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Compile Data Set for Download or QSAR

Found 540 hits with Last Name = 'voshavar' and Initial = 'c'   
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))
BDBM50568920
PNG
(CHEMBL4846823)
Show SMILES CC1(CCCN2CCN(CC2)c2ccccn2)Cc2cc(Cl)ccc2C1=O
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0.740n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor incubated for 1 hr by liquid scintillation counting method


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113243
BindingDB Entry DOI: 10.7270/Q29C726C
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50568920
PNG
(CHEMBL4846823)
Show SMILES CC1(CCCN2CCN(CC2)c2ccccn2)Cc2cc(Cl)ccc2C1=O
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0.741n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor incubated for 1 hr by liquid scintillation counting method


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113243
BindingDB Entry DOI: 10.7270/Q29C726C
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50362863
PNG
(CHEMBL1940418)
Show SMILES Fc1ccc(CCCCN2CCN(CC2)c2ccccn2)cc1
Show InChI InChI=1S/C19H24FN3/c20-18-9-7-17(8-10-18)5-2-4-12-22-13-15-23(16-14-22)19-6-1-3-11-21-19/h1,3,6-11H,2,4-5,12-16H2
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1.10n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor incubated for 1 hr by liquid scintillation counting method


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113243
BindingDB Entry DOI: 10.7270/Q29C726C
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50362863
PNG
(CHEMBL1940418)
Show SMILES Fc1ccc(CCCCN2CCN(CC2)c2ccccn2)cc1
Show InChI InChI=1S/C19H24FN3/c20-18-9-7-17(8-10-18)5-2-4-12-22-13-15-23(16-14-22)19-6-1-3-11-21-19/h1,3,6-11H,2,4-5,12-16H2
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1.10n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-WAY100635 from 5HT1A receptor (unknown origin)


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115943
BindingDB Entry DOI: 10.7270/Q24B34X6
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (Human))
BDBM50523097
PNG
(CHEMBL4533305)
Show SMILES Fc1ccc(cc1)C(=O)CCCN1CCCN(CC1)c1ccccn1
Show InChI InChI=1S/C20H24FN3O/c21-18-9-7-17(8-10-18)19(25)5-3-12-23-13-4-14-24(16-15-23)20-6-1-2-11-22-20/h1-2,6-11H,3-5,12-16H2
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1.20n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-ketanserin from human 5HT2A receptor by liquid scintillation counting


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115943
BindingDB Entry DOI: 10.7270/Q24B34X6
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (Human))
BDBM50523097
PNG
(CHEMBL4533305)
Show SMILES Fc1ccc(cc1)C(=O)CCCN1CCCN(CC1)c1ccccn1
Show InChI InChI=1S/C20H24FN3O/c21-18-9-7-17(8-10-18)19(25)5-3-12-23-13-4-14-24(16-15-23)20-6-1-2-11-22-20/h1-2,6-11H,3-5,12-16H2
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1.20n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-ketanserin from human 5HT2A receptor by liquid scintillation counting


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115943
BindingDB Entry DOI: 10.7270/Q24B34X6
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50568924
PNG
(CHEMBL4862180)
Show SMILES Clc1ccc2C(=O)C(CCCN3CCN(CC3)c3ccccn3)Cc2c1
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2.30n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor incubated for 1 hr by liquid scintillation counting method


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113243
BindingDB Entry DOI: 10.7270/Q29C726C
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50568924
PNG
(CHEMBL4862180)
Show SMILES Clc1ccc2C(=O)C(CCCN3CCN(CC3)c3ccccn3)Cc2c1
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2.30n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor incubated for 1 hr by liquid scintillation counting method


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113243
BindingDB Entry DOI: 10.7270/Q29C726C
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50568921
PNG
(CHEMBL4871868)
Show SMILES CC1(CCCCN2CCN(CC2)c2ccccn2)Cc2cc(Cl)ccc2C1=O
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2.40n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor incubated for 1 hr by liquid scintillation counting method


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113243
BindingDB Entry DOI: 10.7270/Q29C726C
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50568921
PNG
(CHEMBL4871868)
Show SMILES CC1(CCCCN2CCN(CC2)c2ccccn2)Cc2cc(Cl)ccc2C1=O
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2.5n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor incubated for 1 hr by liquid scintillation counting method


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113243
BindingDB Entry DOI: 10.7270/Q29C726C
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50130293
PNG
(7-{4-[4-(2,3-dichlorophenyl)piperazin-1-yl]butoxy}...)
Show SMILES Clc1cccc(N2CCN(CCCCOc3ccc4CCC(=O)Nc4c3)CC2)c1Cl
Show InChI InChI=1S/C23H27Cl2N3O2/c24-19-4-3-5-21(23(19)25)28-13-11-27(12-14-28)10-1-2-15-30-18-8-6-17-7-9-22(29)26-20(17)16-18/h3-6,8,16H,1-2,7,9-15H2,(H,26,29)
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3.30n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]N-methylspiperone from human dopamine D2 receptor incubated for 1 hr by liquid scintillation counting method


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113243
BindingDB Entry DOI: 10.7270/Q29C726C
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50130293
PNG
(7-{4-[4-(2,3-dichlorophenyl)piperazin-1-yl]butoxy}...)
Show SMILES Clc1cccc(N2CCN(CCCCOc3ccc4CCC(=O)Nc4c3)CC2)c1Cl
Show InChI InChI=1S/C23H27Cl2N3O2/c24-19-4-3-5-21(23(19)25)28-13-11-27(12-14-28)10-1-2-15-30-18-8-6-17-7-9-22(29)26-20(17)16-18/h3-6,8,16H,1-2,7,9-15H2,(H,26,29)
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3.30n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D2 receptor by liquid scintillation counting


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115943
BindingDB Entry DOI: 10.7270/Q24B34X6
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50362863
PNG
(CHEMBL1940418)
Show SMILES Fc1ccc(CCCCN2CCN(CC2)c2ccccn2)cc1
Show InChI InChI=1S/C19H24FN3/c20-18-9-7-17(8-10-18)5-2-4-12-22-13-15-23(16-14-22)19-6-1-3-11-21-19/h1,3,6-11H,2,4-5,12-16H2
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3.5n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-methylspiperone from dopamine D4 receptor (unknown origin)


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115943
BindingDB Entry DOI: 10.7270/Q24B34X6
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50362863
PNG
(CHEMBL1940418)
Show SMILES Fc1ccc(CCCCN2CCN(CC2)c2ccccn2)cc1
Show InChI InChI=1S/C19H24FN3/c20-18-9-7-17(8-10-18)5-2-4-12-22-13-15-23(16-14-22)19-6-1-3-11-21-19/h1,3,6-11H,2,4-5,12-16H2
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3.5n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]N-methylspiperone from human dopamine D4 receptor incubated for 1 hr by liquid scintillation counting method


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113243
BindingDB Entry DOI: 10.7270/Q29C726C
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50568919
PNG
(CHEMBL4857665)
Show SMILES Clc1ccc2C(=O)C(CCCCN3CCN(CC3)c3ccccn3)Cc2c1
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4.10n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor incubated for 1 hr by liquid scintillation counting method


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113243
BindingDB Entry DOI: 10.7270/Q29C726C
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50568911
PNG
(CHEMBL4857597)
Show SMILES O=C1CCc2cc(CCCCN3CCN(CC3)c3ccccn3)ccc2N1
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4.10n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor incubated for 1 hr by liquid scintillation counting method


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113243
BindingDB Entry DOI: 10.7270/Q29C726C
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50568919
PNG
(CHEMBL4857665)
Show SMILES Clc1ccc2C(=O)C(CCCCN3CCN(CC3)c3ccccn3)Cc2c1
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4.40n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor incubated for 1 hr by liquid scintillation counting method


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113243
BindingDB Entry DOI: 10.7270/Q29C726C
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50568911
PNG
(CHEMBL4857597)
Show SMILES O=C1CCc2cc(CCCCN3CCN(CC3)c3ccccn3)ccc2N1
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4.5n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor incubated for 1 hr by liquid scintillation counting method


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113243
BindingDB Entry DOI: 10.7270/Q29C726C
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50523094
PNG
(CHEMBL4462108)
Show SMILES Fc1ccc(CCCCN2CCN(CC2)c2ccc(Cl)cn2)cc1
Show InChI InChI=1S/C19H23ClFN3/c20-17-6-9-19(22-15-17)24-13-11-23(12-14-24)10-2-1-3-16-4-7-18(21)8-5-16/h4-9,15H,1-3,10-14H2
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4.80n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D4 receptor by liquid scintillation counting


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115943
BindingDB Entry DOI: 10.7270/Q24B34X6
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50523094
PNG
(CHEMBL4462108)
Show SMILES Fc1ccc(CCCCN2CCN(CC2)c2ccc(Cl)cn2)cc1
Show InChI InChI=1S/C19H23ClFN3/c20-17-6-9-19(22-15-17)24-13-11-23(12-14-24)10-2-1-3-16-4-7-18(21)8-5-16/h4-9,15H,1-3,10-14H2
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4.80n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D4 receptor by liquid scintillation counting


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115943
BindingDB Entry DOI: 10.7270/Q24B34X6
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Homo sapiens (Human))
BDBM50568910
PNG
(CHEMBL4845947)
Show SMILES O=C(CCCN1CCN(CC1)c1ccccn1)c1ccc2NC(=O)CCc2c1
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4.80n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-LSD from human 5-HT7 receptor incubated for 1 hr by liquid scintillation counting method


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113243
BindingDB Entry DOI: 10.7270/Q29C726C
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Homo sapiens (Human))
BDBM50568910
PNG
(CHEMBL4845947)
Show SMILES O=C(CCCN1CCN(CC1)c1ccccn1)c1ccc2NC(=O)CCc2c1
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4.80n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-LSD from human 5-HT7 receptor incubated for 1 hr by liquid scintillation counting method


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113243
BindingDB Entry DOI: 10.7270/Q29C726C
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50568917
PNG
(CHEMBL4876297)
Show SMILES Clc1ccc2CC(CCN3CCN(CC3)c3ccccn3)C(=O)c2c1
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5n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor incubated for 1 hr by liquid scintillation counting method


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113243
BindingDB Entry DOI: 10.7270/Q29C726C
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50568917
PNG
(CHEMBL4876297)
Show SMILES Clc1ccc2CC(CCN3CCN(CC3)c3ccccn3)C(=O)c2c1
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5.10n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor incubated for 1 hr by liquid scintillation counting method


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113243
BindingDB Entry DOI: 10.7270/Q29C726C
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50523095
PNG
(CHEMBL4573441)
Show SMILES Fc1ccc(cc1)C(=O)CCCN1CCN(CC1)c1ccc(Cl)cn1
Show InChI InChI=1S/C19H21ClFN3O/c20-16-5-8-19(22-14-16)24-12-10-23(11-13-24)9-1-2-18(25)15-3-6-17(21)7-4-15/h3-8,14H,1-2,9-13H2
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5.10n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D4 receptor by liquid scintillation counting


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115943
BindingDB Entry DOI: 10.7270/Q24B34X6
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50523095
PNG
(CHEMBL4573441)
Show SMILES Fc1ccc(cc1)C(=O)CCCN1CCN(CC1)c1ccc(Cl)cn1
Show InChI InChI=1S/C19H21ClFN3O/c20-16-5-8-19(22-14-16)24-12-10-23(11-13-24)9-1-2-18(25)15-3-6-17(21)7-4-15/h3-8,14H,1-2,9-13H2
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5.10n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D4 receptor by liquid scintillation counting


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115943
BindingDB Entry DOI: 10.7270/Q24B34X6
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50568914
PNG
(CHEMBL4874069)
Show SMILES O=C(CCCN1CCN(CC1)c1ccccn1)c1ccc2CCCc2c1
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5.20n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor incubated for 1 hr by liquid scintillation counting method


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113243
BindingDB Entry DOI: 10.7270/Q29C726C
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50568914
PNG
(CHEMBL4874069)
Show SMILES O=C(CCCN1CCN(CC1)c1ccccn1)c1ccc2CCCc2c1
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5.20n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor incubated for 1 hr by liquid scintillation counting method


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113243
BindingDB Entry DOI: 10.7270/Q29C726C
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50130293
PNG
(7-{4-[4-(2,3-dichlorophenyl)piperazin-1-yl]butoxy}...)
Show SMILES Clc1cccc(N2CCN(CCCCOc3ccc4CCC(=O)Nc4c3)CC2)c1Cl
Show InChI InChI=1S/C23H27Cl2N3O2/c24-19-4-3-5-21(23(19)25)28-13-11-27(12-14-28)10-1-2-15-30-18-8-6-17-7-9-22(29)26-20(17)16-18/h3-6,8,16H,1-2,7,9-15H2,(H,26,29)
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5.60n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor incubated for 1 hr by liquid scintillation counting method


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113243
BindingDB Entry DOI: 10.7270/Q29C726C
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50130293
PNG
(7-{4-[4-(2,3-dichlorophenyl)piperazin-1-yl]butoxy}...)
Show SMILES Clc1cccc(N2CCN(CCCCOc3ccc4CCC(=O)Nc4c3)CC2)c1Cl
Show InChI InChI=1S/C23H27Cl2N3O2/c24-19-4-3-5-21(23(19)25)28-13-11-27(12-14-28)10-1-2-15-30-18-8-6-17-7-9-22(29)26-20(17)16-18/h3-6,8,16H,1-2,7,9-15H2,(H,26,29)
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5.60n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-8-OH-DPAT from human 5HT1A receptor by liquid scintillation counting


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115943
BindingDB Entry DOI: 10.7270/Q24B34X6
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50568916
PNG
(CHEMBL4866058)
Show SMILES Clc1ccc2CC(CCN3CCN(CC3)c3ccccn3)Cc2c1
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6.10n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor incubated for 1 hr by liquid scintillation counting method


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113243
BindingDB Entry DOI: 10.7270/Q29C726C
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50568916
PNG
(CHEMBL4866058)
Show SMILES Clc1ccc2CC(CCN3CCN(CC3)c3ccccn3)Cc2c1
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6.20n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor incubated for 1 hr by liquid scintillation counting method


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113243
BindingDB Entry DOI: 10.7270/Q29C726C
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50036733
PNG
(1-(4-Fluoro-phenyl)-4-(4-pyridin-2-yl-piperazin-1-...)
Show SMILES Fc1ccc(cc1)C(=O)CCCN1CCN(CC1)c1ccccn1
Show InChI InChI=1S/C19H22FN3O/c20-17-8-6-16(7-9-17)18(24)4-3-11-22-12-14-23(15-13-22)19-5-1-2-10-21-19/h1-2,5-10H,3-4,11-15H2
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6.30n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D4 receptor by liquid scintillation counting


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115943
BindingDB Entry DOI: 10.7270/Q24B34X6
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50036733
PNG
(1-(4-Fluoro-phenyl)-4-(4-pyridin-2-yl-piperazin-1-...)
Show SMILES Fc1ccc(cc1)C(=O)CCCN1CCN(CC1)c1ccccn1
Show InChI InChI=1S/C19H22FN3O/c20-17-8-6-16(7-9-17)18(24)4-3-11-22-12-14-23(15-13-22)19-5-1-2-10-21-19/h1-2,5-10H,3-4,11-15H2
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6.30n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]N-methylspiperone from human dopamine D4 receptor incubated for 1 hr by liquid scintillation counting method


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113243
BindingDB Entry DOI: 10.7270/Q29C726C
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50036733
PNG
(1-(4-Fluoro-phenyl)-4-(4-pyridin-2-yl-piperazin-1-...)
Show SMILES Fc1ccc(cc1)C(=O)CCCN1CCN(CC1)c1ccccn1
Show InChI InChI=1S/C19H22FN3O/c20-17-8-6-16(7-9-17)18(24)4-3-11-22-12-14-23(15-13-22)19-5-1-2-10-21-19/h1-2,5-10H,3-4,11-15H2
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6.70n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-N-methylspiperone from human dopamine D4 receptor by liquid scintillation counting


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115943
BindingDB Entry DOI: 10.7270/Q24B34X6
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50036733
PNG
(1-(4-Fluoro-phenyl)-4-(4-pyridin-2-yl-piperazin-1-...)
Show SMILES Fc1ccc(cc1)C(=O)CCCN1CCN(CC1)c1ccccn1
Show InChI InChI=1S/C19H22FN3O/c20-17-8-6-16(7-9-17)18(24)4-3-11-22-12-14-23(15-13-22)19-5-1-2-10-21-19/h1-2,5-10H,3-4,11-15H2
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6.70n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]N-methylspiperone from human dopamine D4 receptor incubated for 1 hr by liquid scintillation counting method


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113243
BindingDB Entry DOI: 10.7270/Q29C726C
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50036733
PNG
(1-(4-Fluoro-phenyl)-4-(4-pyridin-2-yl-piperazin-1-...)
Show SMILES Fc1ccc(cc1)C(=O)CCCN1CCN(CC1)c1ccccn1
Show InChI InChI=1S/C19H22FN3O/c20-17-8-6-16(7-9-17)18(24)4-3-11-22-12-14-23(15-13-22)19-5-1-2-10-21-19/h1-2,5-10H,3-4,11-15H2
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7.60n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor incubated for 1 hr by liquid scintillation counting method


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113243
BindingDB Entry DOI: 10.7270/Q29C726C
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50036733
PNG
(1-(4-Fluoro-phenyl)-4-(4-pyridin-2-yl-piperazin-1-...)
Show SMILES Fc1ccc(cc1)C(=O)CCCN1CCN(CC1)c1ccccn1
Show InChI InChI=1S/C19H22FN3O/c20-17-8-6-16(7-9-17)18(24)4-3-11-22-12-14-23(15-13-22)19-5-1-2-10-21-19/h1-2,5-10H,3-4,11-15H2
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7.60n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-8-OH-DPAT from human 5HT1A receptor by liquid scintillation counting


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115943
BindingDB Entry DOI: 10.7270/Q24B34X6
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50568915
PNG
(CHEMBL4866053)
Show SMILES OC1C(CCN2CCN(CC2)c2ccccn2)Cc2cc(F)ccc12
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7.90n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]N-methylspiperone from human dopamine D4 receptor incubated for 1 hr by liquid scintillation counting method


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113243
BindingDB Entry DOI: 10.7270/Q29C726C
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50568915
PNG
(CHEMBL4866053)
Show SMILES OC1C(CCN2CCN(CC2)c2ccccn2)Cc2cc(F)ccc12
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8n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor incubated for 1 hr by liquid scintillation counting method


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113243
BindingDB Entry DOI: 10.7270/Q29C726C
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50036733
PNG
(1-(4-Fluoro-phenyl)-4-(4-pyridin-2-yl-piperazin-1-...)
Show SMILES Fc1ccc(cc1)C(=O)CCCN1CCN(CC1)c1ccccn1
Show InChI InChI=1S/C19H22FN3O/c20-17-8-6-16(7-9-17)18(24)4-3-11-22-12-14-23(15-13-22)19-5-1-2-10-21-19/h1-2,5-10H,3-4,11-15H2
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8.10n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor incubated for 1 hr by liquid scintillation counting method


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113243
BindingDB Entry DOI: 10.7270/Q29C726C
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50036733
PNG
(1-(4-Fluoro-phenyl)-4-(4-pyridin-2-yl-piperazin-1-...)
Show SMILES Fc1ccc(cc1)C(=O)CCCN1CCN(CC1)c1ccccn1
Show InChI InChI=1S/C19H22FN3O/c20-17-8-6-16(7-9-17)18(24)4-3-11-22-12-14-23(15-13-22)19-5-1-2-10-21-19/h1-2,5-10H,3-4,11-15H2
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8.10n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-8-OH-DPAT from human 5HT1A receptor by liquid scintillation counting


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115943
BindingDB Entry DOI: 10.7270/Q24B34X6
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Homo sapiens (Human))
BDBM50568920
PNG
(CHEMBL4846823)
Show SMILES CC1(CCCN2CCN(CC2)c2ccccn2)Cc2cc(Cl)ccc2C1=O
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8.40n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-LSD from human 5-HT7 receptor incubated for 1 hr by liquid scintillation counting method


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113243
BindingDB Entry DOI: 10.7270/Q29C726C
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Homo sapiens (Human))
BDBM50568920
PNG
(CHEMBL4846823)
Show SMILES CC1(CCCN2CCN(CC2)c2ccccn2)Cc2cc(Cl)ccc2C1=O
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8.5n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-LSD from human 5-HT7 receptor incubated for 1 hr by liquid scintillation counting method


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113243
BindingDB Entry DOI: 10.7270/Q29C726C
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (Human))
BDBM50130293
PNG
(7-{4-[4-(2,3-dichlorophenyl)piperazin-1-yl]butoxy}...)
Show SMILES Clc1cccc(N2CCN(CCCCOc3ccc4CCC(=O)Nc4c3)CC2)c1Cl
Show InChI InChI=1S/C23H27Cl2N3O2/c24-19-4-3-5-21(23(19)25)28-13-11-27(12-14-28)10-1-2-15-30-18-8-6-17-7-9-22(29)26-20(17)16-18/h3-6,8,16H,1-2,7,9-15H2,(H,26,29)
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8.70n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-Ketanserin from human 5-HT2A receptor incubated for 1 hr by liquid scintillation counting method


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113243
BindingDB Entry DOI: 10.7270/Q29C726C
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (Human))
BDBM50130293
PNG
(7-{4-[4-(2,3-dichlorophenyl)piperazin-1-yl]butoxy}...)
Show SMILES Clc1cccc(N2CCN(CCCCOc3ccc4CCC(=O)Nc4c3)CC2)c1Cl
Show InChI InChI=1S/C23H27Cl2N3O2/c24-19-4-3-5-21(23(19)25)28-13-11-27(12-14-28)10-1-2-15-30-18-8-6-17-7-9-22(29)26-20(17)16-18/h3-6,8,16H,1-2,7,9-15H2,(H,26,29)
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8.70n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-ketanserin from human 5HT2A receptor by liquid scintillation counting


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115943
BindingDB Entry DOI: 10.7270/Q24B34X6
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (Human))
BDBM50523096
PNG
(CHEMBL4574793)
Show SMILES Fc1ccc(cc1)C(=O)CCCN1CCCN(CC1)c1ccc(Cl)cn1
Show InChI InChI=1S/C20H23ClFN3O/c21-17-6-9-20(23-15-17)25-12-2-11-24(13-14-25)10-1-3-19(26)16-4-7-18(22)8-5-16/h4-9,15H,1-3,10-14H2
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8.90n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-ketanserin from human 5HT2A receptor by liquid scintillation counting


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115943
BindingDB Entry DOI: 10.7270/Q24B34X6
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (Human))
BDBM50523096
PNG
(CHEMBL4574793)
Show SMILES Fc1ccc(cc1)C(=O)CCCN1CCCN(CC1)c1ccc(Cl)cn1
Show InChI InChI=1S/C20H23ClFN3O/c21-17-6-9-20(23-15-17)25-12-2-11-24(13-14-25)10-1-3-19(26)16-4-7-18(22)8-5-16/h4-9,15H,1-3,10-14H2
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8.90n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-ketanserin from human 5HT2A receptor by liquid scintillation counting


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115943
BindingDB Entry DOI: 10.7270/Q24B34X6
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (Human))
BDBM50523094
PNG
(CHEMBL4462108)
Show SMILES Fc1ccc(CCCCN2CCN(CC2)c2ccc(Cl)cn2)cc1
Show InChI InChI=1S/C19H23ClFN3/c20-17-6-9-19(22-15-17)24-13-11-23(12-14-24)10-2-1-3-16-4-7-18(21)8-5-16/h4-9,15H,1-3,10-14H2
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9.10n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-ketanserin from human 5HT2A receptor by liquid scintillation counting


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115943
BindingDB Entry DOI: 10.7270/Q24B34X6
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (Human))
BDBM50523094
PNG
(CHEMBL4462108)
Show SMILES Fc1ccc(CCCCN2CCN(CC2)c2ccc(Cl)cn2)cc1
Show InChI InChI=1S/C19H23ClFN3/c20-17-6-9-19(22-15-17)24-13-11-23(12-14-24)10-2-1-3-16-4-7-18(21)8-5-16/h4-9,15H,1-3,10-14H2
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9.20n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-ketanserin from human 5HT2A receptor by liquid scintillation counting


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115943
BindingDB Entry DOI: 10.7270/Q24B34X6
More data for this
Ligand-Target Pair
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