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Compile Data Set for Download or QSAR

Found 52 hits Enz. Inhib. hit(s) with all data for entry = 50017300   
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))
BDBM50176070
PNG
(7-Methoxy-benzofuran-2-carboxylic acid {4-[4-(2,3-...)
Show SMILES COc1cccc2cc(oc12)C(=O)NCCCCN1CCN(CC1)c1cccc(Cl)c1Cl
Show InChI InChI=1S/C24H27Cl2N3O3/c1-31-20-9-4-6-17-16-21(32-23(17)20)24(30)27-10-2-3-11-28-12-14-29(15-13-28)19-8-5-7-18(25)22(19)26/h4-9,16H,2-3,10-15H2,1H3,(H,27,30)
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0.130n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


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


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50180292
PNG
(4-(1H-imidazol-1-yl)-N-(4-(4-(2-methoxyphenyl)pipe...)
Show SMILES COc1ccccc1N1CCN(CCCCNC(=O)c2ccc(cc2)-n2ccnc2)CC1
Show InChI InChI=1S/C25H31N5O2/c1-32-24-7-3-2-6-23(24)29-18-16-28(17-19-29)14-5-4-12-27-25(31)21-8-10-22(11-9-21)30-15-13-26-20-30/h2-3,6-11,13,15,20H,4-5,12,14,16-19H2,1H3,(H,27,31)
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4.79n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


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


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50180287
PNG
(CHEMBL201551 | N-(4-(4-(2-methoxyphenyl)piperazin-...)
Show SMILES COc1ccccc1N1CCN(CCCCNC(=O)c2ccc3OCOc3c2)CC1
Show InChI InChI=1S/C23H29N3O4/c1-28-20-7-3-2-6-19(20)26-14-12-25(13-15-26)11-5-4-10-24-23(27)18-8-9-21-22(16-18)30-17-29-21/h2-3,6-9,16H,4-5,10-15,17H2,1H3,(H,24,27)
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14.7n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


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


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50180280
PNG
(5-(furan-2-yl)-N-(4-(4-(2-methoxyphenyl)piperazin-...)
Show SMILES COc1ccccc1N1CCN(CCCCNC(=O)c2cc(n[nH]2)-c2ccco2)CC1
Show InChI InChI=1S/C23H29N5O3/c1-30-22-8-3-2-7-20(22)28-14-12-27(13-15-28)11-5-4-10-24-23(29)19-17-18(25-26-19)21-9-6-16-31-21/h2-3,6-9,16-17H,4-5,10-15H2,1H3,(H,24,29)(H,25,26)
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19.3n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


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


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50180291
PNG
(CHEMBL199836 | N-[4-[4-(5-methoxy-2-benisooazolyl)...)
Show SMILES COc1ccc2onc(N3CCN(CCCCNC(=O)c4cc(n[nH]4)-c4ccco4)CC3)c2c1
Show InChI InChI=1S/C24H28N6O4/c1-32-17-6-7-21-18(15-17)23(28-34-21)30-12-10-29(11-13-30)9-3-2-8-25-24(31)20-16-19(26-27-20)22-5-4-14-33-22/h4-7,14-16H,2-3,8-13H2,1H3,(H,25,31)(H,26,27)
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21.4n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


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


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50180299
PNG
(CHEMBL199329 | N-[4-[4-(5-methoxy-2-benzisoxazolyl...)
Show SMILES COc1ccc2onc(N3CCN(CCCCNC(=O)c4ccc(cc4)-n4ccnc4)CC3)c2c1
Show InChI InChI=1S/C26H30N6O3/c1-34-22-8-9-24-23(18-22)25(29-35-24)31-16-14-30(15-17-31)12-3-2-10-28-26(33)20-4-6-21(7-5-20)32-13-11-27-19-32/h4-9,11,13,18-19H,2-3,10,12,14-17H2,1H3,(H,28,33)
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22.6n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


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


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50180296
PNG
(CHEMBL203302 | N-(4-(4-(2-methoxyphenyl)piperazin-...)
Show SMILES COc1ccccc1N1CCN(CCCCNC(=O)c2ccc(cc2)N2CCOCC2)CC1
Show InChI InChI=1S/C26H36N4O3/c1-32-25-7-3-2-6-24(25)30-16-14-28(15-17-30)13-5-4-12-27-26(31)22-8-10-23(11-9-22)29-18-20-33-21-19-29/h2-3,6-11H,4-5,12-21H2,1H3,(H,27,31)
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23.9n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


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


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50180282
PNG
(7-methoxy-N-(4-(4-(2-methoxyphenyl)piperazin-1-yl)...)
Show SMILES COc1ccccc1N1CCN(CCCCNC(=O)c2cc3cccc(OC)c3o2)CC1
Show InChI InChI=1S/C25H31N3O4/c1-30-21-10-4-3-9-20(21)28-16-14-27(15-17-28)13-6-5-12-26-25(29)23-18-19-8-7-11-22(31-2)24(19)32-23/h3-4,7-11,18H,5-6,12-17H2,1-2H3,(H,26,29)
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25.5n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


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


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50180292
PNG
(4-(1H-imidazol-1-yl)-N-(4-(4-(2-methoxyphenyl)pipe...)
Show SMILES COc1ccccc1N1CCN(CCCCNC(=O)c2ccc(cc2)-n2ccnc2)CC1
Show InChI InChI=1S/C25H31N5O2/c1-32-24-7-3-2-6-23(24)29-18-16-28(17-19-29)14-5-4-12-27-25(31)21-8-10-22(11-9-21)30-15-13-26-20-30/h2-3,6-11,13,15,20H,4-5,12,14,16-19H2,1H3,(H,27,31)
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27.2n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]spiroperidol from cloned human dopamine receptor D2(long) expressed in rat C6 glioma cells


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50180286
PNG
(CHEMBL197660 | N-[4-[4-(5-methoxy-2-benzisoxazolyl...)
Show SMILES COc1ccc2onc(N3CCN(CCCCNC(=O)c4ccc(cc4)N4CCOCC4)CC3)c2c1
Show InChI InChI=1S/C27H35N5O4/c1-34-23-8-9-25-24(20-23)26(29-36-25)32-14-12-30(13-15-32)11-3-2-10-28-27(33)21-4-6-22(7-5-21)31-16-18-35-19-17-31/h4-9,20H,2-3,10-19H2,1H3,(H,28,33)
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38n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


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


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50180278
PNG
(CHEMBL202713 | N-(4-(4-(1H-indazol-3-yl)piperazin-...)
Show SMILES COc1cccc2cc(oc12)C(=O)NCCCCN1CCN(CC1)c1[nH]nc2ccccc12
Show InChI InChI=1S/C25H29N5O3/c1-32-21-10-6-7-18-17-22(33-23(18)21)25(31)26-11-4-5-12-29-13-15-30(16-14-29)24-19-8-2-3-9-20(19)27-28-24/h2-3,6-10,17H,4-5,11-16H2,1H3,(H,26,31)(H,27,28)
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56.6n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]spiroperidol from cloned human dopamine receptor D2(long) expressed in rat C6 glioma cells


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50180283
PNG
(CHEMBL424667 | N-(4-(4-(2-methoxyphenyl)piperazin-...)
Show SMILES COc1ccccc1N1CCN(CCCCNC(=O)c2ccc3nonc3c2)CC1
Show InChI InChI=1S/C22H27N5O3/c1-29-21-7-3-2-6-20(21)27-14-12-26(13-15-27)11-5-4-10-23-22(28)17-8-9-18-19(16-17)25-30-24-18/h2-3,6-9,16H,4-5,10-15H2,1H3,(H,23,28)
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58.5n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


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


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50132025
PNG
(2-Oxo-2H-chromene-3-carboxylic acid {4-[4-(2-metho...)
Show SMILES COc1ccccc1N1CCN(CCCCNC(=O)c2cc3ccccc3oc2=O)CC1
Show InChI InChI=1S/C25H29N3O4/c1-31-23-11-5-3-9-21(23)28-16-14-27(15-17-28)13-7-6-12-26-24(29)20-18-19-8-2-4-10-22(19)32-25(20)30/h2-5,8-11,18H,6-7,12-17H2,1H3,(H,26,29)
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60.1n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


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


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50180288
PNG
(CHEMBL199498 | N-[4-[4-(2-methoxyphenyl)piperazin-...)
Show SMILES COc1ccccc1N1CCN(CCCCNC(=O)c2ccc3nccnc3c2)CC1
Show InChI InChI=1S/C24H29N5O2/c1-31-23-7-3-2-6-22(23)29-16-14-28(15-17-29)13-5-4-10-27-24(30)19-8-9-20-21(18-19)26-12-11-25-20/h2-3,6-9,11-12,18H,4-5,10,13-17H2,1H3,(H,27,30)
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77.9n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


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


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50180285
PNG
(CHEMBL372308 | N-(4-(4-(5-methoxybenzo[d]isoxazol-...)
Show SMILES COc1ccc2onc(N3CCN(CCCCNC(=O)c4ccc5nonc5c4)CC3)c2c1
Show InChI InChI=1S/C23H26N6O4/c1-31-17-5-7-21-18(15-17)22(27-32-21)29-12-10-28(11-13-29)9-3-2-8-24-23(30)16-4-6-19-20(14-16)26-33-25-19/h4-7,14-15H,2-3,8-13H2,1H3,(H,24,30)
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85n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


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


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50180287
PNG
(CHEMBL201551 | N-(4-(4-(2-methoxyphenyl)piperazin-...)
Show SMILES COc1ccccc1N1CCN(CCCCNC(=O)c2ccc3OCOc3c2)CC1
Show InChI InChI=1S/C23H29N3O4/c1-28-20-7-3-2-6-19(20)26-14-12-25(13-15-26)11-5-4-10-24-23(27)18-8-9-21-22(16-18)30-17-29-21/h2-3,6-9,16H,4-5,10-15,17H2,1H3,(H,24,27)
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86.2n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]spiroperidol from cloned human dopamine receptor D2(long) expressed in rat C6 glioma cells


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50180297
PNG
(7-methoxy-N-(4-(4-(5-methoxybenzo[d]isoxazol-3-yl)...)
Show SMILES COc1ccc2onc(N3CCN(CCCCNC(=O)c4cc5cccc(OC)c5o4)CC3)c2c1
Show InChI InChI=1S/C26H30N4O5/c1-32-19-8-9-21-20(17-19)25(28-35-21)30-14-12-29(13-15-30)11-4-3-10-27-26(31)23-16-18-6-5-7-22(33-2)24(18)34-23/h5-9,16-17H,3-4,10-15H2,1-2H3,(H,27,31)
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98n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


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


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50180298
PNG
(7-methoxy-N-(4-(4-(7-methoxyisoquinolin-1-yl)piper...)
Show SMILES COc1ccc2ccnc(N3CCN(CCCCNC(=O)c4cc5cccc(OC)c5o4)CC3)c2c1
Show InChI InChI=1S/C28H32N4O4/c1-34-22-9-8-20-10-12-29-27(23(20)19-22)32-16-14-31(15-17-32)13-4-3-11-30-28(33)25-18-21-6-5-7-24(35-2)26(21)36-25/h5-10,12,18-19H,3-4,11,13-17H2,1-2H3,(H,30,33)
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102n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


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


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50180279
PNG
(CHEMBL200024 | N-(4-(4-(5-methoxybenzo[d]isoxazol-...)
Show SMILES COc1ccc2onc(N3CCN(CCCCNC(=O)c4ccc5OCOc5c4)CC3)c2c1
Show InChI InChI=1S/C24H28N4O5/c1-30-18-5-7-20-19(15-18)23(26-33-20)28-12-10-27(11-13-28)9-3-2-8-25-24(29)17-4-6-21-22(14-17)32-16-31-21/h4-7,14-15H,2-3,8-13,16H2,1H3,(H,25,29)
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118n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


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


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50180278
PNG
(CHEMBL202713 | N-(4-(4-(1H-indazol-3-yl)piperazin-...)
Show SMILES COc1cccc2cc(oc12)C(=O)NCCCCN1CCN(CC1)c1[nH]nc2ccccc12
Show InChI InChI=1S/C25H29N5O3/c1-32-21-10-6-7-18-17-22(33-23(18)21)25(31)26-11-4-5-12-29-13-15-30(16-14-29)24-19-8-2-3-9-20(19)27-28-24/h2-3,6-10,17H,4-5,11-16H2,1H3,(H,26,31)(H,27,28)
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127n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


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


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50180280
PNG
(5-(furan-2-yl)-N-(4-(4-(2-methoxyphenyl)piperazin-...)
Show SMILES COc1ccccc1N1CCN(CCCCNC(=O)c2cc(n[nH]2)-c2ccco2)CC1
Show InChI InChI=1S/C23H29N5O3/c1-30-22-8-3-2-7-20(22)28-14-12-27(13-15-28)11-5-4-10-24-23(29)19-17-18(25-26-19)21-9-6-16-31-21/h2-3,6-9,16-17H,4-5,10-15H2,1H3,(H,24,29)(H,25,26)
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130n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]spiroperidol from cloned human dopamine receptor D2(long) expressed in rat C6 glioma cells


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50180296
PNG
(CHEMBL203302 | N-(4-(4-(2-methoxyphenyl)piperazin-...)
Show SMILES COc1ccccc1N1CCN(CCCCNC(=O)c2ccc(cc2)N2CCOCC2)CC1
Show InChI InChI=1S/C26H36N4O3/c1-32-25-7-3-2-6-24(25)30-16-14-28(15-17-30)13-5-4-12-27-26(31)22-8-10-23(11-9-22)29-18-20-33-21-19-29/h2-3,6-11H,4-5,12-21H2,1H3,(H,27,31)
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141n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]spiroperidol from cloned human dopamine receptor D2(long) expressed in rat C6 glioma cells


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50132025
PNG
(2-Oxo-2H-chromene-3-carboxylic acid {4-[4-(2-metho...)
Show SMILES COc1ccccc1N1CCN(CCCCNC(=O)c2cc3ccccc3oc2=O)CC1
Show InChI InChI=1S/C25H29N3O4/c1-31-23-11-5-3-9-21(23)28-16-14-27(15-17-28)13-7-6-12-26-24(29)20-18-19-8-2-4-10-22(19)32-25(20)30/h2-5,8-11,18H,6-7,12-17H2,1H3,(H,26,29)
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146n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]spiroperidol from cloned human dopamine receptor D2(long) expressed in rat C6 glioma cells


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50180288
PNG
(CHEMBL199498 | N-[4-[4-(2-methoxyphenyl)piperazin-...)
Show SMILES COc1ccccc1N1CCN(CCCCNC(=O)c2ccc3nccnc3c2)CC1
Show InChI InChI=1S/C24H29N5O2/c1-31-23-7-3-2-6-22(23)29-16-14-28(15-17-29)13-5-4-10-27-24(30)19-8-9-20-21(18-19)26-12-11-25-20/h2-3,6-9,11-12,18H,4-5,10,13-17H2,1H3,(H,27,30)
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179n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]spiroperidol from cloned human dopamine receptor D2(long) expressed in rat C6 glioma cells


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50180294
PNG
(CHEMBL199746 | N-(4-(4-(5-methoxybenzo[d]isoxazol-...)
Show SMILES COc1ccc2onc(N3CCN(CCCCNC(=O)c4ccc5nccnc5c4)CC3)c2c1
Show InChI InChI=1S/C25H28N6O3/c1-33-19-5-7-23-20(17-19)24(29-34-23)31-14-12-30(13-15-31)11-3-2-8-28-25(32)18-4-6-21-22(16-18)27-10-9-26-21/h4-7,9-10,16-17H,2-3,8,11-15H2,1H3,(H,28,32)
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220n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


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


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50180289
PNG
(7-methoxy-N-(4-(4-(quinoxalin-5-yl)piperazin-1-yl)...)
Show SMILES COc1cccc2cc(oc12)C(=O)NCCCCN1CCN(CC1)c1cccc2nccnc12
Show InChI InChI=1S/C26H29N5O3/c1-33-22-9-4-6-19-18-23(34-25(19)22)26(32)29-10-2-3-13-30-14-16-31(17-15-30)21-8-5-7-20-24(21)28-12-11-27-20/h4-9,11-12,18H,2-3,10,13-17H2,1H3,(H,29,32)
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262n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


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


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50180282
PNG
(7-methoxy-N-(4-(4-(2-methoxyphenyl)piperazin-1-yl)...)
Show SMILES COc1ccccc1N1CCN(CCCCNC(=O)c2cc3cccc(OC)c3o2)CC1
Show InChI InChI=1S/C25H31N3O4/c1-30-21-10-4-3-9-20(21)28-16-14-27(15-17-28)13-6-5-12-26-25(29)23-18-19-8-7-11-22(31-2)24(19)32-23/h3-4,7-11,18H,5-6,12-17H2,1-2H3,(H,26,29)
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369n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]spiroperidol from cloned human dopamine receptor D2(long) expressed in rat C6 glioma cells


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50176070
PNG
(7-Methoxy-benzofuran-2-carboxylic acid {4-[4-(2,3-...)
Show SMILES COc1cccc2cc(oc12)C(=O)NCCCCN1CCN(CC1)c1cccc(Cl)c1Cl
Show InChI InChI=1S/C24H27Cl2N3O3/c1-31-20-9-4-6-17-16-21(32-23(17)20)24(30)27-10-2-3-11-28-12-14-29(15-13-28)19-8-5-7-18(25)22(19)26/h4-9,16H,2-3,10-15H2,1H3,(H,27,30)
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373n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]spiroperidol from cloned human dopamine receptor D2(long) expressed in rat C6 glioma cells


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50180298
PNG
(7-methoxy-N-(4-(4-(7-methoxyisoquinolin-1-yl)piper...)
Show SMILES COc1ccc2ccnc(N3CCN(CCCCNC(=O)c4cc5cccc(OC)c5o4)CC3)c2c1
Show InChI InChI=1S/C28H32N4O4/c1-34-22-9-8-20-10-12-29-27(23(20)19-22)32-16-14-31(15-17-32)13-4-3-11-30-28(33)25-18-21-6-5-7-24(35-2)26(21)36-25/h5-10,12,18-19H,3-4,11,13-17H2,1-2H3,(H,30,33)
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519n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]spiroperidol from cloned human dopamine receptor D2(long) expressed in rat C6 glioma cells


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50180286
PNG
(CHEMBL197660 | N-[4-[4-(5-methoxy-2-benzisoxazolyl...)
Show SMILES COc1ccc2onc(N3CCN(CCCCNC(=O)c4ccc(cc4)N4CCOCC4)CC3)c2c1
Show InChI InChI=1S/C27H35N5O4/c1-34-23-8-9-25-24(20-23)26(29-36-25)32-14-12-30(13-15-32)11-3-2-10-28-27(33)21-4-6-22(7-5-21)31-16-18-35-19-17-31/h4-9,20H,2-3,10-19H2,1H3,(H,28,33)
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>750n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]spiroperidol from cloned human dopamine receptor D2(long) expressed in rat C6 glioma cells


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50180279
PNG
(CHEMBL200024 | N-(4-(4-(5-methoxybenzo[d]isoxazol-...)
Show SMILES COc1ccc2onc(N3CCN(CCCCNC(=O)c4ccc5OCOc5c4)CC3)c2c1
Show InChI InChI=1S/C24H28N4O5/c1-30-18-5-7-20-19(15-18)23(26-33-20)28-12-10-27(11-13-28)9-3-2-8-25-24(29)17-4-6-21-22(14-17)32-16-31-21/h4-7,14-15H,2-3,8-13,16H2,1H3,(H,25,29)
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>750n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]spiroperidol from cloned human dopamine receptor D2(long) expressed in rat C6 glioma cells


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50180297
PNG
(7-methoxy-N-(4-(4-(5-methoxybenzo[d]isoxazol-3-yl)...)
Show SMILES COc1ccc2onc(N3CCN(CCCCNC(=O)c4cc5cccc(OC)c5o4)CC3)c2c1
Show InChI InChI=1S/C26H30N4O5/c1-32-19-8-9-21-20(17-19)25(28-35-21)30-14-12-29(13-15-30)11-4-3-10-27-26(31)23-16-18-6-5-7-22(33-2)24(18)34-23/h5-9,16-17H,3-4,10-15H2,1-2H3,(H,27,31)
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>750n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]spiroperidol from cloned human dopamine receptor D2(long) expressed in rat C6 glioma cells


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50180284
PNG
(CHEMBL200243 | N-(4-(4-(1H-benzo[d]imidazol-2-yl)p...)
Show SMILES COc1cccc2cc(oc12)C(=O)NCCCCN1CCN(CC1)c1nc2ccccc2[nH]1
Show InChI InChI=1S/C25H29N5O3/c1-32-21-10-6-7-18-17-22(33-23(18)21)24(31)26-11-4-5-12-29-13-15-30(16-14-29)25-27-19-8-2-3-9-20(19)28-25/h2-3,6-10,17H,4-5,11-16H2,1H3,(H,26,31)(H,27,28)
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>750n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]spiroperidol from cloned human dopamine receptor D2(long) expressed in rat C6 glioma cells


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50180285
PNG
(CHEMBL372308 | N-(4-(4-(5-methoxybenzo[d]isoxazol-...)
Show SMILES COc1ccc2onc(N3CCN(CCCCNC(=O)c4ccc5nonc5c4)CC3)c2c1
Show InChI InChI=1S/C23H26N6O4/c1-31-17-5-7-21-18(15-17)22(27-32-21)29-12-10-28(11-13-29)9-3-2-8-24-23(30)16-4-6-19-20(14-16)26-33-25-19/h4-7,14-15H,2-3,8-13H2,1H3,(H,24,30)
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>750n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]spiroperidol from cloned human dopamine receptor D2(long) expressed in rat C6 glioma cells


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50180295
PNG
(CHEMBL201275 | N-(4-(4-(5-methoxybenzo[d]isoxazol-...)
Show SMILES COc1ccc2onc(N3CCN(CCCCNC(=O)c4cc5ccccc5oc4=O)CC3)c2c1
Show InChI InChI=1S/C26H28N4O5/c1-33-19-8-9-23-20(17-19)24(28-35-23)30-14-12-29(13-15-30)11-5-4-10-27-25(31)21-16-18-6-2-3-7-22(18)34-26(21)32/h2-3,6-9,16-17H,4-5,10-15H2,1H3,(H,27,31)
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>750n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]spiroperidol from cloned human dopamine receptor D2(long) expressed in rat C6 glioma cells


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50180291
PNG
(CHEMBL199836 | N-[4-[4-(5-methoxy-2-benisooazolyl)...)
Show SMILES COc1ccc2onc(N3CCN(CCCCNC(=O)c4cc(n[nH]4)-c4ccco4)CC3)c2c1
Show InChI InChI=1S/C24H28N6O4/c1-32-17-6-7-21-18(15-17)23(28-34-21)30-12-10-29(11-13-30)9-3-2-8-25-24(31)20-16-19(26-27-20)22-5-4-14-33-22/h4-7,14-16H,2-3,8-13H2,1H3,(H,25,31)(H,26,27)
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>750n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]spiroperidol from cloned human dopamine receptor D2(long) expressed in rat C6 glioma cells


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50180290
PNG
(CHEMBL202762 | N-[4-[4-(5-methoxy-2-benzoxazolyl)p...)
Show SMILES COc1ccc2oc(nc2c1)N1CCN(CCCCNC(=O)c2cc3cccc(OC)c3o2)CC1
Show InChI InChI=1S/C26H30N4O5/c1-32-19-8-9-21-20(17-19)28-26(35-21)30-14-12-29(13-15-30)11-4-3-10-27-25(31)23-16-18-6-5-7-22(33-2)24(18)34-23/h5-9,16-17H,3-4,10-15H2,1-2H3,(H,27,31)
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>750n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]spiroperidol from cloned human dopamine receptor D2(long) expressed in rat C6 glioma cells


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50180294
PNG
(CHEMBL199746 | N-(4-(4-(5-methoxybenzo[d]isoxazol-...)
Show SMILES COc1ccc2onc(N3CCN(CCCCNC(=O)c4ccc5nccnc5c4)CC3)c2c1
Show InChI InChI=1S/C25H28N6O3/c1-33-19-5-7-23-20(17-19)24(29-34-23)31-14-12-30(13-15-31)11-3-2-8-28-25(32)18-4-6-21-22(16-18)27-10-9-26-21/h4-7,9-10,16-17H,2-3,8,11-15H2,1H3,(H,28,32)
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>750n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]spiroperidol from cloned human dopamine receptor D2(long) expressed in rat C6 glioma cells


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50180299
PNG
(CHEMBL199329 | N-[4-[4-(5-methoxy-2-benzisoxazolyl...)
Show SMILES COc1ccc2onc(N3CCN(CCCCNC(=O)c4ccc(cc4)-n4ccnc4)CC3)c2c1
Show InChI InChI=1S/C26H30N6O3/c1-34-22-8-9-24-23(18-22)25(29-35-24)31-16-14-30(15-17-31)12-3-2-10-28-26(33)20-4-6-21(7-5-20)32-13-11-27-19-32/h4-9,11,13,18-19H,2-3,10,12,14-17H2,1H3,(H,28,33)
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>750n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]spiroperidol from cloned human dopamine receptor D2(long) expressed in rat C6 glioma cells


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50180281
PNG
(CHEMBL426834 | N-(4-(4-(5-methoxybenzo[d]isoxazol-...)
Show SMILES COc1ccc2onc(N3CCN(CCCCNC(=O)c4cccc(c4)-c4noc(C)n4)CC3)c2c1
Show InChI InChI=1S/C26H30N6O4/c1-18-28-24(29-35-18)19-6-5-7-20(16-19)26(33)27-10-3-4-11-31-12-14-32(15-13-31)25-22-17-21(34-2)8-9-23(22)36-30-25/h5-9,16-17H,3-4,10-15H2,1-2H3,(H,27,33)
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>1.00E+3n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]spiroperidol from cloned human dopamine receptor D2(long) expressed in rat C6 glioma cells


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50180277
PNG
(CHEMBL199480 | N-(4-(4-(5-methoxybenzo[d]isoxazol-...)
Show SMILES COc1ccc2onc(N3CCN(CCCCNC(=O)c4cccc(c4)N4CCOCC4)CC3)c2c1
Show InChI InChI=1S/C27H35N5O4/c1-34-23-7-8-25-24(20-23)26(29-36-25)32-13-11-30(12-14-32)10-3-2-9-28-27(33)21-5-4-6-22(19-21)31-15-17-35-18-16-31/h4-8,19-20H,2-3,9-18H2,1H3,(H,28,33)
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>1.00E+3n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]spiroperidol from cloned human dopamine receptor D2(long) expressed in rat C6 glioma cells


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50180283
PNG
(CHEMBL424667 | N-(4-(4-(2-methoxyphenyl)piperazin-...)
Show SMILES COc1ccccc1N1CCN(CCCCNC(=O)c2ccc3nonc3c2)CC1
Show InChI InChI=1S/C22H27N5O3/c1-29-21-7-3-2-6-20(21)27-14-12-26(13-15-27)11-5-4-10-23-22(28)17-8-9-18-19(16-17)25-30-24-18/h2-3,6-9,16H,4-5,10-15H2,1H3,(H,23,28)
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>1.00E+3n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]spiroperidol from cloned human dopamine receptor D2(long) expressed in rat C6 glioma cells


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50180293
PNG
(3-(1H-imidazol-1-yl)-N-(4-(4-(5-methoxybenzo[d]iso...)
Show SMILES COc1ccc2onc(N3CCN(CCCCNC(=O)c4cccc(c4)-n4ccnc4)CC3)c2c1
Show InChI InChI=1S/C26H30N6O3/c1-34-22-7-8-24-23(18-22)25(29-35-24)31-15-13-30(14-16-31)11-3-2-9-28-26(33)20-5-4-6-21(17-20)32-12-10-27-19-32/h4-8,10,12,17-19H,2-3,9,11,13-16H2,1H3,(H,28,33)
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>1.00E+3n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]spiroperidol from cloned human dopamine receptor D2(long) expressed in rat C6 glioma cells


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50180300
PNG
(CHEMBL197762 | N-(4-(4-(5-methoxybenzo[d]isoxazol-...)
Show SMILES COc1ccc2onc(N3CCN(CCCCNC(=O)c4cccc(c4)-c4ncccn4)CC3)c2c1
Show InChI InChI=1S/C27H30N6O3/c1-35-22-8-9-24-23(19-22)26(31-36-24)33-16-14-32(15-17-33)13-3-2-10-30-27(34)21-7-4-6-20(18-21)25-28-11-5-12-29-25/h4-9,11-12,18-19H,2-3,10,13-17H2,1H3,(H,30,34)
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>1.00E+3n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]spiroperidol from cloned human dopamine receptor D2(long) expressed in rat C6 glioma cells


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50180300
PNG
(CHEMBL197762 | N-(4-(4-(5-methoxybenzo[d]isoxazol-...)
Show SMILES COc1ccc2onc(N3CCN(CCCCNC(=O)c4cccc(c4)-c4ncccn4)CC3)c2c1
Show InChI InChI=1S/C27H30N6O3/c1-35-22-8-9-24-23(19-22)26(31-36-24)33-16-14-32(15-17-33)13-3-2-10-30-27(34)21-7-4-6-20(18-21)25-28-11-5-12-29-25/h4-9,11-12,18-19H,2-3,10,13-17H2,1H3,(H,30,34)
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1.14E+3n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


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


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50180289
PNG
(7-methoxy-N-(4-(4-(quinoxalin-5-yl)piperazin-1-yl)...)
Show SMILES COc1cccc2cc(oc12)C(=O)NCCCCN1CCN(CC1)c1cccc2nccnc12
Show InChI InChI=1S/C26H29N5O3/c1-33-22-9-4-6-19-18-23(34-25(19)22)26(32)29-10-2-3-13-30-14-16-31(17-15-30)21-8-5-7-20-24(21)28-12-11-27-20/h4-9,11-12,18H,2-3,10,13-17H2,1H3,(H,29,32)
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1.25E+3n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]spiroperidol from cloned human dopamine receptor D2(long) expressed in rat C6 glioma cells


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50180281
PNG
(CHEMBL426834 | N-(4-(4-(5-methoxybenzo[d]isoxazol-...)
Show SMILES COc1ccc2onc(N3CCN(CCCCNC(=O)c4cccc(c4)-c4noc(C)n4)CC3)c2c1
Show InChI InChI=1S/C26H30N6O4/c1-18-28-24(29-35-18)19-6-5-7-20(16-19)26(33)27-10-3-4-11-31-12-14-32(15-13-31)25-22-17-21(34-2)8-9-23(22)36-30-25/h5-9,16-17H,3-4,10-15H2,1-2H3,(H,27,33)
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1.29E+3n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


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


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50180277
PNG
(CHEMBL199480 | N-(4-(4-(5-methoxybenzo[d]isoxazol-...)
Show SMILES COc1ccc2onc(N3CCN(CCCCNC(=O)c4cccc(c4)N4CCOCC4)CC3)c2c1
Show InChI InChI=1S/C27H35N5O4/c1-34-23-7-8-25-24(20-23)26(29-36-25)32-13-11-30(12-14-32)10-3-2-9-28-27(33)21-5-4-6-22(19-21)31-15-17-35-18-16-31/h4-8,19-20H,2-3,9-18H2,1H3,(H,28,33)
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1.44E+3n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


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


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50180295
PNG
(CHEMBL201275 | N-(4-(4-(5-methoxybenzo[d]isoxazol-...)
Show SMILES COc1ccc2onc(N3CCN(CCCCNC(=O)c4cc5ccccc5oc4=O)CC3)c2c1
Show InChI InChI=1S/C26H28N4O5/c1-33-19-8-9-23-20(17-19)24(28-35-23)30-14-12-29(13-15-30)11-5-4-10-27-25(31)21-16-18-6-2-3-7-22(18)34-26(21)32/h2-3,6-9,16-17H,4-5,10-15H2,1H3,(H,27,31)
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>2.70E+3n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


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


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50180293
PNG
(3-(1H-imidazol-1-yl)-N-(4-(4-(5-methoxybenzo[d]iso...)
Show SMILES COc1ccc2onc(N3CCN(CCCCNC(=O)c4cccc(c4)-n4ccnc4)CC3)c2c1
Show InChI InChI=1S/C26H30N6O3/c1-34-22-7-8-24-23(18-22)25(29-35-24)31-15-13-30(14-16-31)11-3-2-9-28-26(33)20-5-4-6-21(17-20)32-12-10-27-19-32/h4-8,10,12,17-19H,2-3,9,11,13-16H2,1H3,(H,28,33)
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5.54E+3n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


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


J Med Chem 49: 358-65 (2006)


Article DOI: 10.1021/jm050734s
BindingDB Entry DOI: 10.7270/Q2TX3F0W
More data for this
Ligand-Target Pair
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