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Compile Data Set for Download or QSAR

Found 48 hits Enz. Inhib. hit(s) with all data for entry = 50019273   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50203383
PNG
(CHEMBL228972 | N-(1-benzylpiperidin-4-yl)-2-naphth...)
Show SMILES O=C(NC1CCN(Cc2ccccc2)CC1)c1ccc2ccccc2c1
Show InChI InChI=1S/C23H24N2O/c26-23(21-11-10-19-8-4-5-9-20(19)16-21)24-22-12-14-25(15-13-22)17-18-6-2-1-3-7-18/h1-11,16,22H,12-15,17H2,(H,24,26)
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11n/an/an/an/an/an/an/an/a



Université du Droit et de la Santé Lille II

Curated by ChEMBL


Assay Description
Displacement of [3H]nemonapride from human cloned dopamine D4.2 receptor


Bioorg Med Chem Lett 17: 1570-4 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.106
BindingDB Entry DOI: 10.7270/Q2Z037T3
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50203374
PNG
(CHEMBL234825 | naphthalene-2-carboxylic acid [1-(3...)
Show SMILES Cc1cccc(CN2CCC(CC2)NC(=O)c2ccc3ccccc3c2)c1
Show InChI InChI=1S/C24H26N2O/c1-18-5-4-6-19(15-18)17-26-13-11-23(12-14-26)25-24(27)22-10-9-20-7-2-3-8-21(20)16-22/h2-10,15-16,23H,11-14,17H2,1H3,(H,25,27)
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11n/an/an/an/an/an/an/an/a



Université du Droit et de la Santé Lille II

Curated by ChEMBL


Assay Description
Displacement of [3H]nemonapride from human cloned dopamine D4.2 receptor


Bioorg Med Chem Lett 17: 1570-4 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.106
BindingDB Entry DOI: 10.7270/Q2Z037T3
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50203397
PNG
(CHEMBL234645 | N-(1-(3-methoxybenzyl)piperidin-4-y...)
Show SMILES COc1cccc(CN2CCC(CC2)NC(=O)c2ccc3ccccc3c2)c1
Show InChI InChI=1S/C24H26N2O2/c1-28-23-8-4-5-18(15-23)17-26-13-11-22(12-14-26)25-24(27)21-10-9-19-6-2-3-7-20(19)16-21/h2-10,15-16,22H,11-14,17H2,1H3,(H,25,27)
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16n/an/an/an/an/an/an/an/a



Université du Droit et de la Santé Lille II

Curated by ChEMBL


Assay Description
Displacement of [3H]nemonapride from human cloned dopamine D4.2 receptor


Bioorg Med Chem Lett 17: 1570-4 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.106
BindingDB Entry DOI: 10.7270/Q2Z037T3
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50203376
PNG
(CHEMBL234826 | naphthalene-2-carboxylic acid [1-(4...)
Show SMILES Cc1ccc(CN2CCC(CC2)NC(=O)c2ccc3ccccc3c2)cc1
Show InChI InChI=1S/C24H26N2O/c1-18-6-8-19(9-7-18)17-26-14-12-23(13-15-26)25-24(27)22-11-10-20-4-2-3-5-21(20)16-22/h2-11,16,23H,12-15,17H2,1H3,(H,25,27)
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21n/an/an/an/an/an/an/an/a



Université du Droit et de la Santé Lille II

Curated by ChEMBL


Assay Description
Displacement of [3H]nemonapride from human cloned dopamine D4.2 receptor


Bioorg Med Chem Lett 17: 1570-4 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.106
BindingDB Entry DOI: 10.7270/Q2Z037T3
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50203377
PNG
(CHEMBL234647 | naphthalene-2-carboxylic acid [1-(2...)
Show SMILES Cc1ccccc1CN1CCC(CC1)NC(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C24H26N2O/c1-18-6-2-3-9-22(18)17-26-14-12-23(13-15-26)25-24(27)21-11-10-19-7-4-5-8-20(19)16-21/h2-11,16,23H,12-15,17H2,1H3,(H,25,27)
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26n/an/an/an/an/an/an/an/a



Université du Droit et de la Santé Lille II

Curated by ChEMBL


Assay Description
Displacement of [3H]nemonapride from human cloned dopamine D4.2 receptor


Bioorg Med Chem Lett 17: 1570-4 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.106
BindingDB Entry DOI: 10.7270/Q2Z037T3
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50203392
PNG
(CHEMBL234646 | N-(1-(4-methoxybenzyl)piperidin-4-y...)
Show SMILES COc1ccc(CN2CCC(CC2)NC(=O)c2ccc3ccccc3c2)cc1
Show InChI InChI=1S/C24H26N2O2/c1-28-23-10-6-18(7-11-23)17-26-14-12-22(13-15-26)25-24(27)21-9-8-19-4-2-3-5-20(19)16-21/h2-11,16,22H,12-15,17H2,1H3,(H,25,27)
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31n/an/an/an/an/an/an/an/a



Université du Droit et de la Santé Lille II

Curated by ChEMBL


Assay Description
Displacement of [3H]nemonapride from human cloned dopamine D4.2 receptor


Bioorg Med Chem Lett 17: 1570-4 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.106
BindingDB Entry DOI: 10.7270/Q2Z037T3
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50203373
PNG
(CHEMBL234472 | N-(1-(4-bromobenzyl)piperidin-4-yl)...)
Show SMILES Brc1ccc(CN2CCC(CC2)NC(=O)c2ccc3ccccc3c2)cc1
Show InChI InChI=1S/C23H23BrN2O/c24-21-9-5-17(6-10-21)16-26-13-11-22(12-14-26)25-23(27)20-8-7-18-3-1-2-4-19(18)15-20/h1-10,15,22H,11-14,16H2,(H,25,27)
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34n/an/an/an/an/an/an/an/a



Université du Droit et de la Santé Lille II

Curated by ChEMBL


Assay Description
Displacement of [3H]nemonapride from human cloned dopamine D4.2 receptor


Bioorg Med Chem Lett 17: 1570-4 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.106
BindingDB Entry DOI: 10.7270/Q2Z037T3
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50203382
PNG
(CHEMBL395867 | N-(1-(3-bromobenzyl)piperidin-4-yl)...)
Show SMILES Brc1cccc(CN2CCC(CC2)NC(=O)c2ccc3ccccc3c2)c1
Show InChI InChI=1S/C23H23BrN2O/c24-21-7-3-4-17(14-21)16-26-12-10-22(11-13-26)25-23(27)20-9-8-18-5-1-2-6-19(18)15-20/h1-9,14-15,22H,10-13,16H2,(H,25,27)
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36n/an/an/an/an/an/an/an/a



Université du Droit et de la Santé Lille II

Curated by ChEMBL


Assay Description
Displacement of [3H]nemonapride from human cloned dopamine D4.2 receptor


Bioorg Med Chem Lett 17: 1570-4 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.106
BindingDB Entry DOI: 10.7270/Q2Z037T3
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50203378
PNG
(CHEMBL233581 | N-(1-(4-chlorobenzyl)piperidin-4-yl...)
Show SMILES Clc1ccc(CN2CCC(CC2)NC(=O)c2ccc3ccccc3c2)cc1
Show InChI InChI=1S/C23H23ClN2O/c24-21-9-5-17(6-10-21)16-26-13-11-22(12-14-26)25-23(27)20-8-7-18-3-1-2-4-19(18)15-20/h1-10,15,22H,11-14,16H2,(H,25,27)
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37n/an/an/an/an/an/an/an/a



Université du Droit et de la Santé Lille II

Curated by ChEMBL


Assay Description
Displacement of [3H]nemonapride from human cloned dopamine D4.2 receptor


Bioorg Med Chem Lett 17: 1570-4 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.106
BindingDB Entry DOI: 10.7270/Q2Z037T3
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50203388
PNG
(CHEMBL234641 | N-(1-(4-chlorobenzyl)piperidin-4-yl...)
Show SMILES Clc1ccc(CN2CCC(CC2)NC(=O)c2cccc3ccccc23)cc1
Show InChI InChI=1S/C23H23ClN2O/c24-19-10-8-17(9-11-19)16-26-14-12-20(13-15-26)25-23(27)22-7-3-5-18-4-1-2-6-21(18)22/h1-11,20H,12-16H2,(H,25,27)
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43n/an/an/an/an/an/an/an/a



Université du Droit et de la Santé Lille II

Curated by ChEMBL


Assay Description
Displacement of [3H]nemonapride from human cloned dopamine D4.2 receptor


Bioorg Med Chem Lett 17: 1570-4 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.106
BindingDB Entry DOI: 10.7270/Q2Z037T3
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50203383
PNG
(CHEMBL228972 | N-(1-benzylpiperidin-4-yl)-2-naphth...)
Show SMILES O=C(NC1CCN(Cc2ccccc2)CC1)c1ccc2ccccc2c1
Show InChI InChI=1S/C23H24N2O/c26-23(21-11-10-19-8-4-5-9-20(19)16-21)24-22-12-14-25(15-13-22)17-18-6-2-1-3-7-18/h1-11,16,22H,12-15,17H2,(H,24,26)
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44n/an/an/an/an/an/an/an/a



Université du Droit et de la Santé Lille II

Curated by ChEMBL


Assay Description
Displacement of [3H]ketanserin from rat 5HT2A receptor


Bioorg Med Chem Lett 17: 1570-4 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.106
BindingDB Entry DOI: 10.7270/Q2Z037T3
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50203394
PNG
(CHEMBL234643 | N-(1-(4-bromobenzyl)piperidin-4-yl)...)
Show SMILES Brc1ccc(CN2CCC(CC2)NC(=O)c2cccc3ccccc23)cc1
Show InChI InChI=1S/C23H23BrN2O/c24-19-10-8-17(9-11-19)16-26-14-12-20(13-15-26)25-23(27)22-7-3-5-18-4-1-2-6-21(18)22/h1-11,20H,12-16H2,(H,25,27)
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44n/an/an/an/an/an/an/an/a



Université du Droit et de la Santé Lille II

Curated by ChEMBL


Assay Description
Displacement of [3H]nemonapride from human cloned dopamine D4.2 receptor


Bioorg Med Chem Lett 17: 1570-4 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.106
BindingDB Entry DOI: 10.7270/Q2Z037T3
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50203382
PNG
(CHEMBL395867 | N-(1-(3-bromobenzyl)piperidin-4-yl)...)
Show SMILES Brc1cccc(CN2CCC(CC2)NC(=O)c2ccc3ccccc3c2)c1
Show InChI InChI=1S/C23H23BrN2O/c24-21-7-3-4-17(14-21)16-26-12-10-22(11-13-26)25-23(27)20-9-8-18-5-1-2-6-19(18)15-20/h1-9,14-15,22H,10-13,16H2,(H,25,27)
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53n/an/an/an/an/an/an/an/a



Université du Droit et de la Santé Lille II

Curated by ChEMBL


Assay Description
Displacement of [3H]ketanserin from rat 5HT2A receptor


Bioorg Med Chem Lett 17: 1570-4 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.106
BindingDB Entry DOI: 10.7270/Q2Z037T3
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50203389
PNG
(CHEMBL233580 | N-(1-(3-chlorobenzyl)piperidin-4-yl...)
Show SMILES Clc1cccc(CN2CCC(CC2)NC(=O)c2ccc3ccccc3c2)c1
Show InChI InChI=1S/C23H23ClN2O/c24-21-7-3-4-17(14-21)16-26-12-10-22(11-13-26)25-23(27)20-9-8-18-5-1-2-6-19(18)15-20/h1-9,14-15,22H,10-13,16H2,(H,25,27)
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54n/an/an/an/an/an/an/an/a



Université du Droit et de la Santé Lille II

Curated by ChEMBL


Assay Description
Displacement of [3H]nemonapride from human cloned dopamine D4.2 receptor


Bioorg Med Chem Lett 17: 1570-4 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.106
BindingDB Entry DOI: 10.7270/Q2Z037T3
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50203393
PNG
(CHEMBL395631 | N-(1-(3-bromobenzyl)piperidin-4-yl)...)
Show SMILES Brc1cccc(CN2CCC(CC2)NC(=O)c2cccc3ccccc23)c1
Show InChI InChI=1S/C23H23BrN2O/c24-19-8-3-5-17(15-19)16-26-13-11-20(12-14-26)25-23(27)22-10-4-7-18-6-1-2-9-21(18)22/h1-10,15,20H,11-14,16H2,(H,25,27)
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66n/an/an/an/an/an/an/an/a



Université du Droit et de la Santé Lille II

Curated by ChEMBL


Assay Description
Displacement of [3H]nemonapride from human cloned dopamine D4.2 receptor


Bioorg Med Chem Lett 17: 1570-4 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.106
BindingDB Entry DOI: 10.7270/Q2Z037T3
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50203391
PNG
(CHEMBL233578 | naphthalene-1-carboxylic acid [1-(4...)
Show SMILES Cc1ccc(CN2CCC(CC2)NC(=O)c2cccc3ccccc23)cc1
Show InChI InChI=1S/C24H26N2O/c1-18-9-11-19(12-10-18)17-26-15-13-21(14-16-26)25-24(27)23-8-4-6-20-5-2-3-7-22(20)23/h2-12,21H,13-17H2,1H3,(H,25,27)
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69n/an/an/an/an/an/an/an/a



Université du Droit et de la Santé Lille II

Curated by ChEMBL


Assay Description
Displacement of [3H]nemonapride from human cloned dopamine D4.2 receptor


Bioorg Med Chem Lett 17: 1570-4 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.106
BindingDB Entry DOI: 10.7270/Q2Z037T3
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50203384
PNG
(CHEMBL233404 | naphthalene-1-carboxylic acid [1-(3...)
Show SMILES Cc1cccc(CN2CCC(CC2)NC(=O)c2cccc3ccccc23)c1
Show InChI InChI=1S/C24H26N2O/c1-18-6-4-7-19(16-18)17-26-14-12-21(13-15-26)25-24(27)23-11-5-9-20-8-2-3-10-22(20)23/h2-11,16,21H,12-15,17H2,1H3,(H,25,27)
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77n/an/an/an/an/an/an/an/a



Université du Droit et de la Santé Lille II

Curated by ChEMBL


Assay Description
Displacement of [3H]nemonapride from human cloned dopamine D4.2 receptor


Bioorg Med Chem Lett 17: 1570-4 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.106
BindingDB Entry DOI: 10.7270/Q2Z037T3
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50203386
PNG
(CHEMBL430167 | N-(1-(4-(trifluoromethyl)benzyl)pip...)
Show SMILES FC(F)(F)c1ccc(CN2CCC(CC2)NC(=O)c2ccc3ccccc3c2)cc1
Show InChI InChI=1S/C24H23F3N2O/c25-24(26,27)21-9-5-17(6-10-21)16-29-13-11-22(12-14-29)28-23(30)20-8-7-18-3-1-2-4-19(18)15-20/h1-10,15,22H,11-14,16H2,(H,28,30)
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84n/an/an/an/an/an/an/an/a



Université du Droit et de la Santé Lille II

Curated by ChEMBL


Assay Description
Displacement of [3H]nemonapride from human cloned dopamine D4.2 receptor


Bioorg Med Chem Lett 17: 1570-4 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.106
BindingDB Entry DOI: 10.7270/Q2Z037T3
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50203374
PNG
(CHEMBL234825 | naphthalene-2-carboxylic acid [1-(3...)
Show SMILES Cc1cccc(CN2CCC(CC2)NC(=O)c2ccc3ccccc3c2)c1
Show InChI InChI=1S/C24H26N2O/c1-18-5-4-6-19(15-18)17-26-13-11-23(12-14-26)25-24(27)22-10-9-20-7-2-3-8-21(20)16-22/h2-10,15-16,23H,11-14,17H2,1H3,(H,25,27)
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87n/an/an/an/an/an/an/an/a



Université du Droit et de la Santé Lille II

Curated by ChEMBL


Assay Description
Displacement of [3H]ketanserin from rat 5HT2A receptor


Bioorg Med Chem Lett 17: 1570-4 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.106
BindingDB Entry DOI: 10.7270/Q2Z037T3
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50203385
PNG
(CHEMBL234824 | N-(1-(4-(trifluoromethyl)benzyl)pip...)
Show SMILES FC(F)(F)c1ccc(CN2CCC(CC2)NC(=O)c2cccc3ccccc23)cc1
Show InChI InChI=1S/C24H23F3N2O/c25-24(26,27)19-10-8-17(9-11-19)16-29-14-12-20(13-15-29)28-23(30)22-7-3-5-18-4-1-2-6-21(18)22/h1-11,20H,12-16H2,(H,28,30)
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96n/an/an/an/an/an/an/an/a



Université du Droit et de la Santé Lille II

Curated by ChEMBL


Assay Description
Displacement of [3H]nemonapride from human cloned dopamine D4.2 receptor


Bioorg Med Chem Lett 17: 1570-4 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.106
BindingDB Entry DOI: 10.7270/Q2Z037T3
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50203381
PNG
(CHEMBL234473 | N-(1-(3-(trifluoromethyl)benzyl)pip...)
Show SMILES FC(F)(F)c1cccc(CN2CCC(CC2)NC(=O)c2ccc3ccccc3c2)c1
Show InChI InChI=1S/C24H23F3N2O/c25-24(26,27)21-7-3-4-17(14-21)16-29-12-10-22(11-13-29)28-23(30)20-9-8-18-5-1-2-6-19(18)15-20/h1-9,14-15,22H,10-13,16H2,(H,28,30)
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103n/an/an/an/an/an/an/an/a



Université du Droit et de la Santé Lille II

Curated by ChEMBL


Assay Description
Displacement of [3H]nemonapride from human cloned dopamine D4.2 receptor


Bioorg Med Chem Lett 17: 1570-4 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.106
BindingDB Entry DOI: 10.7270/Q2Z037T3
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50203398
PNG
(CHEMBL234640 | N-(1-(3-chlorobenzyl)piperidin-4-yl...)
Show SMILES Clc1cccc(CN2CCC(CC2)NC(=O)c2cccc3ccccc23)c1
Show InChI InChI=1S/C23H23ClN2O/c24-19-8-3-5-17(15-19)16-26-13-11-20(12-14-26)25-23(27)22-10-4-7-18-6-1-2-9-21(18)22/h1-10,15,20H,11-14,16H2,(H,25,27)
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116n/an/an/an/an/an/an/an/a



Université du Droit et de la Santé Lille II

Curated by ChEMBL


Assay Description
Displacement of [3H]nemonapride from human cloned dopamine D4.2 receptor


Bioorg Med Chem Lett 17: 1570-4 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.106
BindingDB Entry DOI: 10.7270/Q2Z037T3
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50203371
PNG
(CHEMBL398990 | N-(1-(3-(trifluoromethyl)benzyl)pip...)
Show SMILES FC(F)(F)c1cccc(CN2CCC(CC2)NC(=O)c2cccc3ccccc23)c1
Show InChI InChI=1S/C24H23F3N2O/c25-24(26,27)19-8-3-5-17(15-19)16-29-13-11-20(12-14-29)28-23(30)22-10-4-7-18-6-1-2-9-21(18)22/h1-10,15,20H,11-14,16H2,(H,28,30)
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119n/an/an/an/an/an/an/an/a



Université du Droit et de la Santé Lille II

Curated by ChEMBL


Assay Description
Displacement of [3H]nemonapride from human cloned dopamine D4.2 receptor


Bioorg Med Chem Lett 17: 1570-4 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.106
BindingDB Entry DOI: 10.7270/Q2Z037T3
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50203389
PNG
(CHEMBL233580 | N-(1-(3-chlorobenzyl)piperidin-4-yl...)
Show SMILES Clc1cccc(CN2CCC(CC2)NC(=O)c2ccc3ccccc3c2)c1
Show InChI InChI=1S/C23H23ClN2O/c24-21-7-3-4-17(14-21)16-26-12-10-22(11-13-26)25-23(27)20-9-8-18-5-1-2-6-19(18)15-20/h1-9,14-15,22H,10-13,16H2,(H,25,27)
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133n/an/an/an/an/an/an/an/a



Université du Droit et de la Santé Lille II

Curated by ChEMBL


Assay Description
Displacement of [3H]ketanserin from rat 5HT2A receptor


Bioorg Med Chem Lett 17: 1570-4 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.106
BindingDB Entry DOI: 10.7270/Q2Z037T3
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50203399
PNG
(CHEMBL233579 | N-(1-(2-chlorobenzyl)piperidin-4-yl...)
Show SMILES Clc1ccccc1CN1CCC(CC1)NC(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C23H23ClN2O/c24-22-8-4-3-7-20(22)16-26-13-11-21(12-14-26)25-23(27)19-10-9-17-5-1-2-6-18(17)15-19/h1-10,15,21H,11-14,16H2,(H,25,27)
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133n/an/an/an/an/an/an/an/a



Université du Droit et de la Santé Lille II

Curated by ChEMBL


Assay Description
Displacement of [3H]ketanserin from rat 5HT2A receptor


Bioorg Med Chem Lett 17: 1570-4 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.106
BindingDB Entry DOI: 10.7270/Q2Z037T3
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50203392
PNG
(CHEMBL234646 | N-(1-(4-methoxybenzyl)piperidin-4-y...)
Show SMILES COc1ccc(CN2CCC(CC2)NC(=O)c2ccc3ccccc3c2)cc1
Show InChI InChI=1S/C24H26N2O2/c1-28-23-10-6-18(7-11-23)17-26-14-12-22(13-15-26)25-24(27)21-9-8-19-4-2-3-5-20(19)16-21/h2-11,16,22H,12-15,17H2,1H3,(H,25,27)
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151n/an/an/an/an/an/an/an/a



Université du Droit et de la Santé Lille II

Curated by ChEMBL


Assay Description
Displacement of [3H]ketanserin from rat 5HT2A receptor


Bioorg Med Chem Lett 17: 1570-4 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.106
BindingDB Entry DOI: 10.7270/Q2Z037T3
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50203372
PNG
(CHEMBL395632 | naphthalene-1-carboxylic acid [1-(2...)
Show SMILES Cc1ccccc1CN1CCC(CC1)NC(=O)c1cccc2ccccc12
Show InChI InChI=1S/C24H26N2O/c1-18-7-2-3-9-20(18)17-26-15-13-21(14-16-26)25-24(27)23-12-6-10-19-8-4-5-11-22(19)23/h2-12,21H,13-17H2,1H3,(H,25,27)
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155n/an/an/an/an/an/an/an/a



Université du Droit et de la Santé Lille II

Curated by ChEMBL


Assay Description
Displacement of [3H]nemonapride from human cloned dopamine D4.2 receptor


Bioorg Med Chem Lett 17: 1570-4 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.106
BindingDB Entry DOI: 10.7270/Q2Z037T3
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50203397
PNG
(CHEMBL234645 | N-(1-(3-methoxybenzyl)piperidin-4-y...)
Show SMILES COc1cccc(CN2CCC(CC2)NC(=O)c2ccc3ccccc3c2)c1
Show InChI InChI=1S/C24H26N2O2/c1-28-23-8-4-5-18(15-23)17-26-13-11-22(12-14-26)25-24(27)21-10-9-19-6-2-3-7-20(19)16-21/h2-10,15-16,22H,11-14,17H2,1H3,(H,25,27)
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158n/an/an/an/an/an/an/an/a



Université du Droit et de la Santé Lille II

Curated by ChEMBL


Assay Description
Displacement of [3H]ketanserin from rat 5HT2A receptor


Bioorg Med Chem Lett 17: 1570-4 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.106
BindingDB Entry DOI: 10.7270/Q2Z037T3
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50203375
PNG
(CHEMBL229019 | N-(1-benzylpiperidin-4-yl)-1-naphth...)
Show SMILES O=C(NC1CCN(Cc2ccccc2)CC1)c1cccc2ccccc12
Show InChI InChI=1S/C23H24N2O/c26-23(22-12-6-10-19-9-4-5-11-21(19)22)24-20-13-15-25(16-14-20)17-18-7-2-1-3-8-18/h1-12,20H,13-17H2,(H,24,26)
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162n/an/an/an/an/an/an/an/a



Université du Droit et de la Santé Lille II

Curated by ChEMBL


Assay Description
Displacement of [3H]nemonapride from human cloned dopamine D4.2 receptor


Bioorg Med Chem Lett 17: 1570-4 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.106
BindingDB Entry DOI: 10.7270/Q2Z037T3
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50203379
PNG
(CHEMBL434583 | N-(1-(3-methoxybenzyl)piperidin-4-y...)
Show SMILES COc1cccc(CN2CCC(CC2)NC(=O)c2cccc3ccccc23)c1
Show InChI InChI=1S/C24H26N2O2/c1-28-21-9-4-6-18(16-21)17-26-14-12-20(13-15-26)25-24(27)23-11-5-8-19-7-2-3-10-22(19)23/h2-11,16,20H,12-15,17H2,1H3,(H,25,27)
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168n/an/an/an/an/an/an/an/a



Université du Droit et de la Santé Lille II

Curated by ChEMBL


Assay Description
Displacement of [3H]nemonapride from human cloned dopamine D4.2 receptor


Bioorg Med Chem Lett 17: 1570-4 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.106
BindingDB Entry DOI: 10.7270/Q2Z037T3
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50203377
PNG
(CHEMBL234647 | naphthalene-2-carboxylic acid [1-(2...)
Show SMILES Cc1ccccc1CN1CCC(CC1)NC(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C24H26N2O/c1-18-6-2-3-9-22(18)17-26-14-12-23(13-15-26)25-24(27)21-11-10-19-7-4-5-8-20(19)16-21/h2-11,16,23H,12-15,17H2,1H3,(H,25,27)
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175n/an/an/an/an/an/an/an/a



Université du Droit et de la Santé Lille II

Curated by ChEMBL


Assay Description
Displacement of [3H]ketanserin from rat 5HT2A receptor


Bioorg Med Chem Lett 17: 1570-4 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.106
BindingDB Entry DOI: 10.7270/Q2Z037T3
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50203395
PNG
(CHEMBL234644 | N-(1-(4-nitrobenzyl)piperidin-4-yl)...)
Show SMILES [O-][N+](=O)c1ccc(CN2CCC(CC2)NC(=O)c2ccc3ccccc3c2)cc1
Show InChI InChI=1S/C23H23N3O3/c27-23(20-8-7-18-3-1-2-4-19(18)15-20)24-21-11-13-25(14-12-21)16-17-5-9-22(10-6-17)26(28)29/h1-10,15,21H,11-14,16H2,(H,24,27)
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181n/an/an/an/an/an/an/an/a



Université du Droit et de la Santé Lille II

Curated by ChEMBL


Assay Description
Displacement of [3H]nemonapride from human cloned dopamine D4.2 receptor


Bioorg Med Chem Lett 17: 1570-4 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.106
BindingDB Entry DOI: 10.7270/Q2Z037T3
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50203376
PNG
(CHEMBL234826 | naphthalene-2-carboxylic acid [1-(4...)
Show SMILES Cc1ccc(CN2CCC(CC2)NC(=O)c2ccc3ccccc3c2)cc1
Show InChI InChI=1S/C24H26N2O/c1-18-6-8-19(9-7-18)17-26-14-12-23(13-15-26)25-24(27)22-11-10-20-4-2-3-5-21(20)16-22/h2-11,16,23H,12-15,17H2,1H3,(H,25,27)
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222n/an/an/an/an/an/an/an/a



Université du Droit et de la Santé Lille II

Curated by ChEMBL


Assay Description
Displacement of [3H]ketanserin from rat 5HT2A receptor


Bioorg Med Chem Lett 17: 1570-4 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.106
BindingDB Entry DOI: 10.7270/Q2Z037T3
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50203396
PNG
(CHEMBL233403 | N-(1-(4-methoxybenzyl)piperidin-4-y...)
Show SMILES COc1ccc(CN2CCC(CC2)NC(=O)c2cccc3ccccc23)cc1
Show InChI InChI=1S/C24H26N2O2/c1-28-21-11-9-18(10-12-21)17-26-15-13-20(14-16-26)25-24(27)23-8-4-6-19-5-2-3-7-22(19)23/h2-12,20H,13-17H2,1H3,(H,25,27)
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223n/an/an/an/an/an/an/an/a



Université du Droit et de la Santé Lille II

Curated by ChEMBL


Assay Description
Displacement of [3H]nemonapride from human cloned dopamine D4.2 receptor


Bioorg Med Chem Lett 17: 1570-4 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.106
BindingDB Entry DOI: 10.7270/Q2Z037T3
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50203373
PNG
(CHEMBL234472 | N-(1-(4-bromobenzyl)piperidin-4-yl)...)
Show SMILES Brc1ccc(CN2CCC(CC2)NC(=O)c2ccc3ccccc3c2)cc1
Show InChI InChI=1S/C23H23BrN2O/c24-21-9-5-17(6-10-21)16-26-13-11-22(12-14-26)25-23(27)20-8-7-18-3-1-2-4-19(18)15-20/h1-10,15,22H,11-14,16H2,(H,25,27)
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223n/an/an/an/an/an/an/an/a



Université du Droit et de la Santé Lille II

Curated by ChEMBL


Assay Description
Displacement of [3H]ketanserin from rat 5HT2A receptor


Bioorg Med Chem Lett 17: 1570-4 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.106
BindingDB Entry DOI: 10.7270/Q2Z037T3
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50203380
PNG
(CHEMBL232197 | N-(1-(perfluorobenzyl)piperidin-4-y...)
Show SMILES Fc1c(F)c(F)c(CN2CCC(CC2)NC(=O)c2cccc3ccccc23)c(F)c1F
Show InChI InChI=1S/C23H19F5N2O/c24-18-17(19(25)21(27)22(28)20(18)26)12-30-10-8-14(9-11-30)29-23(31)16-7-3-5-13-4-1-2-6-15(13)16/h1-7,14H,8-12H2,(H,29,31)
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228n/an/an/an/an/an/an/an/a



Université du Droit et de la Santé Lille II

Curated by ChEMBL


Assay Description
Displacement of [3H]ketanserin from rat 5HT2A receptor


Bioorg Med Chem Lett 17: 1570-4 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.106
BindingDB Entry DOI: 10.7270/Q2Z037T3
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50203378
PNG
(CHEMBL233581 | N-(1-(4-chlorobenzyl)piperidin-4-yl...)
Show SMILES Clc1ccc(CN2CCC(CC2)NC(=O)c2ccc3ccccc3c2)cc1
Show InChI InChI=1S/C23H23ClN2O/c24-21-9-5-17(6-10-21)16-26-13-11-22(12-14-26)25-23(27)20-8-7-18-3-1-2-4-19(18)15-20/h1-10,15,22H,11-14,16H2,(H,25,27)
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242n/an/an/an/an/an/an/an/a



Université du Droit et de la Santé Lille II

Curated by ChEMBL


Assay Description
Displacement of [3H]ketanserin from rat 5HT2A receptor


Bioorg Med Chem Lett 17: 1570-4 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.106
BindingDB Entry DOI: 10.7270/Q2Z037T3
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50203395
PNG
(CHEMBL234644 | N-(1-(4-nitrobenzyl)piperidin-4-yl)...)
Show SMILES [O-][N+](=O)c1ccc(CN2CCC(CC2)NC(=O)c2ccc3ccccc3c2)cc1
Show InChI InChI=1S/C23H23N3O3/c27-23(20-8-7-18-3-1-2-4-19(18)15-20)24-21-11-13-25(14-12-21)16-17-5-9-22(10-6-17)26(28)29/h1-10,15,21H,11-14,16H2,(H,24,27)
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278n/an/an/an/an/an/an/an/a



Université du Droit et de la Santé Lille II

Curated by ChEMBL


Assay Description
Displacement of [3H]ketanserin from rat 5HT2A receptor


Bioorg Med Chem Lett 17: 1570-4 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.106
BindingDB Entry DOI: 10.7270/Q2Z037T3
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50203370
PNG
(CHEMBL234827 | N-(1-(pyridin-2-ylmethyl)piperidin-...)
Show SMILES O=C(NC1CCN(Cc2ccccn2)CC1)c1ccc2ccccc2c1
Show InChI InChI=1S/C22H23N3O/c26-22(19-9-8-17-5-1-2-6-18(17)15-19)24-20-10-13-25(14-11-20)16-21-7-3-4-12-23-21/h1-9,12,15,20H,10-11,13-14,16H2,(H,24,26)
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299n/an/an/an/an/an/an/an/a



Université du Droit et de la Santé Lille II

Curated by ChEMBL


Assay Description
Displacement of [3H]nemonapride from human cloned dopamine D4.2 receptor


Bioorg Med Chem Lett 17: 1570-4 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.106
BindingDB Entry DOI: 10.7270/Q2Z037T3
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50203390
PNG
(CHEMBL394042 | N-(1-(pyridin-3-ylmethyl)piperidin-...)
Show SMILES O=C(NC1CCN(Cc2cccnc2)CC1)c1ccc2ccccc2c1
Show InChI InChI=1S/C22H23N3O/c26-22(20-8-7-18-5-1-2-6-19(18)14-20)24-21-9-12-25(13-10-21)16-17-4-3-11-23-15-17/h1-8,11,14-15,21H,9-10,12-13,16H2,(H,24,26)
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326n/an/an/an/an/an/an/an/a



Université du Droit et de la Santé Lille II

Curated by ChEMBL


Assay Description
Displacement of [3H]nemonapride from human cloned dopamine D4.2 receptor


Bioorg Med Chem Lett 17: 1570-4 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.106
BindingDB Entry DOI: 10.7270/Q2Z037T3
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50203400
PNG
(CHEMBL233214 | N-(1-(2-chlorobenzyl)piperidin-4-yl...)
Show SMILES Clc1ccccc1CN1CCC(CC1)NC(=O)c1cccc2ccccc12
Show InChI InChI=1S/C23H23ClN2O/c24-22-11-4-2-7-18(22)16-26-14-12-19(13-15-26)25-23(27)21-10-5-8-17-6-1-3-9-20(17)21/h1-11,19H,12-16H2,(H,25,27)
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329n/an/an/an/an/an/an/an/a



Université du Droit et de la Santé Lille II

Curated by ChEMBL


Assay Description
Displacement of [3H]nemonapride from human cloned dopamine D4.2 receptor


Bioorg Med Chem Lett 17: 1570-4 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.106
BindingDB Entry DOI: 10.7270/Q2Z037T3
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50203393
PNG
(CHEMBL395631 | N-(1-(3-bromobenzyl)piperidin-4-yl)...)
Show SMILES Brc1cccc(CN2CCC(CC2)NC(=O)c2cccc3ccccc23)c1
Show InChI InChI=1S/C23H23BrN2O/c24-19-8-3-5-17(15-19)16-26-13-11-20(12-14-26)25-23(27)22-10-4-7-18-6-1-2-9-21(18)22/h1-10,15,20H,11-14,16H2,(H,25,27)
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462n/an/an/an/an/an/an/an/a



Université du Droit et de la Santé Lille II

Curated by ChEMBL


Assay Description
Displacement of [3H]ketanserin from rat 5HT2A receptor


Bioorg Med Chem Lett 17: 1570-4 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.106
BindingDB Entry DOI: 10.7270/Q2Z037T3
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50203390
PNG
(CHEMBL394042 | N-(1-(pyridin-3-ylmethyl)piperidin-...)
Show SMILES O=C(NC1CCN(Cc2cccnc2)CC1)c1ccc2ccccc2c1
Show InChI InChI=1S/C22H23N3O/c26-22(20-8-7-18-5-1-2-6-19(18)14-20)24-21-9-12-25(13-10-21)16-17-4-3-11-23-15-17/h1-8,11,14-15,21H,9-10,12-13,16H2,(H,24,26)
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524n/an/an/an/an/an/an/an/a



Université du Droit et de la Santé Lille II

Curated by ChEMBL


Assay Description
Displacement of [3H]ketanserin from rat 5HT2A receptor


Bioorg Med Chem Lett 17: 1570-4 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.106
BindingDB Entry DOI: 10.7270/Q2Z037T3
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50203370
PNG
(CHEMBL234827 | N-(1-(pyridin-2-ylmethyl)piperidin-...)
Show SMILES O=C(NC1CCN(Cc2ccccn2)CC1)c1ccc2ccccc2c1
Show InChI InChI=1S/C22H23N3O/c26-22(19-9-8-17-5-1-2-6-18(17)15-19)24-20-10-13-25(14-11-20)16-21-7-3-4-12-23-21/h1-9,12,15,20H,10-11,13-14,16H2,(H,24,26)
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545n/an/an/an/an/an/an/an/a



Université du Droit et de la Santé Lille II

Curated by ChEMBL


Assay Description
Displacement of [3H]ketanserin from rat 5HT2A receptor


Bioorg Med Chem Lett 17: 1570-4 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.106
BindingDB Entry DOI: 10.7270/Q2Z037T3
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50203387
PNG
(CHEMBL234001 | N-(1-(pyridin-4-ylmethyl)piperidin-...)
Show SMILES O=C(NC1CCN(Cc2ccncc2)CC1)c1ccc2ccccc2c1
Show InChI InChI=1S/C22H23N3O/c26-22(20-6-5-18-3-1-2-4-19(18)15-20)24-21-9-13-25(14-10-21)16-17-7-11-23-12-8-17/h1-8,11-12,15,21H,9-10,13-14,16H2,(H,24,26)
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695n/an/an/an/an/an/an/an/a



Université du Droit et de la Santé Lille II

Curated by ChEMBL


Assay Description
Displacement of [3H]ketanserin from rat 5HT2A receptor


Bioorg Med Chem Lett 17: 1570-4 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.106
BindingDB Entry DOI: 10.7270/Q2Z037T3
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50203375
PNG
(CHEMBL229019 | N-(1-benzylpiperidin-4-yl)-1-naphth...)
Show SMILES O=C(NC1CCN(Cc2ccccc2)CC1)c1cccc2ccccc12
Show InChI InChI=1S/C23H24N2O/c26-23(22-12-6-10-19-9-4-5-11-21(19)22)24-20-13-15-25(16-14-20)17-18-7-2-1-3-8-18/h1-12,20H,13-17H2,(H,24,26)
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>1.00E+3n/an/an/an/an/an/an/an/a



Université du Droit et de la Santé Lille II

Curated by ChEMBL


Assay Description
Displacement of [3H]ketanserin from rat 5HT2A receptor


Bioorg Med Chem Lett 17: 1570-4 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.106
BindingDB Entry DOI: 10.7270/Q2Z037T3
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50203383
PNG
(CHEMBL228972 | N-(1-benzylpiperidin-4-yl)-2-naphth...)
Show SMILES O=C(NC1CCN(Cc2ccccc2)CC1)c1ccc2ccccc2c1
Show InChI InChI=1S/C23H24N2O/c26-23(21-11-10-19-8-4-5-9-20(19)16-21)24-22-12-14-25(15-13-22)17-18-6-2-1-3-7-18/h1-11,16,22H,12-15,17H2,(H,24,26)
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>1.00E+3n/an/an/an/an/an/an/an/a



Université du Droit et de la Santé Lille II

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human cloned dopamine D2L receptor


Bioorg Med Chem Lett 17: 1570-4 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.106
BindingDB Entry DOI: 10.7270/Q2Z037T3
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50203375
PNG
(CHEMBL229019 | N-(1-benzylpiperidin-4-yl)-1-naphth...)
Show SMILES O=C(NC1CCN(Cc2ccccc2)CC1)c1cccc2ccccc12
Show InChI InChI=1S/C23H24N2O/c26-23(22-12-6-10-19-9-4-5-11-21(19)22)24-20-13-15-25(16-14-20)17-18-7-2-1-3-8-18/h1-12,20H,13-17H2,(H,24,26)
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>1.00E+3n/an/an/an/an/an/an/an/a



Université du Droit et de la Santé Lille II

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human cloned dopamine D2L receptor


Bioorg Med Chem Lett 17: 1570-4 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.106
BindingDB Entry DOI: 10.7270/Q2Z037T3
More data for this
Ligand-Target Pair