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Compile Data Set for Download or QSAR

Found 95 hits Enz. Inhib. hit(s) with all data for entry = 50046177   
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))
BDBM50097834
PNG
(CHEMBL3589652)
Show SMILES OC(CCNC(=O)c1ccc2Cc3ccccc3-c2c1)CN1CCN(CC1)c1cccc(Cl)c1Cl
Show InChI InChI=1S/C28H29Cl2N3O2/c29-25-6-3-7-26(27(25)30)33-14-12-32(13-15-33)18-22(34)10-11-31-28(35)21-9-8-20-16-19-4-1-2-5-23(19)24(20)17-21/h1-9,17,22,34H,10-16,18H2,(H,31,35)
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0.233n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D3 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50097841
PNG
(CHEMBL3588919)
Show SMILES Clc1cccc(N2CCN(CCCCc3cn(nn3)-c3ccc4[nH]ccc4c3)CC2)c1Cl
Show InChI InChI=1S/C24H26Cl2N6/c25-21-5-3-6-23(24(21)26)31-14-12-30(13-15-31)11-2-1-4-19-17-32(29-28-19)20-7-8-22-18(16-20)9-10-27-22/h3,5-10,16-17,27H,1-2,4,11-15H2
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1n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D3 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50097780
PNG
(CHEMBL3588987)
Show SMILES Clc1cccc(N2CCN(CCCCn3cc(nn3)-c3ccc4ncccc4c3)CC2)c1Cl
Show InChI InChI=1S/C31H36N6O/c1-31(2,30(38)33-18-16-23-19-34-26-12-7-6-11-25(23)26)28-21-37-20-24(15-14-22-9-4-3-5-10-22)35-27(13-8-17-32)29(37)36-28/h3-7,9-12,19-21,34H,8,13-18,32H2,1-2H3,(H,33,38)
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1.40n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D3 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50097849
PNG
(CHEMBL3588986)
Show SMILES Clc1cccc(N2CCN(CCCCn3cc(nn3)-c3ccc4[nH]ccc4c3)CC2)c1Cl
Show InChI InChI=1S/C24H26Cl2N6/c25-20-4-3-5-23(24(20)26)31-14-12-30(13-15-31)10-1-2-11-32-17-22(28-29-32)18-6-7-21-19(16-18)8-9-27-21/h3-9,16-17,27H,1-2,10-15H2
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1.5n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D3 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50097836
PNG
(CHEMBL3588914)
Show SMILES COc1ccccc1N1CCN(CCCCc2cn(nn2)-c2ccc-3c(Cc4ccccc-34)c2)CC1
Show InChI InChI=1S/C30H33N5O/c1-36-30-12-5-4-11-29(30)34-18-16-33(17-19-34)15-7-6-9-25-22-35(32-31-25)26-13-14-28-24(21-26)20-23-8-2-3-10-27(23)28/h2-5,8,10-14,21-22H,6-7,9,15-20H2,1H3
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1.60n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D3 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM123850
PNG
(US8748608, 34 | US8748608, 34 Enantiomer A | US874...)
Show SMILES OC(CCNC(=O)c1cc2ccccc2[nH]1)CN1CCN(CC1)c1cccc(Cl)c1Cl
Show InChI InChI=1S/C23H26Cl2N4O2/c24-18-5-3-7-21(22(18)25)29-12-10-28(11-13-29)15-17(30)8-9-26-23(31)20-14-16-4-1-2-6-19(16)27-20/h1-7,14,17,27,30H,8-13,15H2,(H,26,31)
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1.90n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D3 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50097853
PNG
(CHEMBL3589651)
Show SMILES OC(CCNC(=O)c1cnc2ccccc2c1)CN1CCN(CC1)c1cccc(Cl)c1Cl
Show InChI InChI=1S/C24H26Cl2N4O2/c25-20-5-3-7-22(23(20)26)30-12-10-29(11-13-30)16-19(31)8-9-27-24(32)18-14-17-4-1-2-6-21(17)28-15-18/h1-7,14-15,19,31H,8-13,16H2,(H,27,32)
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2.90n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D3 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50097835
PNG
(CHEMBL3588913)
Show SMILES COc1ccccc1N1CCN(CCCCc2cn(nn2)-c2ccc3ccccc3c2)CC1
Show InChI InChI=1S/C27H31N5O/c1-33-27-12-5-4-11-26(27)31-18-16-30(17-19-31)15-7-6-10-24-21-32(29-28-24)25-14-13-22-8-2-3-9-23(22)20-25/h2-5,8-9,11-14,20-21H,6-7,10,15-19H2,1H3
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2.90n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D3 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50097837
PNG
(CHEMBL3588915)
Show SMILES COc1ccccc1N1CCN(CCCCc2cn(nn2)-c2ccc3[nH]ccc3c2)CC1
Show InChI InChI=1S/C25H30N6O/c1-32-25-8-3-2-7-24(25)30-16-14-29(15-17-30)13-5-4-6-21-19-31(28-27-21)22-9-10-23-20(18-22)11-12-26-23/h2-3,7-12,18-19,26H,4-6,13-17H2,1H3
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3.10n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D3 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50097839
PNG
(CHEMBL3588917)
Show SMILES Clc1cccc(N2CCN(CCCCc3cn(nn3)-c3ccc4ccccc4c3)CC2)c1Cl
Show InChI InChI=1S/C26H27Cl2N5/c27-24-9-5-10-25(26(24)28)32-16-14-31(15-17-32)13-4-3-8-22-19-33(30-29-22)23-12-11-20-6-1-2-7-21(20)18-23/h1-2,5-7,9-12,18-19H,3-4,8,13-17H2
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3.80n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D3 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50097840
PNG
(CHEMBL3588918)
Show SMILES Clc1cccc(N2CCN(CCCCc3cn(nn3)-c3ccc-4c(Cc5ccccc-45)c3)CC2)c1Cl
Show InChI InChI=1S/C29H29Cl2N5/c30-27-9-5-10-28(29(27)31)35-16-14-34(15-17-35)13-4-3-7-23-20-36(33-32-23)24-11-12-26-22(19-24)18-21-6-1-2-8-25(21)26/h1-2,5-6,8-12,19-20H,3-4,7,13-18H2
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5.10n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D3 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50042723
PNG
(CHEMBL3353895)
Show SMILES COc1ccccc1N1CCN(CCCCc2cn(nn2)-c2ccccc2)CC1
Show InChI InChI=1S/C23H29N5O/c1-29-23-13-6-5-12-22(23)27-17-15-26(16-18-27)14-8-7-9-20-19-28(25-24-20)21-10-3-2-4-11-21/h2-6,10-13,19H,7-9,14-18H2,1H3
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5.40n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D3 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50097844
PNG
(CHEMBL3588981)
Show SMILES COc1ccccc1N1CCN(CCCCn2cc(nn2)-c2ccc3[nH]ccc3c2)CC1
Show InChI InChI=1S/C25H30N6O/c1-32-25-7-3-2-6-24(25)30-16-14-29(15-17-30)12-4-5-13-31-19-23(27-28-31)20-8-9-22-21(18-20)10-11-26-22/h2-3,6-11,18-19,26H,4-5,12-17H2,1H3
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5.5n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D3 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50097843
PNG
(CHEMBL3588921)
Show SMILES COc1ccccc1N1CCN(CCCCn2cc(nn2)-c2ccc-3c(Cc4ccccc-34)c2)CC1
Show InChI InChI=1S/C30H33N5O/c1-36-30-11-5-4-10-29(30)34-18-16-33(17-19-34)14-6-7-15-35-22-28(31-32-35)24-12-13-27-25(21-24)20-23-8-2-3-9-26(23)27/h2-5,8-13,21-22H,6-7,14-20H2,1H3
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5.60n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D3 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50097846
PNG
(CHEMBL3588983)
Show SMILES COc1ccccc1N1CCN(CCCCn2cc(nn2)-c2ccc(cc2)-c2ccccc2)CC1
Show InChI InChI=1S/C29H33N5O/c1-35-29-12-6-5-11-28(29)33-21-19-32(20-22-33)17-7-8-18-34-23-27(30-31-34)26-15-13-25(14-16-26)24-9-3-2-4-10-24/h2-6,9-16,23H,7-8,17-22H2,1H3
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5.90n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D3 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50097851
PNG
(CHEMBL3588998)
Show SMILES OC(CCn1cc(nn1)-c1ccc2[nH]ccc2c1)CN1CCN(CC1)c1cccc(Cl)c1Cl
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5.90n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D3 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50097845
PNG
(CHEMBL3588982)
Show SMILES COc1ccccc1N1CCN(CCCCn2cc(nn2)-c2ccc3ncccc3c2)CC1
Show InChI InChI=1S/C26H30N6O/c1-33-26-9-3-2-8-25(26)31-17-15-30(16-18-31)13-4-5-14-32-20-24(28-29-32)22-10-11-23-21(19-22)7-6-12-27-23/h2-3,6-12,19-20H,4-5,13-18H2,1H3
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6.70n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D3 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50097847
PNG
(CHEMBL3588984)
Show SMILES Clc1cccc(N2CCN(CCCCn3cc(nn3)-c3ccc4ccccc4c3)CC2)c1Cl
Show InChI InChI=1S/C26H27Cl2N5/c27-23-8-5-9-25(26(23)28)32-16-14-31(15-17-32)12-3-4-13-33-19-24(29-30-33)22-11-10-20-6-1-2-7-21(20)18-22/h1-2,5-11,18-19H,3-4,12-17H2
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7.70n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D3 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50097785
PNG
(CHEMBL3588988)
Show SMILES Clc1cccc(N2CCN(CCCCn3cc(nn3)-c3ccc(cc3)-c3ccccc3)CC2)c1Cl
Show InChI InChI=1S/C24H23N5/c25-12-6-11-22-24-28-23(17-7-2-1-3-8-17)16-29(24)15-19(27-22)13-18-14-26-21-10-5-4-9-20(18)21/h1-5,7-10,14-16,26H,6,11-13,25H2
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8.30n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D3 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50097842
PNG
(CHEMBL3588920)
Show SMILES COc1ccccc1N1CCN(CCCCn2cc(nn2)-c2ccc3ccccc3c2)CC1
Show InChI InChI=1S/C27H31N5O/c1-33-27-11-5-4-10-26(27)31-18-16-30(17-19-31)14-6-7-15-32-21-25(28-29-32)24-13-12-22-8-2-3-9-23(22)20-24/h2-5,8-13,20-21H,6-7,14-19H2,1H3
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11n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D3 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50097838
PNG
(CHEMBL3588916)
Show SMILES COc1ccccc1N1CCN(CCCCc2cn(nn2)-c2ccc3cnccc3c2)CC1
Show InChI InChI=1S/C26H30N6O/c1-33-26-8-3-2-7-25(26)31-16-14-30(15-17-31)13-5-4-6-23-20-32(29-28-23)24-10-9-22-19-27-12-11-21(22)18-24/h2-3,7-12,18-20H,4-6,13-17H2,1H3
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13n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D3 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50097848
PNG
(CHEMBL3588985)
Show SMILES Clc1cccc(N2CCN(CCCCn3cc(nn3)-c3ccc-4c(Cc5ccccc-45)c3)CC2)c1Cl
Show InChI InChI=1S/C29H29Cl2N5/c30-26-8-5-9-28(29(26)31)35-16-14-34(15-17-35)12-3-4-13-36-20-27(32-33-36)22-10-11-25-23(19-22)18-21-6-1-2-7-24(21)25/h1-2,5-11,19-20H,3-4,12-18H2
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14n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D3 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50097852
PNG
(CHEMBL3589650)
Show SMILES OC(CCn1cc(nn1)-c1ccc2ncccc2c1)CN1CCN(CC1)c1cccc(Cl)c1Cl
Show InChI InChI=1S/C25H26Cl2N6O/c26-21-4-1-5-24(25(21)27)32-13-11-31(12-14-32)16-20(34)8-10-33-17-23(29-30-33)19-6-7-22-18(15-19)3-2-9-28-22/h1-7,9,15,17,20,34H,8,10-14,16H2
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18n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D3 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50097830
PNG
(CHEMBL3588993)
Show SMILES COc1ccccc1N1CCN(CC(O)CCn2cc(nn2)-c2ccc-3c(Cc4ccccc-34)c2)CC1
Show InChI InChI=1S/C30H33N5O2/c1-37-30-9-5-4-8-29(30)34-16-14-33(15-17-34)20-25(36)12-13-35-21-28(31-32-35)23-10-11-27-24(19-23)18-22-6-2-3-7-26(22)27/h2-11,19,21,25,36H,12-18,20H2,1H3
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19n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D3 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50097842
PNG
(CHEMBL3588920)
Show SMILES COc1ccccc1N1CCN(CCCCn2cc(nn2)-c2ccc3ccccc3c2)CC1
Show InChI InChI=1S/C27H31N5O/c1-33-27-11-5-4-10-26(27)31-18-16-30(17-19-31)14-6-7-15-32-21-25(28-29-32)24-13-12-22-8-2-3-9-23(22)20-24/h2-5,8-13,20-21H,6-7,14-19H2,1H3
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23n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50441096
PNG
(CHEMBL2430443)
Show SMILES COc1ccccc1N1CCN(CCCCn2cc(nn2)-c2ccccc2)CC1
Show InChI InChI=1S/C23H29N5O/c1-29-23-12-6-5-11-22(23)27-17-15-26(16-18-27)13-7-8-14-28-19-21(24-25-28)20-9-3-2-4-10-20/h2-6,9-12,19H,7-8,13-18H2,1H3
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23n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D3 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50097832
PNG
(CHEMBL3588995)
Show SMILES OC(CCn1cc(nn1)-c1ccc2ccccc2c1)CN1CCN(CC1)c1cccc(Cl)c1Cl
Show InChI InChI=1S/C26H27Cl2N5O/c27-23-6-3-7-25(26(23)28)32-14-12-31(13-15-32)17-22(34)10-11-33-18-24(29-30-33)21-9-8-19-4-1-2-5-20(19)16-21/h1-9,16,18,22,34H,10-15,17H2
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25n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D3 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50097827
PNG
(CHEMBL3588990)
Show SMILES COc1ccccc1N1CCN(CC(O)CCn2cc(nn2)-c2ccc(cc2)-c2ccccc2)CC1
Show InChI InChI=1S/C29H33N5O2/c1-36-29-10-6-5-9-28(29)33-19-17-32(18-20-33)21-26(35)15-16-34-22-27(30-31-34)25-13-11-24(12-14-25)23-7-3-2-4-8-23/h2-14,22,26,35H,15-21H2,1H3
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31n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D3 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50097835
PNG
(CHEMBL3588913)
Show SMILES COc1ccccc1N1CCN(CCCCc2cn(nn2)-c2ccc3ccccc3c2)CC1
Show InChI InChI=1S/C27H31N5O/c1-33-27-12-5-4-11-26(27)31-18-16-30(17-19-31)15-7-6-10-24-21-32(29-28-24)25-14-13-22-8-2-3-9-23(22)20-25/h2-5,8-9,11-14,20-21H,6-7,10,15-19H2,1H3
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32n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50097850
PNG
(CHEMBL3588997)
Show SMILES COc1ccccc1N1CCN(CC(O)CCn2cc(nn2)-c2ccc3[nH]ccc3c2)CC1
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34n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D3 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50097826
PNG
(CHEMBL3588989)
Show SMILES COc1ccccc1N1CCN(CC(O)CCn2cc(nn2)-c2ccc3ccccc3c2)CC1
Show InChI InChI=1S/C27H31N5O2/c1-34-27-9-5-4-8-26(27)31-16-14-30(15-17-31)19-24(33)12-13-32-20-25(28-29-32)23-11-10-21-6-2-3-7-22(21)18-23/h2-11,18,20,24,33H,12-17,19H2,1H3
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41n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D3 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50097845
PNG
(CHEMBL3588982)
Show SMILES COc1ccccc1N1CCN(CCCCn2cc(nn2)-c2ccc3ncccc3c2)CC1
Show InChI InChI=1S/C26H30N6O/c1-33-26-9-3-2-8-25(26)31-17-15-30(16-18-31)13-4-5-14-32-20-24(28-29-32)22-10-11-23-21(19-22)7-6-12-27-23/h2-3,6-12,19-20H,4-5,13-18H2,1H3
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43n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50097844
PNG
(CHEMBL3588981)
Show SMILES COc1ccccc1N1CCN(CCCCn2cc(nn2)-c2ccc3[nH]ccc3c2)CC1
Show InChI InChI=1S/C25H30N6O/c1-32-25-7-3-2-6-24(25)30-16-14-29(15-17-30)12-4-5-13-31-19-23(27-28-31)20-8-9-22-21(18-20)10-11-26-22/h2-3,6-11,18-19,26H,4-5,12-17H2,1H3
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44n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50097841
PNG
(CHEMBL3588919)
Show SMILES Clc1cccc(N2CCN(CCCCc3cn(nn3)-c3ccc4[nH]ccc4c3)CC2)c1Cl
Show InChI InChI=1S/C24H26Cl2N6/c25-21-5-3-6-23(24(21)26)31-14-12-30(13-15-31)11-2-1-4-19-17-32(29-28-19)20-7-8-22-18(16-20)9-10-27-22/h3,5-10,16-17,27H,1-2,4,11-15H2
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47n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50097843
PNG
(CHEMBL3588921)
Show SMILES COc1ccccc1N1CCN(CCCCn2cc(nn2)-c2ccc-3c(Cc4ccccc-34)c2)CC1
Show InChI InChI=1S/C30H33N5O/c1-36-30-11-5-4-10-29(30)34-18-16-33(17-19-34)14-6-7-15-35-22-28(31-32-35)24-12-13-27-25(21-24)20-23-8-2-3-9-26(23)27/h2-5,8-13,21-22H,6-7,14-20H2,1H3
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50n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50097837
PNG
(CHEMBL3588915)
Show SMILES COc1ccccc1N1CCN(CCCCc2cn(nn2)-c2ccc3[nH]ccc3c2)CC1
Show InChI InChI=1S/C25H30N6O/c1-32-25-8-3-2-7-24(25)30-16-14-29(15-17-30)13-5-4-6-21-19-31(28-27-21)22-9-10-23-20(18-22)11-12-26-23/h2-3,7-12,18-19,26H,4-6,13-17H2,1H3
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52n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50042723
PNG
(CHEMBL3353895)
Show SMILES COc1ccccc1N1CCN(CCCCc2cn(nn2)-c2ccccc2)CC1
Show InChI InChI=1S/C23H29N5O/c1-29-23-13-6-5-12-22(23)27-17-15-26(16-18-27)14-8-7-9-20-19-28(25-24-20)21-10-3-2-4-11-21/h2-6,10-13,19H,7-9,14-18H2,1H3
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54n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50097780
PNG
(CHEMBL3588987)
Show SMILES Clc1cccc(N2CCN(CCCCn3cc(nn3)-c3ccc4ncccc4c3)CC2)c1Cl
Show InChI InChI=1S/C31H36N6O/c1-31(2,30(38)33-18-16-23-19-34-26-12-7-6-11-25(23)26)28-21-37-20-24(15-14-22-9-4-3-5-10-22)35-27(13-8-17-32)29(37)36-28/h3-7,9-12,19-21,34H,8,13-18,32H2,1-2H3,(H,33,38)
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54n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50097834
PNG
(CHEMBL3589652)
Show SMILES OC(CCNC(=O)c1ccc2Cc3ccccc3-c2c1)CN1CCN(CC1)c1cccc(Cl)c1Cl
Show InChI InChI=1S/C28H29Cl2N3O2/c29-25-6-3-7-26(27(25)30)33-14-12-32(13-15-33)18-22(34)10-11-31-28(35)21-9-8-20-16-19-4-1-2-5-23(19)24(20)17-21/h1-9,17,22,34H,10-16,18H2,(H,31,35)
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55n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50097833
PNG
(CHEMBL3588996)
Show SMILES OC(CCn1cc(nn1)-c1ccc(cc1)-c1ccccc1)CN1CCN(CC1)c1cccc(Cl)c1Cl
Show InChI InChI=1S/C28H29Cl2N5O/c29-25-7-4-8-27(28(25)30)34-17-15-33(16-18-34)19-24(36)13-14-35-20-26(31-32-35)23-11-9-22(10-12-23)21-5-2-1-3-6-21/h1-12,20,24,36H,13-19H2
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56n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D3 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50097849
PNG
(CHEMBL3588986)
Show SMILES Clc1cccc(N2CCN(CCCCn3cc(nn3)-c3ccc4[nH]ccc4c3)CC2)c1Cl
Show InChI InChI=1S/C24H26Cl2N6/c25-20-4-3-5-23(24(20)26)31-14-12-30(13-15-31)10-1-2-11-32-17-22(28-29-32)18-6-7-21-19(16-18)8-9-27-21/h3-9,16-17,27H,1-2,10-15H2
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56n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50097836
PNG
(CHEMBL3588914)
Show SMILES COc1ccccc1N1CCN(CCCCc2cn(nn2)-c2ccc-3c(Cc4ccccc-34)c2)CC1
Show InChI InChI=1S/C30H33N5O/c1-36-30-12-5-4-11-29(30)34-18-16-33(17-19-34)15-7-6-9-25-22-35(32-31-25)26-13-14-28-24(21-26)20-23-8-2-3-10-27(23)28/h2-5,8,10-14,21-22H,6-7,9,15-20H2,1H3
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57n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50097831
PNG
(CHEMBL3588994)
Show SMILES COc1ccccc1N1CCN(CC(O)CCn2cc(nn2)-c2ccc3ncccc3c2)CC1
Show InChI InChI=1S/C26H30N6O2/c1-34-26-7-3-2-6-25(26)31-15-13-30(14-16-31)18-22(33)10-12-32-19-24(28-29-32)21-8-9-23-20(17-21)5-4-11-27-23/h2-9,11,17,19,22,33H,10,12-16,18H2,1H3
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68n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D3 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50097846
PNG
(CHEMBL3588983)
Show SMILES COc1ccccc1N1CCN(CCCCn2cc(nn2)-c2ccc(cc2)-c2ccccc2)CC1
Show InChI InChI=1S/C29H33N5O/c1-35-29-12-6-5-11-28(29)33-21-19-32(20-22-33)17-7-8-18-34-23-27(30-31-34)26-15-13-25(14-16-26)24-9-3-2-4-10-24/h2-6,9-16,23H,7-8,17-22H2,1H3
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69n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50097839
PNG
(CHEMBL3588917)
Show SMILES Clc1cccc(N2CCN(CCCCc3cn(nn3)-c3ccc4ccccc4c3)CC2)c1Cl
Show InChI InChI=1S/C26H27Cl2N5/c27-24-9-5-10-25(26(24)28)32-16-14-31(15-17-32)13-4-3-8-22-19-33(30-29-22)23-12-11-20-6-1-2-7-21(20)18-23/h1-2,5-7,9-12,18-19H,3-4,8,13-17H2
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81n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50097838
PNG
(CHEMBL3588916)
Show SMILES COc1ccccc1N1CCN(CCCCc2cn(nn2)-c2ccc3cnccc3c2)CC1
Show InChI InChI=1S/C26H30N6O/c1-33-26-8-3-2-7-25(26)31-16-14-30(15-17-31)13-5-4-6-23-20-32(29-28-23)24-10-9-22-19-27-12-11-21(22)18-24/h2-3,7-12,18-20H,4-6,13-17H2,1H3
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83n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50097847
PNG
(CHEMBL3588984)
Show SMILES Clc1cccc(N2CCN(CCCCn3cc(nn3)-c3ccc4ccccc4c3)CC2)c1Cl
Show InChI InChI=1S/C26H27Cl2N5/c27-23-8-5-9-25(26(23)28)32-16-14-31(15-17-32)12-3-4-13-33-19-24(29-30-33)22-11-10-20-6-1-2-7-21(20)18-22/h1-2,5-11,18-19H,3-4,12-17H2
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103n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50441096
PNG
(CHEMBL2430443)
Show SMILES COc1ccccc1N1CCN(CCCCn2cc(nn2)-c2ccccc2)CC1
Show InChI InChI=1S/C23H29N5O/c1-29-23-12-6-5-11-22(23)27-17-15-26(16-18-27)13-7-8-14-28-19-21(24-25-28)20-9-3-2-4-10-20/h2-6,9-12,19H,7-8,13-18H2,1H3
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137n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50097828
PNG
(CHEMBL3588991)
Show SMILES COc1ccccc1N1CCN(CC(O)CCn2cc(nn2)-c2ccccc2)CC1
Show InChI InChI=1S/C23H29N5O2/c1-30-23-10-6-5-9-22(23)27-15-13-26(14-16-27)17-20(29)11-12-28-18-21(24-25-28)19-7-3-2-4-8-19/h2-10,18,20,29H,11-17H2,1H3
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173n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D3 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50097826
PNG
(CHEMBL3588989)
Show SMILES COc1ccccc1N1CCN(CC(O)CCn2cc(nn2)-c2ccc3ccccc3c2)CC1
Show InChI InChI=1S/C27H31N5O2/c1-34-27-9-5-4-8-26(27)31-16-14-30(15-17-31)19-24(33)12-13-32-20-25(28-29-32)23-11-10-21-6-2-3-7-22(21)18-23/h2-11,18,20,24,33H,12-17,19H2,1H3
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189n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting...


Bioorg Med Chem 23: 4000-12 (2015)


Article DOI: 10.1016/j.bmc.2015.01.017
BindingDB Entry DOI: 10.7270/Q2BV7JCJ
More data for this
Ligand-Target Pair
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