Found 63 hits Enz. Inhib. hit(s) with all data for entry = 50020921 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 |
|---|
Melanin-concentrating hormone receptor 1
(RAT) | BDBM50152456
((S)-3-{3-[4-(3-Acetylamino-phenyl)-piperidin-1-yl]...)Show SMILES COCC1=C([C@@H](N(C(=O)NCCCN2CCC(CC2)c2cccc(NC(C)=O)c2)C(=O)N1)c1ccc(F)c(F)c1)C(=O)OC |t:3| Show InChI InChI=1S/C31H37F2N5O6/c1-19(39)35-23-7-4-6-21(16-23)20-10-14-37(15-11-20)13-5-12-34-30(41)38-28(22-8-9-24(32)25(33)17-22)27(29(40)44-3)26(18-43-2)36-31(38)42/h4,6-9,16-17,20,28H,5,10-15,18H2,1-3H3,(H,34,41)(H,35,39)(H,36,42)/t28-/m0/s1 | Reactome pathway
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| 0.25 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]T226296 from rat recombinant MCH1 receptor |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(RAT) | BDBM50219047
(CHEMBL245231 | N-(3-(1-(4-(3,4-difluorophenoxy)ben...)Show SMILES CC(C)C(=O)Nc1cccc(c1)C1CCN(Cc2ccc(Oc3ccc(F)c(F)c3)cc2)CC1 Show InChI InChI=1S/C28H30F2N2O2/c1-19(2)28(33)31-23-5-3-4-22(16-23)21-12-14-32(15-13-21)18-20-6-8-24(9-7-20)34-25-10-11-26(29)27(30)17-25/h3-11,16-17,19,21H,12-15,18H2,1-2H3,(H,31,33) | Reactome pathway
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| 1.80 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]T226296 from rat recombinant MCH1 receptor |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(RAT) | BDBM50219053
(CHEMBL242004 | N-(3-{1-4-(3,4-difluorophenoxy)benz...)Show SMILES CC(C)C(=O)Nc1ccc(C)c(c1)C1CCN(Cc2ccc(Oc3ccc(F)c(F)c3)cc2)CC1 Show InChI InChI=1S/C29H32F2N2O2/c1-19(2)29(34)32-23-7-4-20(3)26(16-23)22-12-14-33(15-13-22)18-21-5-8-24(9-6-21)35-25-10-11-27(30)28(31)17-25/h4-11,16-17,19,22H,12-15,18H2,1-3H3,(H,32,34) | Reactome pathway
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| 2.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]T226296 from rat recombinant MCH1 receptor |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(RAT) | BDBM50219062
(CHEMBL394569 | N-(3-{1-[4-(4-chlorophenyl)-4-oxobu...)Show SMILES CC(C)C(=O)Nc1cccc(c1)C1CCN(CCCC(=O)c2ccc(Cl)cc2)CC1 Show InChI InChI=1S/C25H31ClN2O2/c1-18(2)25(30)27-23-6-3-5-21(17-23)19-12-15-28(16-13-19)14-4-7-24(29)20-8-10-22(26)11-9-20/h3,5-6,8-11,17-19H,4,7,12-16H2,1-2H3,(H,27,30) | Reactome pathway
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| 5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]T226296 from rat recombinant MCH1 receptor |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(RAT) | BDBM50219064
(CHEMBL245010 | N-(3-{1-[4-(4-chlorophenoxy)benzyl]...)Show SMILES CC(C)C(=O)Nc1cccc(c1)C1CCN(Cc2ccc(Oc3ccc(Cl)cc3)cc2)CC1 Show InChI InChI=1S/C28H31ClN2O2/c1-20(2)28(32)30-25-5-3-4-23(18-25)22-14-16-31(17-15-22)19-21-6-10-26(11-7-21)33-27-12-8-24(29)9-13-27/h3-13,18,20,22H,14-17,19H2,1-2H3,(H,30,32) | Reactome pathway
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| 5.30 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]T226296 from rat recombinant MCH1 receptor |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(RAT) | BDBM50219050
(CHEMBL389129 | N-(3-{1-[4-(3,4-dichlorophenoxy)ben...)Show SMILES CC(C)C(=O)Nc1cccc(c1)C1CCN(Cc2ccc(Oc3ccc(Cl)c(Cl)c3)cc2)CC1 Show InChI InChI=1S/C28H30Cl2N2O2/c1-19(2)28(33)31-23-5-3-4-22(16-23)21-12-14-32(15-13-21)18-20-6-8-24(9-7-20)34-25-10-11-26(29)27(30)17-25/h3-11,16-17,19,21H,12-15,18H2,1-2H3,(H,31,33) | Reactome pathway
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| 8.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]T226296 from rat recombinant MCH1 receptor |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(RAT) | BDBM50219054
(2-methyl-N-{3-[1-(4-phenoxybenzyl)-4-piperidinyl]p...)Show SMILES CC(C)C(=O)Nc1cccc(c1)C1CCN(Cc2ccc(Oc3ccccc3)cc2)CC1 Show InChI InChI=1S/C28H32N2O2/c1-21(2)28(31)29-25-8-6-7-24(19-25)23-15-17-30(18-16-23)20-22-11-13-27(14-12-22)32-26-9-4-3-5-10-26/h3-14,19,21,23H,15-18,20H2,1-2H3,(H,29,31) | Reactome pathway
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| 10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]T226296 from rat recombinant MCH1 receptor |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(RAT) | BDBM50219055
(CHEMBL244791 | N-(3-{1-[3-(3,4-dichlorophenoxy)ben...)Show SMILES CC(C)C(=O)Nc1cccc(c1)C1CCN(Cc2cccc(Oc3ccc(Cl)c(Cl)c3)c2)CC1 Show InChI InChI=1S/C28H30Cl2N2O2/c1-19(2)28(33)31-23-7-4-6-22(16-23)21-11-13-32(14-12-21)18-20-5-3-8-24(15-20)34-25-9-10-26(29)27(30)17-25/h3-10,15-17,19,21H,11-14,18H2,1-2H3,(H,31,33) | Reactome pathway
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| 18 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]T226296 from rat recombinant MCH1 receptor |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(RAT) | BDBM50219066
(CHEMBL244578 | N-(3-{1-[3-(4-chlorophenoxy)benzyl]...)Show SMILES CC(C)C(=O)Nc1cccc(c1)C1CCN(Cc2cccc(Oc3ccc(Cl)cc3)c2)CC1 Show InChI InChI=1S/C28H31ClN2O2/c1-20(2)28(32)30-25-7-4-6-23(18-25)22-13-15-31(16-14-22)19-21-5-3-8-27(17-21)33-26-11-9-24(29)10-12-26/h3-12,17-18,20,22H,13-16,19H2,1-2H3,(H,30,32) | Reactome pathway
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| 23 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]T226296 from rat recombinant MCH1 receptor |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(RAT) | BDBM50219045
(CHEMBL242003 | N-(5-{1-[4-(3,4-difluorophenoxy)ben...)Show SMILES CC(C)C(=O)Nc1cc(ccc1C)C1CCN(Cc2ccc(Oc3ccc(F)c(F)c3)cc2)CC1 Show InChI InChI=1S/C29H32F2N2O2/c1-19(2)29(34)32-28-16-23(7-4-20(28)3)22-12-14-33(15-13-22)18-21-5-8-24(9-6-21)35-25-10-11-26(30)27(31)17-25/h4-11,16-17,19,22H,12-15,18H2,1-3H3,(H,32,34) | Reactome pathway
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| 27 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]T226296 from rat recombinant MCH1 receptor |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(RAT) | BDBM50219063
(2-methyl-N-{3-[1-(3-phenoxybenzyl)-4-piperidinyl]p...)Show SMILES CC(C)C(=O)Nc1cccc(c1)C1CCN(Cc2cccc(Oc3ccccc3)c2)CC1 Show InChI InChI=1S/C28H32N2O2/c1-21(2)28(31)29-25-10-7-9-24(19-25)23-14-16-30(17-15-23)20-22-8-6-13-27(18-22)32-26-11-4-3-5-12-26/h3-13,18-19,21,23H,14-17,20H2,1-2H3,(H,29,31) | Reactome pathway
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| 28 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]T226296 from rat recombinant MCH1 receptor |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(RAT) | BDBM50219065
(2-methyl-N-(3-{1-[3-(4-methylphenoxy)benzyl]-4-pip...)Show SMILES CC(C)C(=O)Nc1cccc(c1)C1CCN(Cc2cccc(Oc3ccc(C)cc3)c2)CC1 Show InChI InChI=1S/C29H34N2O2/c1-21(2)29(32)30-26-8-5-7-25(19-26)24-14-16-31(17-15-24)20-23-6-4-9-28(18-23)33-27-12-10-22(3)11-13-27/h4-13,18-19,21,24H,14-17,20H2,1-3H3,(H,30,32) | Reactome pathway
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| 31 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]T226296 from rat recombinant MCH1 receptor |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(RAT) | BDBM50219051
(CHEMBL245229 | N-(3-{1-[4-(4-methoxyphenoxy)benzyl...)Show SMILES COc1ccc(Oc2ccc(CN3CCC(CC3)c3cccc(NC(=O)C(C)C)c3)cc2)cc1 Show InChI InChI=1S/C29H34N2O3/c1-21(2)29(32)30-25-6-4-5-24(19-25)23-15-17-31(18-16-23)20-22-7-9-27(10-8-22)34-28-13-11-26(33-3)12-14-28/h4-14,19,21,23H,15-18,20H2,1-3H3,(H,30,32) | Reactome pathway
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| 35 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]T226296 from rat recombinant MCH1 receptor |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
Alpha-1A adrenergic receptor
(Homo sapiens (Human)) | BDBM50152456
((S)-3-{3-[4-(3-Acetylamino-phenyl)-piperidin-1-yl]...)Show SMILES COCC1=C([C@@H](N(C(=O)NCCCN2CCC(CC2)c2cccc(NC(C)=O)c2)C(=O)N1)c1ccc(F)c(F)c1)C(=O)OC |t:3| Show InChI InChI=1S/C31H37F2N5O6/c1-19(39)35-23-7-4-6-21(16-23)20-10-14-37(15-11-20)13-5-12-34-30(41)38-28(22-8-9-24(32)25(33)17-22)27(29(40)44-3)26(18-43-2)36-31(38)42/h4,6-9,16-17,20,28H,5,10-15,18H2,1-3H3,(H,34,41)(H,35,39)(H,36,42)/t28-/m0/s1 | PDB
Reactome pathway
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| 40 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Displacement of [125I]HEAT from human recombinant adrenergic alpha1A receptor |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(RAT) | BDBM50219059
(CHEMBL390212 | N-(3-{1-[3-(4-methoxyphenoxy)benzyl...)Show SMILES COc1ccc(Oc2cccc(CN3CCC(CC3)c3cccc(NC(=O)C(C)C)c3)c2)cc1 Show InChI InChI=1S/C29H34N2O3/c1-21(2)29(32)30-25-8-5-7-24(19-25)23-14-16-31(17-15-23)20-22-6-4-9-28(18-22)34-27-12-10-26(33-3)11-13-27/h4-13,18-19,21,23H,14-17,20H2,1-3H3,(H,30,32) | Reactome pathway
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| 43 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]T226296 from rat recombinant MCH1 receptor |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(RAT) | BDBM50219052
(2-methyl-N-[3-(1-{3-[3-(trifluoromethyl)phenoxy]be...)Show SMILES CC(C)C(=O)Nc1cccc(c1)C1CCN(Cc2cccc(Oc3cccc(c3)C(F)(F)F)c2)CC1 Show InChI InChI=1S/C29H31F3N2O2/c1-20(2)28(35)33-25-9-4-7-23(17-25)22-12-14-34(15-13-22)19-21-6-3-10-26(16-21)36-27-11-5-8-24(18-27)29(30,31)32/h3-11,16-18,20,22H,12-15,19H2,1-2H3,(H,33,35) | Reactome pathway
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| 65 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]T226296 from rat recombinant MCH1 receptor |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(RAT) | BDBM50219061
(CHEMBL243794 | N-(3-{1-[4-(4-chlorophenyl)-4-oxobu...)Show SMILES CC(=O)Nc1cccc(c1)C1CCN(CCCC(=O)c2ccc(Cl)cc2)CC1 Show InChI InChI=1S/C23H27ClN2O2/c1-17(27)25-22-5-2-4-20(16-22)18-11-14-26(15-12-18)13-3-6-23(28)19-7-9-21(24)10-8-19/h2,4-5,7-10,16,18H,3,6,11-15H2,1H3,(H,25,27) | Reactome pathway
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| 70 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]T226296 from rat recombinant MCH1 receptor |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(RAT) | BDBM50219048
(CHEMBL244372 | N-(3-{1-[4-(4-chlorophenyl)-4-oxobu...)Show SMILES Clc1ccc(cc1)C(=O)CCCN1CCC(CC1)c1cccc(NC(=O)Cc2ccccc2)c1 Show InChI InChI=1S/C29H31ClN2O2/c30-26-13-11-24(12-14-26)28(33)10-5-17-32-18-15-23(16-19-32)25-8-4-9-27(21-25)31-29(34)20-22-6-2-1-3-7-22/h1-4,6-9,11-14,21,23H,5,10,15-20H2,(H,31,34) | Reactome pathway
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| 84 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]T226296 from rat recombinant MCH1 receptor |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(RAT) | BDBM50219058
(CHEMBL244004 | N-(3-{1-[4-(3,4-dimethylphenyl)-4-o...)Show SMILES CC(=O)Nc1cccc(c1)C1CCN(CCCC(=O)c2ccc(C)c(C)c2)CC1 Show InChI InChI=1S/C25H32N2O2/c1-18-9-10-23(16-19(18)2)25(29)8-5-13-27-14-11-21(12-15-27)22-6-4-7-24(17-22)26-20(3)28/h4,6-7,9-10,16-17,21H,5,8,11-15H2,1-3H3,(H,26,28) | Reactome pathway
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| 100 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]T226296 from rat recombinant MCH1 receptor |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50219064
(CHEMBL245010 | N-(3-{1-[4-(4-chlorophenoxy)benzyl]...)Show SMILES CC(C)C(=O)Nc1cccc(c1)C1CCN(Cc2ccc(Oc3ccc(Cl)cc3)cc2)CC1 Show InChI InChI=1S/C28H31ClN2O2/c1-20(2)28(32)30-25-5-3-4-23(18-25)22-14-16-31(17-15-22)19-21-6-10-26(11-7-21)33-27-12-8-24(29)9-13-27/h3-13,18,20,22H,14-17,19H2,1-2H3,(H,30,32) | PDB
Reactome pathway
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| 110 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from human recombinant dopamine D2 receptor |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50219054
(2-methyl-N-{3-[1-(4-phenoxybenzyl)-4-piperidinyl]p...)Show SMILES CC(C)C(=O)Nc1cccc(c1)C1CCN(Cc2ccc(Oc3ccccc3)cc2)CC1 Show InChI InChI=1S/C28H32N2O2/c1-21(2)28(31)29-25-8-6-7-24(19-25)23-15-17-30(18-16-23)20-22-11-13-27(14-12-22)32-26-9-4-3-5-10-26/h3-14,19,21,23H,15-18,20H2,1-2H3,(H,29,31) | PDB
Reactome pathway
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| 120 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from human recombinant dopamine D2 receptor |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(RAT) | BDBM50219068
(CHEMBL245008 | N-(3-{1-[3-(3,5-dichlorophenoxy)ben...)Show SMILES CC(C)C(=O)Nc1cccc(c1)C1CCN(Cc2cccc(Oc3cc(Cl)cc(Cl)c3)c2)CC1 Show InChI InChI=1S/C28H30Cl2N2O2/c1-19(2)28(33)31-25-7-4-6-22(14-25)21-9-11-32(12-10-21)18-20-5-3-8-26(13-20)34-27-16-23(29)15-24(30)17-27/h3-8,13-17,19,21H,9-12,18H2,1-2H3,(H,31,33) | Reactome pathway
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| 140 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]T226296 from rat recombinant MCH1 receptor |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
Alpha-1A adrenergic receptor
(Homo sapiens (Human)) | BDBM50219049
(1-(4-Chloro-phenyl)-4-[4-(4-chloro-phenyl)-4-hydro...)Show SMILES OC1(CCN(CCCC(=O)c2ccc(Cl)cc2)CC1)c1ccc(Cl)cc1 Show InChI InChI=1S/C21H23Cl2NO2/c22-18-7-3-16(4-8-18)20(25)2-1-13-24-14-11-21(26,12-15-24)17-5-9-19(23)10-6-17/h3-10,26H,1-2,11-15H2 | PDB
Reactome pathway
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| 150 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Displacement of [125I]HEAT from human recombinant adrenergic alpha1A receptor |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
Alpha-1A adrenergic receptor
(Homo sapiens (Human)) | BDBM50219053
(CHEMBL242004 | N-(3-{1-4-(3,4-difluorophenoxy)benz...)Show SMILES CC(C)C(=O)Nc1ccc(C)c(c1)C1CCN(Cc2ccc(Oc3ccc(F)c(F)c3)cc2)CC1 Show InChI InChI=1S/C29H32F2N2O2/c1-19(2)29(34)32-23-7-4-20(3)26(16-23)22-12-14-33(15-13-22)18-21-5-8-24(9-6-21)35-25-10-11-27(30)28(31)17-25/h4-11,16-17,19,22H,12-15,18H2,1-3H3,(H,32,34) | PDB
Reactome pathway
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| 180 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Displacement of [125I]HEAT from human recombinant adrenergic alpha1A receptor |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50219049
(1-(4-Chloro-phenyl)-4-[4-(4-chloro-phenyl)-4-hydro...)Show SMILES OC1(CCN(CCCC(=O)c2ccc(Cl)cc2)CC1)c1ccc(Cl)cc1 Show InChI InChI=1S/C21H23Cl2NO2/c22-18-7-3-16(4-8-18)20(25)2-1-13-24-14-11-21(26,12-15-24)17-5-9-19(23)10-6-17/h3-10,26H,1-2,11-15H2 | PDB
Reactome pathway
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| 190 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from human recombinant dopamine D2 receptor |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
Alpha-1A adrenergic receptor
(Homo sapiens (Human)) | BDBM50219047
(CHEMBL245231 | N-(3-(1-(4-(3,4-difluorophenoxy)ben...)Show SMILES CC(C)C(=O)Nc1cccc(c1)C1CCN(Cc2ccc(Oc3ccc(F)c(F)c3)cc2)CC1 Show InChI InChI=1S/C28H30F2N2O2/c1-19(2)28(33)31-23-5-3-4-22(16-23)21-12-14-32(15-13-21)18-20-6-8-24(9-7-20)34-25-10-11-26(29)27(30)17-25/h3-11,16-17,19,21H,12-15,18H2,1-2H3,(H,31,33) | PDB
Reactome pathway
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| 200 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Displacement of [125I]HEAT from human recombinant adrenergic alpha1A receptor |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(RAT) | BDBM50219056
(CHEMBL244163 | N-(3-{1-[4-(4-chlorophenyl)-4-oxobu...)Show SMILES Clc1ccc(cc1)C(=O)CCCN1CCC(CC1)c1cccc(NC(=O)C2CCCCC2)c1 Show InChI InChI=1S/C28H35ClN2O2/c29-25-13-11-22(12-14-25)27(32)10-5-17-31-18-15-21(16-19-31)24-8-4-9-26(20-24)30-28(33)23-6-2-1-3-7-23/h4,8-9,11-14,20-21,23H,1-3,5-7,10,15-19H2,(H,30,33) | Reactome pathway
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| 200 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]T226296 from rat recombinant MCH1 receptor |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(RAT) | BDBM50219049
(1-(4-Chloro-phenyl)-4-[4-(4-chloro-phenyl)-4-hydro...)Show SMILES OC1(CCN(CCCC(=O)c2ccc(Cl)cc2)CC1)c1ccc(Cl)cc1 Show InChI InChI=1S/C21H23Cl2NO2/c22-18-7-3-16(4-8-18)20(25)2-1-13-24-14-11-21(26,12-15-24)17-5-9-19(23)10-6-17/h3-10,26H,1-2,11-15H2 | Reactome pathway
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| 350 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]T226296 from rat recombinant MCH1 receptor |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(RAT) | BDBM50219046
(CHEMBL395788 | N-{3-[1-(4-oxo-4-phenylbutyl)-4-pip...)Show SMILES CC(=O)Nc1cccc(c1)C1CCN(CCCC(=O)c2ccccc2)CC1 Show InChI InChI=1S/C23H28N2O2/c1-18(26)24-22-10-5-9-21(17-22)19-12-15-25(16-13-19)14-6-11-23(27)20-7-3-2-4-8-20/h2-5,7-10,17,19H,6,11-16H2,1H3,(H,24,26) | Reactome pathway
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| 350 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]T226296 from rat recombinant MCH1 receptor |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(RAT) | BDBM50219057
(CHEMBL395789 | N-(3-{1-[4-(4-methylphenyl)-4-oxobu...)Show SMILES CC(=O)Nc1cccc(c1)C1CCN(CCCC(=O)c2ccc(C)cc2)CC1 Show InChI InChI=1S/C24H30N2O2/c1-18-8-10-21(11-9-18)24(28)7-4-14-26-15-12-20(13-16-26)22-5-3-6-23(17-22)25-19(2)27/h3,5-6,8-11,17,20H,4,7,12-16H2,1-2H3,(H,25,27) | Reactome pathway
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| 360 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]T226296 from rat recombinant MCH1 receptor |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50219045
(CHEMBL242003 | N-(5-{1-[4-(3,4-difluorophenoxy)ben...)Show SMILES CC(C)C(=O)Nc1cc(ccc1C)C1CCN(Cc2ccc(Oc3ccc(F)c(F)c3)cc2)CC1 Show InChI InChI=1S/C29H32F2N2O2/c1-19(2)29(34)32-28-16-23(7-4-20(28)3)22-12-14-33(15-13-22)18-21-5-8-24(9-6-21)35-25-10-11-26(30)27(31)17-25/h4-11,16-17,19,22H,12-15,18H2,1-3H3,(H,32,34) | PDB
Reactome pathway
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| 400 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from human recombinant dopamine D2 receptor |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50219047
(CHEMBL245231 | N-(3-(1-(4-(3,4-difluorophenoxy)ben...)Show SMILES CC(C)C(=O)Nc1cccc(c1)C1CCN(Cc2ccc(Oc3ccc(F)c(F)c3)cc2)CC1 Show InChI InChI=1S/C28H30F2N2O2/c1-19(2)28(33)31-23-5-3-4-22(16-23)21-12-14-32(15-13-21)18-20-6-8-24(9-7-20)34-25-10-11-26(29)27(30)17-25/h3-11,16-17,19,21H,12-15,18H2,1-2H3,(H,31,33) | PDB
Reactome pathway
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| 470 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from human recombinant dopamine D2 receptor |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(RAT) | BDBM50219060
(CHEMBL244003 | N-(3-{1-[4-oxo-4-(4-phenoxyphenyl)b...)Show SMILES CC(=O)Nc1cccc(c1)C1CCN(CCCC(=O)c2ccc(Oc3ccccc3)cc2)CC1 Show InChI InChI=1S/C29H32N2O3/c1-22(32)30-26-8-5-7-25(21-26)23-16-19-31(20-17-23)18-6-11-29(33)24-12-14-28(15-13-24)34-27-9-3-2-4-10-27/h2-5,7-10,12-15,21,23H,6,11,16-20H2,1H3,(H,30,32) | Reactome pathway
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| 490 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]T226296 from rat recombinant MCH1 receptor |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(RAT) | BDBM50219067
(CHEMBL244576 | N-(3-{1-[3-(4-tert-butylphenoxy)ben...)Show SMILES CC(C)C(=O)Nc1cccc(c1)C1CCN(Cc2cccc(Oc3ccc(cc3)C(C)(C)C)c2)CC1 Show InChI InChI=1S/C32H40N2O2/c1-23(2)31(35)33-28-10-7-9-26(21-28)25-16-18-34(19-17-25)22-24-8-6-11-30(20-24)36-29-14-12-27(13-15-29)32(3,4)5/h6-15,20-21,23,25H,16-19,22H2,1-5H3,(H,33,35) | Reactome pathway
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| 540 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]T226296 from rat recombinant MCH1 receptor |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50219062
(CHEMBL394569 | N-(3-{1-[4-(4-chlorophenyl)-4-oxobu...)Show SMILES CC(C)C(=O)Nc1cccc(c1)C1CCN(CCCC(=O)c2ccc(Cl)cc2)CC1 Show InChI InChI=1S/C25H31ClN2O2/c1-18(2)25(30)27-23-6-3-5-21(17-23)19-12-15-28(16-13-19)14-4-7-24(29)20-8-10-22(26)11-9-20/h3,5-6,8-11,17-19H,4,7,12-16H2,1-2H3,(H,27,30) | PDB
Reactome pathway
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| 610 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from human recombinant dopamine D2 receptor |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50219048
(CHEMBL244372 | N-(3-{1-[4-(4-chlorophenyl)-4-oxobu...)Show SMILES Clc1ccc(cc1)C(=O)CCCN1CCC(CC1)c1cccc(NC(=O)Cc2ccccc2)c1 Show InChI InChI=1S/C29H31ClN2O2/c30-26-13-11-24(12-14-26)28(33)10-5-17-32-18-15-23(16-19-32)25-8-4-9-27(21-25)31-29(34)20-22-6-2-1-3-7-22/h1-4,6-9,11-14,21,23H,5,10,15-20H2,(H,31,34) | PDB
Reactome pathway
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| 780 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from human recombinant dopamine D2 receptor |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50219059
(CHEMBL390212 | N-(3-{1-[3-(4-methoxyphenoxy)benzyl...)Show SMILES COc1ccc(Oc2cccc(CN3CCC(CC3)c3cccc(NC(=O)C(C)C)c3)c2)cc1 Show InChI InChI=1S/C29H34N2O3/c1-21(2)29(32)30-25-8-5-7-24(19-25)23-14-16-31(17-15-23)20-22-6-4-9-28(18-22)34-27-12-10-26(33-3)11-13-27/h4-13,18-19,21,23H,14-17,20H2,1-3H3,(H,30,32) | PDB
Reactome pathway
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PubMed
| 1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from human recombinant dopamine D2 receptor |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
Alpha-1A adrenergic receptor
(Homo sapiens (Human)) | BDBM50219045
(CHEMBL242003 | N-(5-{1-[4-(3,4-difluorophenoxy)ben...)Show SMILES CC(C)C(=O)Nc1cc(ccc1C)C1CCN(Cc2ccc(Oc3ccc(F)c(F)c3)cc2)CC1 Show InChI InChI=1S/C29H32F2N2O2/c1-19(2)29(34)32-28-16-23(7-4-20(28)3)22-12-14-33(15-13-22)18-21-5-8-24(9-6-21)35-25-10-11-26(30)27(31)17-25/h4-11,16-17,19,22H,12-15,18H2,1-3H3,(H,32,34) | PDB
Reactome pathway
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| Article
PubMed
| 1.01E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Displacement of [125I]HEAT from human recombinant adrenergic alpha1A receptor |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50219065
(2-methyl-N-(3-{1-[3-(4-methylphenoxy)benzyl]-4-pip...)Show SMILES CC(C)C(=O)Nc1cccc(c1)C1CCN(Cc2cccc(Oc3ccc(C)cc3)c2)CC1 Show InChI InChI=1S/C29H34N2O2/c1-21(2)29(32)30-26-8-5-7-25(19-26)24-14-16-31(17-15-24)20-23-6-4-9-28(18-23)33-27-12-10-22(3)11-13-27/h4-13,18-19,21,24H,14-17,20H2,1-3H3,(H,30,32) | PDB
Reactome pathway
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| Article
PubMed
| 1.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from human recombinant dopamine D2 receptor |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50219061
(CHEMBL243794 | N-(3-{1-[4-(4-chlorophenyl)-4-oxobu...)Show SMILES CC(=O)Nc1cccc(c1)C1CCN(CCCC(=O)c2ccc(Cl)cc2)CC1 Show InChI InChI=1S/C23H27ClN2O2/c1-17(27)25-22-5-2-4-20(16-22)18-11-14-26(15-12-18)13-3-6-23(28)19-7-9-21(24)10-8-19/h2,4-5,7-10,16,18H,3,6,11-15H2,1H3,(H,25,27) | PDB
Reactome pathway
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PubMed
| 1.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from human recombinant dopamine D2 receptor |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50219051
(CHEMBL245229 | N-(3-{1-[4-(4-methoxyphenoxy)benzyl...)Show SMILES COc1ccc(Oc2ccc(CN3CCC(CC3)c3cccc(NC(=O)C(C)C)c3)cc2)cc1 Show InChI InChI=1S/C29H34N2O3/c1-21(2)29(32)30-25-6-4-5-24(19-25)23-15-17-31(18-16-23)20-22-7-9-27(10-8-22)34-28-13-11-26(33-3)12-14-28/h4-14,19,21,23H,15-18,20H2,1-3H3,(H,30,32) | PDB
Reactome pathway
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| Article
PubMed
| 1.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from human recombinant dopamine D2 receptor |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50152456
((S)-3-{3-[4-(3-Acetylamino-phenyl)-piperidin-1-yl]...)Show SMILES COCC1=C([C@@H](N(C(=O)NCCCN2CCC(CC2)c2cccc(NC(C)=O)c2)C(=O)N1)c1ccc(F)c(F)c1)C(=O)OC |t:3| Show InChI InChI=1S/C31H37F2N5O6/c1-19(39)35-23-7-4-6-21(16-23)20-10-14-37(15-11-20)13-5-12-34-30(41)38-28(22-8-9-24(32)25(33)17-22)27(29(40)44-3)26(18-43-2)36-31(38)42/h4,6-9,16-17,20,28H,5,10-15,18H2,1-3H3,(H,34,41)(H,35,39)(H,36,42)/t28-/m0/s1 | PDB
Reactome pathway
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| Article
PubMed
| 2.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from human recombinant dopamine D2 receptor |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50219050
(CHEMBL389129 | N-(3-{1-[4-(3,4-dichlorophenoxy)ben...)Show SMILES CC(C)C(=O)Nc1cccc(c1)C1CCN(Cc2ccc(Oc3ccc(Cl)c(Cl)c3)cc2)CC1 Show InChI InChI=1S/C28H30Cl2N2O2/c1-19(2)28(33)31-23-5-3-4-22(16-23)21-12-14-32(15-13-21)18-20-6-8-24(9-7-20)34-25-10-11-26(29)27(30)17-25/h3-11,16-17,19,21H,12-15,18H2,1-2H3,(H,31,33) | PDB
Reactome pathway
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| Article
PubMed
| 2.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from human recombinant dopamine D2 receptor |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50219058
(CHEMBL244004 | N-(3-{1-[4-(3,4-dimethylphenyl)-4-o...)Show SMILES CC(=O)Nc1cccc(c1)C1CCN(CCCC(=O)c2ccc(C)c(C)c2)CC1 Show InChI InChI=1S/C25H32N2O2/c1-18-9-10-23(16-19(18)2)25(29)8-5-13-27-14-11-21(12-15-27)22-6-4-7-24(17-22)26-20(3)28/h4,6-7,9-10,16-17,21H,5,8,11-15H2,1-3H3,(H,26,28) | PDB
Reactome pathway
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PubMed
| 6.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from human recombinant dopamine D2 receptor |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50219053
(CHEMBL242004 | N-(3-{1-4-(3,4-difluorophenoxy)benz...)Show SMILES CC(C)C(=O)Nc1ccc(C)c(c1)C1CCN(Cc2ccc(Oc3ccc(F)c(F)c3)cc2)CC1 Show InChI InChI=1S/C29H32F2N2O2/c1-19(2)29(34)32-23-7-4-20(3)26(16-23)22-12-14-33(15-13-22)18-21-5-8-24(9-6-21)35-25-10-11-27(30)28(31)17-25/h4-11,16-17,19,22H,12-15,18H2,1-3H3,(H,32,34) | PDB
Reactome pathway
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| Article
PubMed
| 7.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from human recombinant dopamine D2 receptor |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
Alpha-1A adrenergic receptor
(Homo sapiens (Human)) | BDBM50219050
(CHEMBL389129 | N-(3-{1-[4-(3,4-dichlorophenoxy)ben...)Show SMILES CC(C)C(=O)Nc1cccc(c1)C1CCN(Cc2ccc(Oc3ccc(Cl)c(Cl)c3)cc2)CC1 Show InChI InChI=1S/C28H30Cl2N2O2/c1-19(2)28(33)31-23-5-3-4-22(16-23)21-12-14-32(15-13-21)18-20-6-8-24(9-7-20)34-25-10-11-26(29)27(30)17-25/h3-11,16-17,19,21H,12-15,18H2,1-2H3,(H,31,33) | PDB
Reactome pathway
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PubMed
| 3.40E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Displacement of [125I]HEAT from human recombinant adrenergic alpha1A receptor |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(RAT) | BDBM50219062
(CHEMBL394569 | N-(3-{1-[4-(4-chlorophenyl)-4-oxobu...)Show SMILES CC(C)C(=O)Nc1cccc(c1)C1CCN(CCCC(=O)c2ccc(Cl)cc2)CC1 Show InChI InChI=1S/C25H31ClN2O2/c1-18(2)25(30)27-23-6-3-5-21(17-23)19-12-15-28(16-13-19)14-4-7-24(29)20-8-10-22(26)11-9-20/h3,5-6,8-11,17-19H,4,7,12-16H2,1-2H3,(H,27,30) | Reactome pathway
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| Article
PubMed
| n/a | n/a | 72 | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Antagonist activity at rat MCH1 receptor expressed in HEK293 cells by FLIPR calcium mobility assay |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(RAT) | BDBM50219047
(CHEMBL245231 | N-(3-(1-(4-(3,4-difluorophenoxy)ben...)Show SMILES CC(C)C(=O)Nc1cccc(c1)C1CCN(Cc2ccc(Oc3ccc(F)c(F)c3)cc2)CC1 Show InChI InChI=1S/C28H30F2N2O2/c1-19(2)28(33)31-23-5-3-4-22(16-23)21-12-14-32(15-13-21)18-20-6-8-24(9-7-20)34-25-10-11-26(29)27(30)17-25/h3-11,16-17,19,21H,12-15,18H2,1-2H3,(H,31,33) | Reactome pathway
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| Article
PubMed
| n/a | n/a | 110 | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Antagonist activity at rat MCH1 receptor expressed in HEK293 cells by FLIPR calcium mobility assay |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(RAT) | BDBM50219053
(CHEMBL242004 | N-(3-{1-4-(3,4-difluorophenoxy)benz...)Show SMILES CC(C)C(=O)Nc1ccc(C)c(c1)C1CCN(Cc2ccc(Oc3ccc(F)c(F)c3)cc2)CC1 Show InChI InChI=1S/C29H32F2N2O2/c1-19(2)29(34)32-23-7-4-20(3)26(16-23)22-12-14-33(15-13-22)18-21-5-8-24(9-6-21)35-25-10-11-27(30)28(31)17-25/h4-11,16-17,19,22H,12-15,18H2,1-3H3,(H,32,34) | Reactome pathway
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PubMed
| n/a | n/a | 230 | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Antagonist activity at rat MCH1 receptor expressed in HEK293 cells by FLIPR calcium mobility assay |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
Melanin-concentrating hormone receptor 1
(RAT) | BDBM50219054
(2-methyl-N-{3-[1-(4-phenoxybenzyl)-4-piperidinyl]p...)Show SMILES CC(C)C(=O)Nc1cccc(c1)C1CCN(Cc2ccc(Oc3ccccc3)cc2)CC1 Show InChI InChI=1S/C28H32N2O2/c1-21(2)28(31)29-25-8-6-7-24(19-25)23-15-17-30(18-16-23)20-22-11-13-27(14-12-22)32-26-9-4-3-5-10-26/h3-14,19,21,23H,15-18,20H2,1-2H3,(H,29,31) | Reactome pathway
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| Article
PubMed
| n/a | n/a | 320 | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Antagonist activity at rat MCH1 receptor expressed in HEK293 cells by FLIPR calcium mobility assay |
J Med Chem 50: 3883-90 (2007)
Article DOI: 10.1021/jm060383x
BindingDB Entry DOI: 10.7270/Q25D8RJM |
More data for this
Ligand-Target Pair | |
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