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PubMed code 22607670

Compile data set for download or QSAR
Found 34 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))		BDBM50384195
PNG
(CHEMBL2029930)
Show SMILES O=C(Nc1ccncc1)Nc1cccc(CCN2CCN(CC2)c2ccccc2)c1
Show InChI InChI=1S/C24H27N5O/c30-24(26-21-9-12-25-13-10-21)27-22-6-4-5-20(19-22)11-14-28-15-17-29(18-16-28)23-7-2-1-3-8-23/h1-10,12-13,19H,11,14-18H2,(H2,25,26,27,30)
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 0.5n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Displacement of [3H]8OH-DPAT from human 5HT1A receptor expressed in CHO -K1 cell membrane after 60 mins by liquid scintillation counting

Bioorg Med Chem Lett 22: 3967-72 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.098
BindingDB Entry DOI: 10.7270/Q21837HF
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))		BDBM50384188
PNG
(CHEMBL2029923)
Show SMILES O=C(Cc1ccccc1)Nc1cccc(CCN2CCN(CC2)c2ccccc2)c1
Show InChI InChI=1S/C26H29N3O/c30-26(21-22-8-3-1-4-9-22)27-24-11-7-10-23(20-24)14-15-28-16-18-29(19-17-28)25-12-5-2-6-13-25/h1-13,20H,14-19,21H2,(H,27,30)
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 0.580n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Displacement of [3H]8OH-DPAT from human 5HT1A receptor expressed in CHO -K1 cell membrane after 60 mins by liquid scintillation counting

Bioorg Med Chem Lett 22: 3967-72 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.098
BindingDB Entry DOI: 10.7270/Q21837HF
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))		BDBM50384194
PNG
(CHEMBL2029929)
Show SMILES O=C(Nc1cccnc1)Nc1cccc(CCN2CCN(CC2)c2ccccc2)c1
Show InChI InChI=1S/C24H27N5O/c30-24(27-22-8-5-12-25-19-22)26-21-7-4-6-20(18-21)11-13-28-14-16-29(17-15-28)23-9-2-1-3-10-23/h1-10,12,18-19H,11,13-17H2,(H2,26,27,30)
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 0.950n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Displacement of [3H]8OH-DPAT from human 5HT1A receptor expressed in CHO -K1 cell membrane after 60 mins by liquid scintillation counting

Bioorg Med Chem Lett 22: 3967-72 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.098
BindingDB Entry DOI: 10.7270/Q21837HF
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))		BDBM50384190
PNG
(CHEMBL2029925)
Show SMILES O=C(Cc1cccnc1)Nc1cccc(CCN2CCN(CC2)c2ccccc2)c1
Show InChI InChI=1S/C25H28N4O/c30-25(19-22-7-5-12-26-20-22)27-23-8-4-6-21(18-23)11-13-28-14-16-29(17-15-28)24-9-2-1-3-10-24/h1-10,12,18,20H,11,13-17,19H2,(H,27,30)
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 1.39n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Displacement of [3H]8OH-DPAT from human 5HT1A receptor expressed in CHO -K1 cell membrane after 60 mins by liquid scintillation counting

Bioorg Med Chem Lett 22: 3967-72 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.098
BindingDB Entry DOI: 10.7270/Q21837HF
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))		BDBM50384191
PNG
(CHEMBL2029926)
Show SMILES O=C(Cc1ccncc1)Nc1cccc(CCN2CCN(CC2)c2ccccc2)c1
Show InChI InChI=1S/C25H28N4O/c30-25(20-22-9-12-26-13-10-22)27-23-6-4-5-21(19-23)11-14-28-15-17-29(18-16-28)24-7-2-1-3-8-24/h1-10,12-13,19H,11,14-18,20H2,(H,27,30)
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 2.26n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Displacement of [3H]8OH-DPAT from human 5HT1A receptor expressed in CHO -K1 cell membrane after 60 mins by liquid scintillation counting

Bioorg Med Chem Lett 22: 3967-72 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.098
BindingDB Entry DOI: 10.7270/Q21837HF
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50384187
PNG
(CHEMBL2029922)
Show SMILES O=C(Nc1ccncc1)Nc1ccc(CCN2CCN(CC2)c2ccccc2)cc1
Show InChI InChI=1S/C24H27N5O/c30-24(27-22-10-13-25-14-11-22)26-21-8-6-20(7-9-21)12-15-28-16-18-29(19-17-28)23-4-2-1-3-5-23/h1-11,13-14H,12,15-19H2,(H2,25,26,27,30)
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 3.60n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human D2 DA receptor expressed in CHO cell membrane after 60 mins by liquid scintillation counting

Bioorg Med Chem Lett 22: 3967-72 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.098
BindingDB Entry DOI: 10.7270/Q21837HF
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))		BDBM50384189
PNG
(CHEMBL2029924)
Show SMILES O=C(Cc1ccccn1)Nc1cccc(CCN2CCN(CC2)c2ccccc2)c1
Show InChI InChI=1S/C25H28N4O/c30-25(20-22-8-4-5-13-26-22)27-23-9-6-7-21(19-23)12-14-28-15-17-29(18-16-28)24-10-2-1-3-11-24/h1-11,13,19H,12,14-18,20H2,(H,27,30)
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 4.73n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Displacement of [3H]8OH-DPAT from human 5HT1A receptor expressed in CHO -K1 cell membrane after 60 mins by liquid scintillation counting

Bioorg Med Chem Lett 22: 3967-72 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.098
BindingDB Entry DOI: 10.7270/Q21837HF
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))		BDBM50384192
PNG
(CHEMBL2029927)
Show SMILES O=C(Nc1ccccc1)Nc1cccc(CCN2CCN(CC2)c2ccccc2)c1
Show InChI InChI=1S/C25H28N4O/c30-25(26-22-9-3-1-4-10-22)27-23-11-7-8-21(20-23)14-15-28-16-18-29(19-17-28)24-12-5-2-6-13-24/h1-13,20H,14-19H2,(H2,26,27,30)
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 5.78n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Displacement of [3H]8OH-DPAT from human 5HT1A receptor expressed in CHO -K1 cell membrane after 60 mins by liquid scintillation counting

Bioorg Med Chem Lett 22: 3967-72 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.098
BindingDB Entry DOI: 10.7270/Q21837HF
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))		BDBM50384193
PNG
(CHEMBL2029928)
Show SMILES O=C(Nc1cccc(CCN2CCN(CC2)c2ccccc2)c1)Nc1ccccn1
Show InChI InChI=1S/C24H27N5O/c30-24(27-23-11-4-5-13-25-23)26-21-8-6-7-20(19-21)12-14-28-15-17-29(18-16-28)22-9-2-1-3-10-22/h1-11,13,19H,12,14-18H2,(H2,25,26,27,30)
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 7.53n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Displacement of [3H]8OH-DPAT from human 5HT1A receptor expressed in CHO -K1 cell membrane after 60 mins by liquid scintillation counting

Bioorg Med Chem Lett 22: 3967-72 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.098
BindingDB Entry DOI: 10.7270/Q21837HF
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50384186
PNG
(CHEMBL2029921)
Show SMILES O=C(Nc1ccc(CCN2CCN(CC2)c2ccccc2)cc1)Nc1cccnc1
Show InChI InChI=1S/C24H27N5O/c30-24(27-22-5-4-13-25-19-22)26-21-10-8-20(9-11-21)12-14-28-15-17-29(18-16-28)23-6-2-1-3-7-23/h1-11,13,19H,12,14-18H2,(H2,26,27,30)
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 8.20n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human D2 DA receptor expressed in CHO cell membrane after 60 mins by liquid scintillation counting

Bioorg Med Chem Lett 22: 3967-72 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.098
BindingDB Entry DOI: 10.7270/Q21837HF
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50384185
PNG
(CHEMBL2029920)
Show SMILES O=C(Nc1ccc(CCN2CCN(CC2)c2ccccc2)cc1)Nc1ccccn1
Show InChI InChI=1S/C24H27N5O/c30-24(27-23-8-4-5-14-25-23)26-21-11-9-20(10-12-21)13-15-28-16-18-29(19-17-28)22-6-2-1-3-7-22/h1-12,14H,13,15-19H2,(H2,25,26,27,30)
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 14.2n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human D2 DA receptor expressed in CHO cell membrane after 60 mins by liquid scintillation counting

Bioorg Med Chem Lett 22: 3967-72 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.098
BindingDB Entry DOI: 10.7270/Q21837HF
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50384194
PNG
(CHEMBL2029929)
Show SMILES O=C(Nc1cccnc1)Nc1cccc(CCN2CCN(CC2)c2ccccc2)c1
Show InChI InChI=1S/C24H27N5O/c30-24(27-22-8-5-12-25-19-22)26-21-7-4-6-20(18-21)11-13-28-14-16-29(17-15-28)23-9-2-1-3-10-23/h1-10,12,18-19H,11,13-17H2,(H2,26,27,30)
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 29.7n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human D2 DA receptor expressed in CHO cell membrane after 60 mins by liquid scintillation counting

Bioorg Med Chem Lett 22: 3967-72 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.098
BindingDB Entry DOI: 10.7270/Q21837HF
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))		BDBM50384196
PNG
(CHEMBL2029931)
Show SMILES C(Cc1ccccc1)N1CCN(CC1)c1ccccc1
Show InChI InChI=1S/C18H22N2/c1-3-7-17(8-4-1)11-12-19-13-15-20(16-14-19)18-9-5-2-6-10-18/h1-10H,11-16H2
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 43.2n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Displacement of [3H]8OH-DPAT from human 5HT1A receptor expressed in CHO -K1 cell membrane after 60 mins by liquid scintillation counting

Bioorg Med Chem Lett 22: 3967-72 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.098
BindingDB Entry DOI: 10.7270/Q21837HF
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50384183
PNG
(CHEMBL2029918)
Show SMILES O=C(Cc1ccncc1)Nc1ccc(CCN2CCN(CC2)c2ccccc2)cc1
Show InChI InChI=1S/C25H28N4O/c30-25(20-22-10-13-26-14-11-22)27-23-8-6-21(7-9-23)12-15-28-16-18-29(19-17-28)24-4-2-1-3-5-24/h1-11,13-14H,12,15-20H2,(H,27,30)
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 48.6n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human D2 DA receptor expressed in CHO cell membrane after 60 mins by liquid scintillation counting

Bioorg Med Chem Lett 22: 3967-72 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.098
BindingDB Entry DOI: 10.7270/Q21837HF
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50384195
PNG
(CHEMBL2029930)
Show SMILES O=C(Nc1ccncc1)Nc1cccc(CCN2CCN(CC2)c2ccccc2)c1
Show InChI InChI=1S/C24H27N5O/c30-24(26-21-9-12-25-13-10-21)27-22-6-4-5-20(19-22)11-14-28-15-17-29(18-16-28)23-7-2-1-3-8-23/h1-10,12-13,19H,11,14-18H2,(H2,25,26,27,30)
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 48.7n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human D2 DA receptor expressed in CHO cell membrane after 60 mins by liquid scintillation counting

Bioorg Med Chem Lett 22: 3967-72 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.098
BindingDB Entry DOI: 10.7270/Q21837HF
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50384182
PNG
(CHEMBL2029917)
Show SMILES O=C(Cc1cccnc1)Nc1ccc(CCN2CCN(CC2)c2ccccc2)cc1
Show InChI InChI=1S/C25H28N4O/c30-25(19-22-5-4-13-26-20-22)27-23-10-8-21(9-11-23)12-14-28-15-17-29(18-16-28)24-6-2-1-3-7-24/h1-11,13,20H,12,14-19H2,(H,27,30)
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 69.6n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human D2 DA receptor expressed in CHO cell membrane after 60 mins by liquid scintillation counting

Bioorg Med Chem Lett 22: 3967-72 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.098
BindingDB Entry DOI: 10.7270/Q21837HF
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50384181
PNG
(CHEMBL2029916)
Show SMILES O=C(Cc1ccccn1)Nc1ccc(CCN2CCN(CC2)c2ccccc2)cc1
Show InChI InChI=1S/C25H28N4O/c30-25(20-23-6-4-5-14-26-23)27-22-11-9-21(10-12-22)13-15-28-16-18-29(19-17-28)24-7-2-1-3-8-24/h1-12,14H,13,15-20H2,(H,27,30)
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 70.7n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human D2 DA receptor expressed in CHO cell membrane after 60 mins by liquid scintillation counting

Bioorg Med Chem Lett 22: 3967-72 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.098
BindingDB Entry DOI: 10.7270/Q21837HF
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50384190
PNG
(CHEMBL2029925)
Show SMILES O=C(Cc1cccnc1)Nc1cccc(CCN2CCN(CC2)c2ccccc2)c1
Show InChI InChI=1S/C25H28N4O/c30-25(19-22-7-5-12-26-20-22)27-23-8-4-6-21(18-23)11-13-28-14-16-29(17-15-28)24-9-2-1-3-10-24/h1-10,12,18,20H,11,13-17,19H2,(H,27,30)
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 82.4n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human D2 DA receptor expressed in CHO cell membrane after 60 mins by liquid scintillation counting

Bioorg Med Chem Lett 22: 3967-72 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.098
BindingDB Entry DOI: 10.7270/Q21837HF
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))		BDBM50384181
PNG
(CHEMBL2029916)
Show SMILES O=C(Cc1ccccn1)Nc1ccc(CCN2CCN(CC2)c2ccccc2)cc1
Show InChI InChI=1S/C25H28N4O/c30-25(20-23-6-4-5-14-26-23)27-22-11-9-21(10-12-22)13-15-28-16-18-29(19-17-28)24-7-2-1-3-8-24/h1-12,14H,13,15-20H2,(H,27,30)
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 95.3n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Displacement of [3H]8OH-DPAT from human 5HT1A receptor expressed in CHO -K1 cell membrane after 60 mins by liquid scintillation counting

Bioorg Med Chem Lett 22: 3967-72 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.098
BindingDB Entry DOI: 10.7270/Q21837HF
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))		BDBM50384183
PNG
(CHEMBL2029918)
Show SMILES O=C(Cc1ccncc1)Nc1ccc(CCN2CCN(CC2)c2ccccc2)cc1
Show InChI InChI=1S/C25H28N4O/c30-25(20-22-10-13-26-14-11-22)27-23-8-6-21(7-9-23)12-15-28-16-18-29(19-17-28)24-4-2-1-3-5-24/h1-11,13-14H,12,15-20H2,(H,27,30)
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 123n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Displacement of [3H]8OH-DPAT from human 5HT1A receptor expressed in CHO -K1 cell membrane after 60 mins by liquid scintillation counting

Bioorg Med Chem Lett 22: 3967-72 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.098
BindingDB Entry DOI: 10.7270/Q21837HF
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))		BDBM50384185
PNG
(CHEMBL2029920)
Show SMILES O=C(Nc1ccc(CCN2CCN(CC2)c2ccccc2)cc1)Nc1ccccn1
Show InChI InChI=1S/C24H27N5O/c30-24(27-23-8-4-5-14-25-23)26-21-11-9-20(10-12-21)13-15-28-16-18-29(19-17-28)22-6-2-1-3-7-22/h1-12,14H,13,15-19H2,(H2,25,26,27,30)
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 126n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Displacement of [3H]8OH-DPAT from human 5HT1A receptor expressed in CHO -K1 cell membrane after 60 mins by liquid scintillation counting

Bioorg Med Chem Lett 22: 3967-72 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.098
BindingDB Entry DOI: 10.7270/Q21837HF
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))		BDBM50384182
PNG
(CHEMBL2029917)
Show SMILES O=C(Cc1cccnc1)Nc1ccc(CCN2CCN(CC2)c2ccccc2)cc1
Show InChI InChI=1S/C25H28N4O/c30-25(19-22-5-4-13-26-20-22)27-23-10-8-21(9-11-23)12-14-28-15-17-29(18-16-28)24-6-2-1-3-7-24/h1-11,13,20H,12,14-19H2,(H,27,30)
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 160n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Displacement of [3H]8OH-DPAT from human 5HT1A receptor expressed in CHO -K1 cell membrane after 60 mins by liquid scintillation counting

Bioorg Med Chem Lett 22: 3967-72 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.098
BindingDB Entry DOI: 10.7270/Q21837HF
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50384191
PNG
(CHEMBL2029926)
Show SMILES O=C(Cc1ccncc1)Nc1cccc(CCN2CCN(CC2)c2ccccc2)c1
Show InChI InChI=1S/C25H28N4O/c30-25(20-22-9-12-26-13-10-22)27-23-6-4-5-21(19-23)11-14-28-15-17-29(18-16-28)24-7-2-1-3-8-24/h1-10,12-13,19H,11,14-18,20H2,(H,27,30)
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 202n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human D2 DA receptor expressed in CHO cell membrane after 60 mins by liquid scintillation counting

Bioorg Med Chem Lett 22: 3967-72 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.098
BindingDB Entry DOI: 10.7270/Q21837HF
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))		BDBM50384187
PNG
(CHEMBL2029922)
Show SMILES O=C(Nc1ccncc1)Nc1ccc(CCN2CCN(CC2)c2ccccc2)cc1
Show InChI InChI=1S/C24H27N5O/c30-24(27-22-10-13-25-14-11-22)26-21-8-6-20(7-9-21)12-15-28-16-18-29(19-17-28)23-4-2-1-3-5-23/h1-11,13-14H,12,15-19H2,(H2,25,26,27,30)
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 227n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Displacement of [3H]8OH-DPAT from human 5HT1A receptor expressed in CHO -K1 cell membrane after 60 mins by liquid scintillation counting

Bioorg Med Chem Lett 22: 3967-72 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.098
BindingDB Entry DOI: 10.7270/Q21837HF
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50384189
PNG
(CHEMBL2029924)
Show SMILES O=C(Cc1ccccn1)Nc1cccc(CCN2CCN(CC2)c2ccccc2)c1
Show InChI InChI=1S/C25H28N4O/c30-25(20-22-8-4-5-13-26-22)27-23-9-6-7-21(19-23)12-14-28-15-17-29(18-16-28)24-10-2-1-3-11-24/h1-11,13,19H,12,14-18,20H2,(H,27,30)
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 278n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human D2 DA receptor expressed in CHO cell membrane after 60 mins by liquid scintillation counting

Bioorg Med Chem Lett 22: 3967-72 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.098
BindingDB Entry DOI: 10.7270/Q21837HF
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50384193
PNG
(CHEMBL2029928)
Show SMILES O=C(Nc1cccc(CCN2CCN(CC2)c2ccccc2)c1)Nc1ccccn1
Show InChI InChI=1S/C24H27N5O/c30-24(27-23-11-4-5-13-25-23)26-21-8-6-7-20(19-21)12-14-28-15-17-29(18-16-28)22-9-2-1-3-10-22/h1-11,13,19H,12,14-18H2,(H2,25,26,27,30)
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 364n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human D2 DA receptor expressed in CHO cell membrane after 60 mins by liquid scintillation counting

Bioorg Med Chem Lett 22: 3967-72 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.098
BindingDB Entry DOI: 10.7270/Q21837HF
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))		BDBM50384186
PNG
(CHEMBL2029921)
Show SMILES O=C(Nc1ccc(CCN2CCN(CC2)c2ccccc2)cc1)Nc1cccnc1
Show InChI InChI=1S/C24H27N5O/c30-24(27-22-5-4-13-25-19-22)26-21-10-8-20(9-11-21)12-14-28-15-17-29(18-16-28)23-6-2-1-3-7-23/h1-11,13,19H,12,14-18H2,(H2,26,27,30)
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 398n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Displacement of [3H]8OH-DPAT from human 5HT1A receptor expressed in CHO -K1 cell membrane after 60 mins by liquid scintillation counting

Bioorg Med Chem Lett 22: 3967-72 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.098
BindingDB Entry DOI: 10.7270/Q21837HF
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50384196
PNG
(CHEMBL2029931)
Show SMILES C(Cc1ccccc1)N1CCN(CC1)c1ccccc1
Show InChI InChI=1S/C18H22N2/c1-3-7-17(8-4-1)11-12-19-13-15-20(16-14-19)18-9-5-2-6-10-18/h1-10H,11-16H2
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 478n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human D2 DA receptor expressed in CHO cell membrane after 60 mins by liquid scintillation counting

Bioorg Med Chem Lett 22: 3967-72 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.098
BindingDB Entry DOI: 10.7270/Q21837HF
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50384184
PNG
(CHEMBL2029919)
Show SMILES O=C(Nc1ccccc1)Nc1ccc(CCN2CCN(CC2)c2ccccc2)cc1
Show InChI InChI=1S/C25H28N4O/c30-25(26-22-7-3-1-4-8-22)27-23-13-11-21(12-14-23)15-16-28-17-19-29(20-18-28)24-9-5-2-6-10-24/h1-14H,15-20H2,(H2,26,27,30)
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 483n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human D2 DA receptor expressed in CHO cell membrane after 60 mins by liquid scintillation counting

Bioorg Med Chem Lett 22: 3967-72 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.098
BindingDB Entry DOI: 10.7270/Q21837HF
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))		BDBM50384180
PNG
(CHEMBL2029915)
Show SMILES O=C(Cc1ccccc1)Nc1ccc(CCN2CCN(CC2)c2ccccc2)cc1
Show InChI InChI=1S/C26H29N3O/c30-26(21-23-7-3-1-4-8-23)27-24-13-11-22(12-14-24)15-16-28-17-19-29(20-18-28)25-9-5-2-6-10-25/h1-14H,15-21H2,(H,27,30)
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 903n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Displacement of [3H]8OH-DPAT from human 5HT1A receptor expressed in CHO -K1 cell membrane after 60 mins by liquid scintillation counting

Bioorg Med Chem Lett 22: 3967-72 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.098
BindingDB Entry DOI: 10.7270/Q21837HF
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))		BDBM50384184
PNG
(CHEMBL2029919)
Show SMILES O=C(Nc1ccccc1)Nc1ccc(CCN2CCN(CC2)c2ccccc2)cc1
Show InChI InChI=1S/C25H28N4O/c30-25(26-22-7-3-1-4-8-22)27-23-13-11-21(12-14-23)15-16-28-17-19-29(20-18-28)24-9-5-2-6-10-24/h1-14H,15-20H2,(H2,26,27,30)
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 2.26E+3n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Displacement of [3H]8OH-DPAT from human 5HT1A receptor expressed in CHO -K1 cell membrane after 60 mins by liquid scintillation counting

Bioorg Med Chem Lett 22: 3967-72 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.098
BindingDB Entry DOI: 10.7270/Q21837HF
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50384192
PNG
(CHEMBL2029927)
Show SMILES O=C(Nc1ccccc1)Nc1cccc(CCN2CCN(CC2)c2ccccc2)c1
Show InChI InChI=1S/C25H28N4O/c30-25(26-22-9-3-1-4-10-22)27-23-11-7-8-21(20-23)14-15-28-16-18-29(19-17-28)24-12-5-2-6-13-24/h1-13,20H,14-19H2,(H2,26,27,30)
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 3.25E+3n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human D2 DA receptor expressed in CHO cell membrane after 60 mins by liquid scintillation counting

Bioorg Med Chem Lett 22: 3967-72 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.098
BindingDB Entry DOI: 10.7270/Q21837HF
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50384188
PNG
(CHEMBL2029923)
Show SMILES O=C(Cc1ccccc1)Nc1cccc(CCN2CCN(CC2)c2ccccc2)c1
Show InChI InChI=1S/C26H29N3O/c30-26(21-22-8-3-1-4-9-22)27-24-11-7-10-23(20-24)14-15-28-16-18-29(19-17-28)25-12-5-2-6-13-25/h1-13,20H,14-19,21H2,(H,27,30)
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 3.58E+3n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human D2 DA receptor expressed in CHO cell membrane after 60 mins by liquid scintillation counting

Bioorg Med Chem Lett 22: 3967-72 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.098
BindingDB Entry DOI: 10.7270/Q21837HF
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50384180
PNG
(CHEMBL2029915)
Show SMILES O=C(Cc1ccccc1)Nc1ccc(CCN2CCN(CC2)c2ccccc2)cc1
Show InChI InChI=1S/C26H29N3O/c30-26(21-23-7-3-1-4-8-23)27-24-13-11-22(12-14-24)15-16-28-17-19-29(20-18-28)25-9-5-2-6-10-25/h1-14H,15-21H2,(H,27,30)
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 4.19E+3n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human D2 DA receptor expressed in CHO cell membrane after 60 mins by liquid scintillation counting

Bioorg Med Chem Lett 22: 3967-72 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.098
BindingDB Entry DOI: 10.7270/Q21837HF
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%