7-6-12-25-24(28)23-18-19-8-2-5-11-22(19)30-23/h2-5,8-11,18H,6-7,12-17H2,1H3,(H,25,28)
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72n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]Spiperone from human dopamine D2 short receptor expressed in CHO cells


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50328447
PNG
(4-[4-(4-Chlorophenyl)-4-hydroxypiperidin-1-yl]-1-(...)
Show SMILES Cc1ccc(C)c(c1)C(=O)CCCN1CCC(O)(CC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C23H28ClNO2/c1-17-5-6-18(2)21(16-17)22(26)4-3-13-25-14-11-23(27,12-15-25)19-7-9-20(24)10-8-19/h5-10,16,27H,3-4,11-15H2,1-2H3
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73n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]Spiperone from human dopamine D3 receptor expressed in CHO cells


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50328450
PNG
(4-[4-(2,5-Dimethylphenyl)piperazin-1-yl]-1-(4-fluo...)
Show SMILES Cc1ccc(C)c(c1)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1
Show InChI InChI=1S/C22H27FN2O/c1-17-5-6-18(2)21(16-17)25-14-12-24(13-15-25)11-3-4-22(26)19-7-9-20(23)10-8-19/h5-10,16H,3-4,11-15H2,1-2H3
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76n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]Spiperone from human dopamine D3 receptor expressed in CHO cells


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50328455
PNG
(CHEMBL1258382 | N-[4-[4-([2.2]Paracyclophan-4-yl)p...)
Show SMILES O=C(NCCCCN1CCN(CC1)c1cc2CCc3ccc(CCc1cc2)cc3)c1cc2ccccc2s1
Show InChI InChI=1S/C33H37N3OS/c37-33(32-24-29-5-1-2-6-31(29)38-32)34-17-3-4-18-35-19-21-36(22-20-35)30-23-27-12-11-25-7-9-26(10-8-25)13-15-28(30)16-14-27/h1-2,5-10,14,16,23-24H,3-4,11-13,15,17-22H2,(H,34,37)
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83n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]Spiperone from human dopamine D2 long receptor expressed in CHO cells


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50328456
PNG
(CHEMBL1258383 | N-[4-[4-(2,5-Dimethylphenyl)pipera...)
Show SMILES Cc1ccc(C)c(c1)N1CCN(CCCCNC(=O)c2cc3ccccc3s2)CC1
Show InChI InChI=1S/C25H31N3OS/c1-19-9-10-20(2)22(17-19)28-15-13-27(14-16-28)12-6-5-11-26-25(29)24-18-21-7-3-4-8-23(21)30-24/h3-4,7-10,17-18H,5-6,11-16H2,1-2H3,(H,26,29)
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84n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]Spiperone from human dopamine D2 long receptor expressed in CHO cells


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50328459
PNG
(CHEMBL1258495 | N-[4-[4-(2,5-Dimethylphenyl)pipera...)
Show SMILES Cc1ccc(C)c(c1)N1CCN(CCCCNC(=O)c2cc(C)ccc2C)CC1
Show InChI InChI=1S/C25H35N3O/c1-19-7-9-21(3)23(17-19)25(29)26-11-5-6-12-27-13-15-28(16-14-27)24-18-20(2)8-10-22(24)4/h7-10,17-18H,5-6,11-16H2,1-4H3,(H,26,29)
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86n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]Spiperone from human dopamine D2 short receptor expressed in CHO cells


J Med Chem 53: 7219-28 (2010)


Article DOI: 10.1021/jm100899z
BindingDB Entry DOI: 10.7270/Q27W6CDZ
More data for this
Ligand-Target Pair
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