Found 135 hits with Last Name = 'graulich' and Initial = 'a' Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
Small conductance calcium-activated potassium channel protein 1/2/3
(Rattus norvegicus-RAT-Rattus norvegicus (Rat)) | BDBM50260153
(Apamin | CHEMBL525408 | Octadecapeptide venom)Show SMILES CC(C)C[C@@H]1NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]2CSSC[C@H](NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)[C@H](CSSC[C@H](N)C(=O)N[C@@H](CC(N)=O)C(=O)N2)NC1=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1cnc[nH]1)C(N)=O)[C@@H](C)O |r,wU:83.102,47.101,13.138,4.3,33.34,88.89,78.79,67.68,107.109,116.118,125.127,wD:26.30,52.106,56.57,17.17,135.140,8.8,38.39,93.94,(27.83,-36.7,;27.83,-35.16,;26.49,-34.38,;29.15,-34.38,;29.15,-32.85,;30.49,-32.08,;31.8,-32.85,;31.8,-34.38,;33.14,-32.08,;33.14,-30.53,;34.47,-32.85,;35.8,-32.08,;35.8,-30.53,;40.01,-33.02,;41.6,-32.04,;43.23,-32.89,;43.23,-34.42,;44.54,-32.11,;44.54,-30.57,;45.89,-29.8,;45.89,-28.26,;44.54,-27.49,;47.21,-27.49,;45.89,-32.89,;48.48,-32.23,;48.91,-30.87,;50.38,-34.89,;52.13,-34.44,;53.01,-35.96,;51.84,-36.95,;50.38,-36.43,;48.34,-38.91,;48.77,-40.45,;46.11,-38.58,;46.11,-37.03,;44.16,-39.41,;42.33,-38.62,;42.33,-37.09,;40.7,-39.47,;40.7,-40.99,;39.37,-41.76,;39.37,-43.3,;38.05,-44.06,;38.05,-45.59,;38.29,-38.35,;35.39,-39.38,;35.39,-40.91,;34.06,-38.61,;40.93,-30.71,;40.94,-27.32,;39.36,-26.12,;39.37,-23.14,;38.05,-22.37,;36.72,-23.15,;35.39,-22.38,;35.4,-20.84,;34.06,-23.15,;34.06,-24.68,;32.73,-25.46,;32.73,-26.98,;31.4,-27.31,;30.08,-26.97,;28.36,-27.74,;30.08,-25.44,;32.73,-22.39,;31.4,-23.16,;31.41,-24.7,;28.69,-22.34,;28.69,-20.8,;30.02,-20.04,;30.02,-18.5,;31.34,-17.73,;31.34,-16.2,;32.68,-15.42,;30.02,-15.42,;26.07,-23.55,;26.08,-25.1,;27.41,-25.88,;23.8,-26.94,;22.48,-26.19,;23.83,-29.77,;25.16,-30.53,;26.5,-29.77,;25.16,-32.08,;23.84,-32.85,;23.84,-34.38,;24.76,-36.3,;26.09,-37.07,;26.09,-38.61,;24.77,-39.38,;27.42,-39.38,;27.42,-40.91,;28.75,-38.61,;30.09,-39.38,;30.09,-40.91,;31.42,-41.68,;31.42,-43.23,;32.75,-40.91,;31.41,-38.61,;31.41,-37.07,;32.73,-39.38,;26.5,-32.85,;27.83,-32.08,;27.83,-30.53,;38.04,-20.83,;36.7,-20.07,;39.36,-20.06,;39.36,-18.52,;38.03,-17.74,;38.03,-16.21,;36.71,-15.43,;36.71,-13.9,;35.38,-16.21,;40.7,-17.74,;40.69,-16.21,;42.03,-18.52,;43.37,-17.74,;43.37,-16.2,;44.7,-15.42,;44.7,-13.89,;46.03,-13.1,;43.36,-13.12,;44.71,-18.51,;44.7,-20.05,;46.04,-17.73,;47.37,-18.52,;48.68,-17.74,;50.05,-18.53,;50.21,-20.07,;51.72,-20.4,;52.48,-19.07,;51.47,-17.91,;47.36,-20.05,;48.68,-20.83,;46.03,-20.83,;40.01,-34.57,;38.67,-35.33,;41.74,-35.33,)| Show InChI InChI=1S/C79H131N31O24S4/c1-35(2)26-49-70(127)107-51-31-136-135-30-41(81)63(120)105-50(28-57(84)114)71(128)108-53(73(130)99-42(12-7-8-22-80)64(121)96-38(5)77(134)110-25-11-15-54(110)75(132)102-47(18-21-58(115)116)69(126)109-59(39(6)111)76(133)95-37(4)62(119)104-49)33-138-137-32-52(106-66(123)44(14-10-24-92-79(88)89)98-65(122)43(13-9-23-91-78(86)87)97-61(118)36(3)94-72(51)129)74(131)101-45(16-19-55(82)112)67(124)100-46(17-20-56(83)113)68(125)103-48(60(85)117)27-40-29-90-34-93-40/h29,34-39,41-54,59,111H,7-28,30-33,80-81H2,1-6H3,(H2,82,112)(H2,83,113)(H2,84,114)(H2,85,117)(H,90,93)(H,94,129)(H,95,133)(H,96,121)(H,97,118)(H,98,122)(H,99,130)(H,100,124)(H,101,131)(H,102,132)(H,103,125)(H,104,119)(H,105,120)(H,106,123)(H,107,127)(H,108,128)(H,109,126)(H,115,116)(H4,86,87,91)(H4,88,89,92)/t36-,37-,38-,39+,41-,42-,43-,44-,45-,46-,47-,48-,49-,50-,51-,52-,53-,54-,59-/m0/s1 | PDB
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| 0.00400 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Li£ge
Curated by ChEMBL
| Assay Description
Displacement of [125I]apamin from Wistar rat cortical apamin-sensitive site |
J Med Chem 49: 7208-14 (2006)
Article DOI: 10.1021/jm0607395
BindingDB Entry DOI: 10.7270/Q2S75K20 |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 7
(Homo sapiens (Human)) | BDBM50403770
(CHEMBL12427)Show SMILES O=C1Nc2cccc3CCCC1(CCCCN1CCN(CC1)c1ccccc1)c23 Show InChI InChI=1S/C25H31N3O/c29-24-25(14-7-9-20-8-6-12-22(26-24)23(20)25)13-4-5-15-27-16-18-28(19-17-27)21-10-2-1-3-11-21/h1-3,6,8,10-12H,4-5,7,9,13-19H2,(H,26,29) | PDB
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| 2.10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Li£ge
Curated by ChEMBL
| Assay Description
Binding affinity to 5HT7 receptor |
Bioorg Med Chem Lett 20: 1118-23 (2010)
Article DOI: 10.1016/j.bmcl.2009.12.027
BindingDB Entry DOI: 10.7270/Q2TH8MTG |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 7
(Homo sapiens (Human)) | BDBM50116963
(2a-(4-(4-phenyl-5,6-dihydropyridin-1(2H)-yl)butyl)...)Show SMILES O=C1Nc2cccc3CCCC1(CCCCN1CCC(=CC1)c1ccccc1)c23 |c:20| Show InChI InChI=1S/C26H30N2O/c29-25-26(16-7-11-22-10-6-12-23(27-25)24(22)26)15-4-5-17-28-18-13-21(14-19-28)20-8-2-1-3-9-20/h1-3,6,8-10,12-13H,4-5,7,11,14-19H2,(H,27,29) | PDB
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| 3.30 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Li£ge
Curated by ChEMBL
| Assay Description
Binding affinity to 5HT7 receptor |
Bioorg Med Chem Lett 20: 1118-23 (2010)
Article DOI: 10.1016/j.bmcl.2009.12.027
BindingDB Entry DOI: 10.7270/Q2TH8MTG |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM50203374
(CHEMBL234825 | naphthalene-2-carboxylic acid [1-(3...)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) | PDB
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| 11 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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)) | BDBM50203383
(CHEMBL228972 | N-(1-benzylpiperidin-4-yl)-2-naphth...)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) | PDB
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| 11 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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)) | BDBM50203383
(CHEMBL228972 | N-(1-benzylpiperidin-4-yl)-2-naphth...)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) | PDB
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| 11 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Faculté des Sciences Pharmaceutiques et Biologiques de Lille
Curated by ChEMBL
| Assay Description
Displacement of [3H]nemonapride from human cloned dopamine D4.2 receptor |
Bioorg Med Chem Lett 17: 1565-9 (2007)
Article DOI: 10.1016/j.bmcl.2006.12.096
BindingDB Entry DOI: 10.7270/Q2T72H3S |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM50203397
(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) | PDB
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| 16 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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)) | BDBM50203469
(3-Methoxy-naphthalene-2-carboxylic acid (1-benzyl-...)Show InChI InChI=1S/C25H28N2O2/c1-29-24-16-22-10-6-5-9-21(22)15-23(24)25(28)26-17-19-11-13-27(14-12-19)18-20-7-3-2-4-8-20/h2-10,15-16,19H,11-14,17-18H2,1H3,(H,26,28) | PDB
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| 20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Faculté des Sciences Pharmaceutiques et Biologiques de Lille
Curated by ChEMBL
| Assay Description
Displacement of [3H]nemonapride from human cloned dopamine D4.2 receptor |
Bioorg Med Chem Lett 17: 1565-9 (2007)
Article DOI: 10.1016/j.bmcl.2006.12.096
BindingDB Entry DOI: 10.7270/Q2T72H3S |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM50203376
(CHEMBL234826 | naphthalene-2-carboxylic acid [1-(4...)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) | PDB
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| 21 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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 | |
Small conductance calcium-activated potassium channel protein 1/2/3
(Rattus norvegicus-RAT-Rattus norvegicus (Rat)) | BDBM50476799
(CHEMBL397282)Show SMILES [I-].[I-].COc1cc2cc[n+](C)c(Cc3cccc(Cc4[n+](C)ccc5cc(OC)c(OC)c(OC)c45)c3)c2c(OC)c1OC Show InChI InChI=1S/C34H38N2O6/c1-35-14-12-23-19-27(37-3)31(39-5)33(41-7)29(23)25(35)17-21-10-9-11-22(16-21)18-26-30-24(13-15-36(26)2)20-28(38-4)32(40-6)34(30)42-8/h9-16,19-20H,17-18H2,1-8H3/q+2 | PDB
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| 23 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Li£ge
Curated by ChEMBL
| Assay Description
Displacement of [125I]apamin from SK channel in Wistar rat cortex |
J Med Chem 50: 5070-5 (2007)
Article DOI: 10.1021/jm070412j
BindingDB Entry DOI: 10.7270/Q28055C0 |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM50203377
(CHEMBL234647 | naphthalene-2-carboxylic acid [1-(2...)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) | PDB
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| 26 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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)) | BDBM50203467
(CHEMBL229023 | N-(1-(1-phenylethyl)piperidin-4-yl)...)Show SMILES CC(N1CCC(CC1)NC(=O)c1ccc2ccccc2c1)c1ccccc1 |w:1.0| Show InChI InChI=1S/C24H26N2O/c1-18(19-7-3-2-4-8-19)26-15-13-23(14-16-26)25-24(27)22-12-11-20-9-5-6-10-21(20)17-22/h2-12,17-18,23H,13-16H2,1H3,(H,25,27) | PDB
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| 29 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Faculté des Sciences Pharmaceutiques et Biologiques de Lille
Curated by ChEMBL
| Assay Description
Displacement of [3H]nemonapride from human cloned dopamine D4.2 receptor |
Bioorg Med Chem Lett 17: 1565-9 (2007)
Article DOI: 10.1016/j.bmcl.2006.12.096
BindingDB Entry DOI: 10.7270/Q2T72H3S |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM50203392
(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) | PDB
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| 31 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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 | |
Small conductance calcium-activated potassium channel protein 1/2/3
(Rattus norvegicus-RAT-Rattus norvegicus (Rat)) | BDBM50476809
(CHEMBL394773)Show SMILES [I-].[I-].COc1cc2cc[n+](C)c(Cc3ccccc3Cc3[n+](C)ccc4cc(OC)c(OC)cc34)c2cc1OC Show InChI InChI=1S/C32H34N2O4/c1-33-13-11-23-17-29(35-3)31(37-5)19-25(23)27(33)15-21-9-7-8-10-22(21)16-28-26-20-32(38-6)30(36-4)18-24(26)12-14-34(28)2/h7-14,17-20H,15-16H2,1-6H3/q+2 | PDB
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| 33 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Li£ge
Curated by ChEMBL
| Assay Description
Displacement of [125I]apamin from SK channel in Wistar rat cortex |
J Med Chem 50: 5070-5 (2007)
Article DOI: 10.1021/jm070412j
BindingDB Entry DOI: 10.7270/Q28055C0 |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM50203373
(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) | PDB
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| 34 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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 | |
Small conductance calcium-activated potassium channel protein 1/2/3
(Rattus norvegicus-RAT-Rattus norvegicus (Rat)) | BDBM50476802
(CHEMBL395568)Show SMILES [I-].[I-].COc1cc2cc[n+](C)c(Cc3ccccc3Cc3[n+](C)ccc4cc(OC)c(OC)c(OC)c34)c2c(OC)c1OC Show InChI InChI=1S/C34H38N2O6/c1-35-15-13-23-19-27(37-3)31(39-5)33(41-7)29(23)25(35)17-21-11-9-10-12-22(21)18-26-30-24(14-16-36(26)2)20-28(38-4)32(40-6)34(30)42-8/h9-16,19-20H,17-18H2,1-8H3/q+2 | PDB
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| 35 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Li£ge
Curated by ChEMBL
| Assay Description
Displacement of [125I]apamin from SK channel in Wistar rat cortex |
J Med Chem 50: 5070-5 (2007)
Article DOI: 10.1021/jm070412j
BindingDB Entry DOI: 10.7270/Q28055C0 |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM50203382
(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) | PDB
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| 36 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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
(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) | PDB
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| 37 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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)) | BDBM50203471
(CHEMBL388620 | N-(1-phenethylpiperidin-4-yl)-2-nap...)Show InChI InChI=1S/C24H26N2O/c27-24(22-11-10-20-8-4-5-9-21(20)18-22)25-23-13-16-26(17-14-23)15-12-19-6-2-1-3-7-19/h1-11,18,23H,12-17H2,(H,25,27) | PDB
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| 42 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Faculté des Sciences Pharmaceutiques et Biologiques de Lille
Curated by ChEMBL
| Assay Description
Displacement of [3H]ketanserin from rat cloned 5HT2A receptor |
Bioorg Med Chem Lett 17: 1565-9 (2007)
Article DOI: 10.1016/j.bmcl.2006.12.096
BindingDB Entry DOI: 10.7270/Q2T72H3S |
More data for this
Ligand-Target Pair | |
Small conductance calcium-activated potassium channel protein 1/2/3
(Rattus norvegicus-RAT-Rattus norvegicus (Rat)) | BDBM50476800
(CHEMBL242790)Show SMILES [I-].[I-].COc1cc2cc[n+](C)c(CCCCc3[n+](C)ccc4cc(OC)c(OC)c(OC)c34)c2c(OC)c1OC Show InChI InChI=1S/C30H38N2O6/c1-31-15-13-19-17-23(33-3)27(35-5)29(37-7)25(19)21(31)11-9-10-12-22-26-20(14-16-32(22)2)18-24(34-4)28(36-6)30(26)38-8/h13-18H,9-12H2,1-8H3/q+2 | PDB
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| 42 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Li£ge
Curated by ChEMBL
| Assay Description
Displacement of [125I]apamin from SK channel in Wistar rat cortex |
J Med Chem 50: 5070-5 (2007)
Article DOI: 10.1021/jm070412j
BindingDB Entry DOI: 10.7270/Q28055C0 |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM50203388
(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) | PDB
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| 43 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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
(CHEMBL228972 | N-(1-benzylpiperidin-4-yl)-2-naphth...)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) | PDB
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| 44 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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
(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) | PDB
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| 44 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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
(CHEMBL228972 | N-(1-benzylpiperidin-4-yl)-2-naphth...)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) | PDB
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| 44 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Faculté des Sciences Pharmaceutiques et Biologiques de Lille
Curated by ChEMBL
| Assay Description
Displacement of [3H]ketanserin from rat cloned 5HT2A receptor |
Bioorg Med Chem Lett 17: 1565-9 (2007)
Article DOI: 10.1016/j.bmcl.2006.12.096
BindingDB Entry DOI: 10.7270/Q2T72H3S |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 2A
(Rattus norvegicus (rat)) | BDBM50203470
(CHEMBL229024 | N-(1-(3-phenylpropyl)piperidin-4-yl...)Show InChI InChI=1S/C25H28N2O/c28-25(23-13-12-21-10-4-5-11-22(21)19-23)26-24-14-17-27(18-15-24)16-6-9-20-7-2-1-3-8-20/h1-5,7-8,10-13,19,24H,6,9,14-18H2,(H,26,28) | PDB
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| 50 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Faculté des Sciences Pharmaceutiques et Biologiques de Lille
Curated by ChEMBL
| Assay Description
Displacement of [3H]ketanserin from rat cloned 5HT2A receptor |
Bioorg Med Chem Lett 17: 1565-9 (2007)
Article DOI: 10.1016/j.bmcl.2006.12.096
BindingDB Entry DOI: 10.7270/Q2T72H3S |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 2A
(Rattus norvegicus (rat)) | BDBM50203382
(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) | PDB
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| 53 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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
(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) | PDB
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| 54 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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)) | BDBM50203470
(CHEMBL229024 | N-(1-(3-phenylpropyl)piperidin-4-yl...)Show InChI InChI=1S/C25H28N2O/c28-25(23-13-12-21-10-4-5-11-22(21)19-23)26-24-14-17-27(18-15-24)16-6-9-20-7-2-1-3-8-20/h1-5,7-8,10-13,19,24H,6,9,14-18H2,(H,26,28) | PDB
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| 63 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Faculté des Sciences Pharmaceutiques et Biologiques de Lille
Curated by ChEMBL
| Assay Description
Displacement of [3H]nemonapride from human cloned dopamine D4.2 receptor |
Bioorg Med Chem Lett 17: 1565-9 (2007)
Article DOI: 10.1016/j.bmcl.2006.12.096
BindingDB Entry DOI: 10.7270/Q2T72H3S |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM50203393
(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) | PDB
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| 66 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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
(CHEMBL233578 | naphthalene-1-carboxylic acid [1-(4...)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) | PDB
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| 69 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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)) | BDBM50203475
(CHEMBL387951 | N-(1-(3-phenylpropyl)piperidin-4-yl...)Show InChI InChI=1S/C25H28N2O/c28-25(24-14-6-12-21-11-4-5-13-23(21)24)26-22-15-18-27(19-16-22)17-7-10-20-8-2-1-3-9-20/h1-6,8-9,11-14,22H,7,10,15-19H2,(H,26,28) | PDB
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| 71 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Faculté des Sciences Pharmaceutiques et Biologiques de Lille
Curated by ChEMBL
| Assay Description
Displacement of [3H]nemonapride from human cloned dopamine D4.2 receptor |
Bioorg Med Chem Lett 17: 1565-9 (2007)
Article DOI: 10.1016/j.bmcl.2006.12.096
BindingDB Entry DOI: 10.7270/Q2T72H3S |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM50203384
(CHEMBL233404 | naphthalene-1-carboxylic acid [1-(3...)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) | PDB
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| 77 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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
(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) | PDB
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| 84 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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
(CHEMBL234825 | naphthalene-2-carboxylic acid [1-(3...)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) | PDB
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| 87 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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 | |
Small conductance calcium-activated potassium channel protein 1/2/3
(Rattus norvegicus-RAT-Rattus norvegicus (Rat)) | BDBM50476798
(CHEMBL242789)Show SMILES [I-].[I-].COc1cc2cc[n+](C)c(CCCc3[n+](C)ccc4cc(OC)c(OC)c(OC)c34)c2c(OC)c1OC Show InChI InChI=1S/C29H36N2O6/c1-30-14-12-18-16-22(32-3)26(34-5)28(36-7)24(18)20(30)10-9-11-21-25-19(13-15-31(21)2)17-23(33-4)27(35-6)29(25)37-8/h12-17H,9-11H2,1-8H3/q+2 | PDB
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| 90 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Li£ge
Curated by ChEMBL
| Assay Description
Displacement of [125I]apamin from SK channel in Wistar rat cortex |
J Med Chem 50: 5070-5 (2007)
Article DOI: 10.1021/jm070412j
BindingDB Entry DOI: 10.7270/Q28055C0 |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM50203385
(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) | PDB
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| 96 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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
(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) | PDB
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| 103 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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 | |
Small conductance calcium-activated potassium channel protein 1/2/3
(Rattus norvegicus-RAT-Rattus norvegicus (Rat)) | BDBM50476801
(CHEMBL241952)Show SMILES [I-].[I-].COc1cc2cc[n+](C)c(Cc3cccc(Cc4[n+](C)ccc5cc(OC)c(OC)cc45)c3)c2cc1OC Show InChI InChI=1S/C32H34N2O4/c1-33-12-10-23-17-29(35-3)31(37-5)19-25(23)27(33)15-21-8-7-9-22(14-21)16-28-26-20-32(38-6)30(36-4)18-24(26)11-13-34(28)2/h7-14,17-20H,15-16H2,1-6H3/q+2 | PDB
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| 106 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Li£ge
Curated by ChEMBL
| Assay Description
Displacement of [125I]apamin from SK channel in Wistar rat cortex |
J Med Chem 50: 5070-5 (2007)
Article DOI: 10.1021/jm070412j
BindingDB Entry DOI: 10.7270/Q28055C0 |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 2A
(Rattus norvegicus (rat)) | BDBM50203467
(CHEMBL229023 | N-(1-(1-phenylethyl)piperidin-4-yl)...)Show SMILES CC(N1CCC(CC1)NC(=O)c1ccc2ccccc2c1)c1ccccc1 |w:1.0| Show InChI InChI=1S/C24H26N2O/c1-18(19-7-3-2-4-8-19)26-15-13-23(14-16-26)25-24(27)22-12-11-20-9-5-6-10-21(20)17-22/h2-12,17-18,23H,13-16H2,1H3,(H,25,27) | PDB
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| 110 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Faculté des Sciences Pharmaceutiques et Biologiques de Lille
Curated by ChEMBL
| Assay Description
Displacement of [3H]ketanserin from rat cloned 5HT2A receptor |
Bioorg Med Chem Lett 17: 1565-9 (2007)
Article DOI: 10.1016/j.bmcl.2006.12.096
BindingDB Entry DOI: 10.7270/Q2T72H3S |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM50203398
(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) | PDB
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| 116 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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
(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) | PDB
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| 119 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50203469
(3-Methoxy-naphthalene-2-carboxylic acid (1-benzyl-...)Show InChI InChI=1S/C25H28N2O2/c1-29-24-16-22-10-6-5-9-21(22)15-23(24)25(28)26-17-19-11-13-27(14-12-19)18-20-7-3-2-4-8-20/h2-10,15-16,19H,11-14,17-18H2,1H3,(H,26,28) | PDB
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| 126 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Faculté des Sciences Pharmaceutiques et Biologiques de Lille
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from human cloned dopamine D2L receptor |
Bioorg Med Chem Lett 17: 1565-9 (2007)
Article DOI: 10.1016/j.bmcl.2006.12.096
BindingDB Entry DOI: 10.7270/Q2T72H3S |
More data for this
Ligand-Target Pair | |
Small conductance calcium-activated potassium channel protein 1/2/3
(Rattus norvegicus-RAT-Rattus norvegicus (Rat)) | BDBM50476807
(CHEMBL242791)Show SMILES [I-].[I-].C[n+]1ccc2ccccc2c1Cc1cccc(Cc2[n+](C)ccc3ccccc23)c1 Show InChI InChI=1S/C28H26N2/c1-29-16-14-23-10-3-5-12-25(23)27(29)19-21-8-7-9-22(18-21)20-28-26-13-6-4-11-24(26)15-17-30(28)2/h3-18H,19-20H2,1-2H3/q+2 | PDB
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| 132 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Li£ge
Curated by ChEMBL
| Assay Description
Displacement of [125I]apamin from SK channel in Wistar rat cortex |
J Med Chem 50: 5070-5 (2007)
Article DOI: 10.1021/jm070412j
BindingDB Entry DOI: 10.7270/Q28055C0 |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 2A
(Rattus norvegicus (rat)) | BDBM50203389
(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) | PDB
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| 133 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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
(CHEMBL233579 | N-(1-(2-chlorobenzyl)piperidin-4-yl...)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) | PDB
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| 133 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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)) | BDBM50203471
(CHEMBL388620 | N-(1-phenethylpiperidin-4-yl)-2-nap...)Show InChI InChI=1S/C24H26N2O/c27-24(22-11-10-20-8-4-5-9-21(20)18-22)25-23-13-16-26(17-14-23)15-12-19-6-2-1-3-7-19/h1-11,18,23H,12-17H2,(H,25,27) | PDB
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| 139 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Faculté des Sciences Pharmaceutiques et Biologiques de Lille
Curated by ChEMBL
| Assay Description
Displacement of [3H]nemonapride from human cloned dopamine D4.2 receptor |
Bioorg Med Chem Lett 17: 1565-9 (2007)
Article DOI: 10.1016/j.bmcl.2006.12.096
BindingDB Entry DOI: 10.7270/Q2T72H3S |
More data for this
Ligand-Target Pair | |
Small conductance calcium-activated potassium channel protein 1/2/3
(Rattus norvegicus-RAT-Rattus norvegicus (Rat)) | BDBM50476803
(CHEMBL242579)Show SMILES [I-].[I-].COc1cc2cc[n+](C)c(CCCCCc3[n+](C)ccc4cc(OC)c(OC)cc34)c2cc1OC Show InChI InChI=1S/C29H36N2O4/c1-30-14-12-20-16-26(32-3)28(34-5)18-22(20)24(30)10-8-7-9-11-25-23-19-29(35-6)27(33-4)17-21(23)13-15-31(25)2/h12-19H,7-11H2,1-6H3/q+2 | PDB
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| 150 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Li£ge
Curated by ChEMBL
| Assay Description
Displacement of [125I]apamin from SK channel in Wistar rat cortex |
J Med Chem 50: 5070-5 (2007)
Article DOI: 10.1021/jm070412j
BindingDB Entry DOI: 10.7270/Q28055C0 |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 2A
(Rattus norvegicus (rat)) | BDBM50203392
(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) | PDB
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| 151 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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
(CHEMBL395632 | naphthalene-1-carboxylic acid [1-(2...)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) | PDB
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| 155 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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
(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) | PDB
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| 158 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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 | |
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