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Compile Data Set for Download or QSAR

Found 125 hits with Last Name = 'colpaert' and Initial = 'f'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50476127
PNG
(CHEMBL218217)
Show SMILES CC(C)Oc1ccccc1OCCNCc1cccc(c1)-c1ccccc1
Show InChI InChI=1S/C24H27NO2/c1-19(2)27-24-14-7-6-13-23(24)26-16-15-25-18-20-9-8-12-22(17-20)21-10-4-3-5-11-21/h3-14,17,19,25H,15-16,18H2,1-2H3
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0.195n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Displacement of [3H]YM-09151-2 from rat striatum D2 receptor


J Med Chem 50: 865-76 (2007)


Article DOI: 10.1021/jm061180b
BindingDB Entry DOI: 10.7270/Q2ZS309D
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50476128
PNG
(CHEMBL384657)
Show SMILES CC1(C)Cc2cccc(OCCNCc3cncc(c3)C3=CCCC3)c2O1 |t:21|
Show InChI InChI=1S/C23H28N2O2/c1-23(2)13-19-8-5-9-21(22(19)27-23)26-11-10-24-14-17-12-20(16-25-15-17)18-6-3-4-7-18/h5-6,8-9,12,15-16,24H,3-4,7,10-11,13-14H2,1-2H3
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0.275n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Displacement of [3H]YM-09151-2 from rat striatum D2 receptor


J Med Chem 50: 865-76 (2007)


Article DOI: 10.1021/jm061180b
BindingDB Entry DOI: 10.7270/Q2ZS309D
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50476119
PNG
(CHEMBL386988)
Show SMILES CC(C)Oc1ccccc1OCCNCc1cccc(c1)-c1ccsc1
Show InChI InChI=1S/C22H25NO2S/c1-17(2)25-22-9-4-3-8-21(22)24-12-11-23-15-18-6-5-7-19(14-18)20-10-13-26-16-20/h3-10,13-14,16-17,23H,11-12,15H2,1-2H3
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0.275n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Displacement of [3H]YM-09151-2 from rat striatum D2 receptor


J Med Chem 50: 865-76 (2007)


Article DOI: 10.1021/jm061180b
BindingDB Entry DOI: 10.7270/Q2ZS309D
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50476125
PNG
(CHEMBL376634)
Show SMILES CC(C)Oc1ccccc1OCCNCc1cccc(c1)-c1ccco1
Show InChI InChI=1S/C22H25NO3/c1-17(2)26-22-10-4-3-9-21(22)25-14-12-23-16-18-7-5-8-19(15-18)20-11-6-13-24-20/h3-11,13,15,17,23H,12,14,16H2,1-2H3
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0.339n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Displacement of [3H]YM-09151-2 from rat striatum D2 receptor


J Med Chem 50: 865-76 (2007)


Article DOI: 10.1021/jm061180b
BindingDB Entry DOI: 10.7270/Q2ZS309D
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50476132
PNG
(CHEMBL218261)
Show SMILES CC1(C)Cc2cccc(OCCNCc3cccc(c3)C3=CCCC3)c2O1 |t:21|
Show InChI InChI=1S/C24H29NO2/c1-24(2)16-21-11-6-12-22(23(21)27-24)26-14-13-25-17-18-7-5-10-20(15-18)19-8-3-4-9-19/h5-8,10-12,15,25H,3-4,9,13-14,16-17H2,1-2H3
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0.417n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Displacement of [3H]YM-09151-2 from rat striatum D2 receptor


J Med Chem 50: 865-76 (2007)


Article DOI: 10.1021/jm061180b
BindingDB Entry DOI: 10.7270/Q2ZS309D
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM50476730
PNG
(CHEMBL231471)
Show SMILES Fc1ccc(cc1Cl)C(=O)N1CCC(F)(CNCc2nccc(n2)-c2ccco2)CC1
Show InChI InChI=1S/C22H21ClF2N4O2/c23-16-12-15(3-4-17(16)24)21(30)29-9-6-22(25,7-10-29)14-26-13-20-27-8-5-18(28-20)19-2-1-11-31-19/h1-5,8,11-12,26H,6-7,9-10,13-14H2
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0.427n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Binding affinity to 5HT1A receptor in rat cortex membrane


J Med Chem 50: 5024-33 (2007)


Article DOI: 10.1021/jm070714l
BindingDB Entry DOI: 10.7270/Q2HH6NTB
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50476120
PNG
(CHEMBL221920)
Show SMILES C(COc1cccc2CC3(CC3)Oc12)NCc1cncc(c1)C1=CCCC1 |t:26|
Show InChI InChI=1S/C23H26N2O2/c1-2-5-18(4-1)20-12-17(15-25-16-20)14-24-10-11-26-21-7-3-6-19-13-23(8-9-23)27-22(19)21/h3-4,6-7,12,15-16,24H,1-2,5,8-11,13-14H2
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0.447n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Displacement of [3H]YM-09151-2 from rat striatum D2 receptor


J Med Chem 50: 865-76 (2007)


Article DOI: 10.1021/jm061180b
BindingDB Entry DOI: 10.7270/Q2ZS309D
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50476116
PNG
(CHEMBL220809)
Show SMILES CC(C)Oc1ccccc1OCCNCc1cccc(c1)C1=CCCC1 |t:23|
Show InChI InChI=1S/C23H29NO2/c1-18(2)26-23-13-6-5-12-22(23)25-15-14-24-17-19-8-7-11-21(16-19)20-9-3-4-10-20/h5-9,11-13,16,18,24H,3-4,10,14-15,17H2,1-2H3
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0.501n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Displacement of [3H]YM-09151-2 from rat striatum D2 receptor


J Med Chem 50: 865-76 (2007)


Article DOI: 10.1021/jm061180b
BindingDB Entry DOI: 10.7270/Q2ZS309D
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50476115
PNG
(CHEMBL425810)
Show SMILES CC(C)Oc1ccccc1OCCNCc1cccc(c1)-c1cccs1
Show InChI InChI=1S/C22H25NO2S/c1-17(2)25-21-10-4-3-9-20(21)24-13-12-23-16-18-7-5-8-19(15-18)22-11-6-14-26-22/h3-11,14-15,17,23H,12-13,16H2,1-2H3
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0.562n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Displacement of [3H]YM-09151-2 from rat striatum D2 receptor


J Med Chem 50: 865-76 (2007)


Article DOI: 10.1021/jm061180b
BindingDB Entry DOI: 10.7270/Q2ZS309D
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50476130
PNG
(CHEMBL413777)
Show SMILES CC(C)Oc1ccccc1OCCNCc1cccc(c1)C1CCCC1
Show InChI InChI=1S/C23H31NO2/c1-18(2)26-23-13-6-5-12-22(23)25-15-14-24-17-19-8-7-11-21(16-19)20-9-3-4-10-20/h5-8,11-13,16,18,20,24H,3-4,9-10,14-15,17H2,1-2H3
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0.562n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Displacement of [3H]YM-09151-2 from rat striatum D2 receptor


J Med Chem 50: 865-76 (2007)


Article DOI: 10.1021/jm061180b
BindingDB Entry DOI: 10.7270/Q2ZS309D
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50476122
PNG
(CHEMBL219111)
Show SMILES CC(C)Oc1ccccc1OCCNCc1cccc(c1)C1CC1
Show InChI InChI=1S/C21H27NO2/c1-16(2)24-21-9-4-3-8-20(21)23-13-12-22-15-17-6-5-7-19(14-17)18-10-11-18/h3-9,14,16,18,22H,10-13,15H2,1-2H3
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0.603n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Displacement of [3H]YM-09151-2 from rat striatum D2 receptor


J Med Chem 50: 865-76 (2007)


Article DOI: 10.1021/jm061180b
BindingDB Entry DOI: 10.7270/Q2ZS309D
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM50476729
PNG
(CHEMBL425833)
Show SMILES Fc1ccc(cc1Cl)C(=O)N1CCC(F)(CNCc2ccc(Cl)cn2)CC1
Show InChI InChI=1S/C19H19Cl2F2N3O/c20-14-2-3-15(25-10-14)11-24-12-19(23)5-7-26(8-6-19)18(27)13-1-4-17(22)16(21)9-13/h1-4,9-10,24H,5-8,11-12H2
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0.692n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Binding affinity to 5HT1A receptor in rat cortex membrane


J Med Chem 50: 5024-33 (2007)


Article DOI: 10.1021/jm070714l
BindingDB Entry DOI: 10.7270/Q2HH6NTB
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM50476740
PNG
(CHEMBL396062)
Show SMILES CNc1nc(CNCC2(F)CCN(CC2)C(=O)c2ccc(F)c(Cl)c2)ncc1Cl
Show InChI InChI=1S/C19H21Cl2F2N5O/c1-24-17-14(21)9-26-16(27-17)10-25-11-19(23)4-6-28(7-5-19)18(29)12-2-3-15(22)13(20)8-12/h2-3,8-9,25H,4-7,10-11H2,1H3,(H,24,26,27)
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0.741n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Binding affinity to 5HT1A receptor in rat cortex membrane


J Med Chem 50: 5024-33 (2007)


Article DOI: 10.1021/jm070714l
BindingDB Entry DOI: 10.7270/Q2HH6NTB
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50476124
PNG
(CHEMBL375297)
Show SMILES C(COc1cccc2OCCOc12)NCc1cccc(c1)C1=CCCC1 |t:24|
Show InChI InChI=1S/C22H25NO3/c1-2-7-18(6-1)19-8-3-5-17(15-19)16-23-11-12-24-20-9-4-10-21-22(20)26-14-13-25-21/h3-6,8-10,15,23H,1-2,7,11-14,16H2
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0.776n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Displacement of [3H]YM-09151-2 from rat striatum D2 receptor


J Med Chem 50: 865-76 (2007)


Article DOI: 10.1021/jm061180b
BindingDB Entry DOI: 10.7270/Q2ZS309D
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50476129
PNG
(CHEMBL221183)
Show SMILES CC1(C)COc2c1cccc2OCCNCc1cccc(c1)C1=CCCC1 |t:25|
Show InChI InChI=1S/C24H29NO2/c1-24(2)17-27-23-21(24)11-6-12-22(23)26-14-13-25-16-18-7-5-10-20(15-18)19-8-3-4-9-19/h5-8,10-12,15,25H,3-4,9,13-14,16-17H2,1-2H3
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0.813n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Displacement of [3H]YM-09151-2 from rat striatum D2 receptor


J Med Chem 50: 865-76 (2007)


Article DOI: 10.1021/jm061180b
BindingDB Entry DOI: 10.7270/Q2ZS309D
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM50328639
PNG
((3-Chloro-4-fluoro-phenyl)-(4-fluoro-4-{[(5-methyl...)
Show SMILES Cc1ccc(CNCC2(F)CCN(CC2)C(=O)c2ccc(F)c(Cl)c2)nc1
Show InChI InChI=1S/C20H22ClF2N3O/c1-14-2-4-16(25-11-14)12-24-13-20(23)6-8-26(9-7-20)19(27)15-3-5-18(22)17(21)10-15/h2-5,10-11,24H,6-9,12-13H2,1H3
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0.851n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Binding affinity to 5HT1A receptor in rat cortex membrane


J Med Chem 50: 5024-33 (2007)


Article DOI: 10.1021/jm070714l
BindingDB Entry DOI: 10.7270/Q2HH6NTB
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM50476128
PNG
(CHEMBL384657)
Show SMILES CC1(C)Cc2cccc(OCCNCc3cncc(c3)C3=CCCC3)c2O1 |t:21|
Show InChI InChI=1S/C23H28N2O2/c1-23(2)13-19-8-5-9-21(22(19)27-23)26-11-10-24-14-17-12-20(16-25-15-17)18-6-3-4-7-18/h5-6,8-9,12,15-16,24H,3-4,7,10-11,13-14H2,1-2H3
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0.955n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Displacement of [3H]OH-DPAT from rat cortex 5HT1A receptor


J Med Chem 50: 865-76 (2007)


Article DOI: 10.1021/jm061180b
BindingDB Entry DOI: 10.7270/Q2ZS309D
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50476131
PNG
(CHEMBL218313)
Show SMILES C(COc1cccc2CC3(CC3)Oc12)NCc1cccc(c1)C1=CCCC1 |t:26|
Show InChI InChI=1S/C24H27NO2/c1-2-7-19(6-1)20-8-3-5-18(15-20)17-25-13-14-26-22-10-4-9-21-16-24(11-12-24)27-23(21)22/h3-6,8-10,15,25H,1-2,7,11-14,16-17H2
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1.10n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Displacement of [3H]YM-09151-2 from rat striatum D2 receptor


J Med Chem 50: 865-76 (2007)


Article DOI: 10.1021/jm061180b
BindingDB Entry DOI: 10.7270/Q2ZS309D
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50476126
PNG
(CHEMBL219486)
Show SMILES CC1(C)Oc2cccc(OCCNCc3cccc(c3)C3=CCCC3)c2O1 |t:21|
Show InChI InChI=1S/C23H27NO3/c1-23(2)26-21-12-6-11-20(22(21)27-23)25-14-13-24-16-17-7-5-10-19(15-17)18-8-3-4-9-18/h5-8,10-12,15,24H,3-4,9,13-14,16H2,1-2H3
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1.20n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Displacement of [3H]YM-09151-2 from rat striatum D2 receptor


J Med Chem 50: 865-76 (2007)


Article DOI: 10.1021/jm061180b
BindingDB Entry DOI: 10.7270/Q2ZS309D
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM50476727
PNG
(CHEMBL394530)
Show SMILES FCc1ccc(CNCC2(F)CCN(CC2)C(=O)c2ccc(F)c(Cl)c2)nc1
Show InChI InChI=1S/C20H21ClF3N3O/c21-17-9-15(2-4-18(17)23)19(28)27-7-5-20(24,6-8-27)13-25-12-16-3-1-14(10-22)11-26-16/h1-4,9,11,25H,5-8,10,12-13H2
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1.20n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Binding affinity to 5HT1A receptor in rat cortex membrane


J Med Chem 50: 5024-33 (2007)


Article DOI: 10.1021/jm070714l
BindingDB Entry DOI: 10.7270/Q2HH6NTB
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM21393
PNG
(7-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-o...)
Show SMILES CCCN(CCC)C1CCc2cccc(O)c2C1
Show InChI InChI=1S/C16H25NO/c1-3-10-17(11-4-2)14-9-8-13-6-5-7-16(18)15(13)12-14/h5-7,14,18H,3-4,8-12H2,1-2H3
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1.40n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Binding affinity to 5HT1A receptor in rat cortex membrane


J Med Chem 50: 5024-33 (2007)


Article DOI: 10.1021/jm070714l
BindingDB Entry DOI: 10.7270/Q2HH6NTB
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM21393
PNG
(7-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-o...)
Show SMILES CCCN(CCC)C1CCc2cccc(O)c2C1
Show InChI InChI=1S/C16H25NO/c1-3-10-17(11-4-2)14-9-8-13-6-5-7-16(18)15(13)12-14/h5-7,14,18H,3-4,8-12H2,1-2H3
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1.40n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Displacement of [3H]OH-DPAT from rat cortex 5HT1A receptor


J Med Chem 50: 865-76 (2007)


Article DOI: 10.1021/jm061180b
BindingDB Entry DOI: 10.7270/Q2ZS309D
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50241119
PNG
(7-(4-Biphenyl-3-ylmethyl-piperazin-1-yl)-3H-benzoo...)
Show SMILES O=c1[nH]c2cccc(N3CCN(Cc4cccc(c4)-c4ccccc4)CC3)c2o1
Show InChI InChI=1S/C24H23N3O2/c28-24-25-21-10-5-11-22(23(21)29-24)27-14-12-26(13-15-27)17-18-6-4-9-20(16-18)19-7-2-1-3-8-19/h1-11,16H,12-15,17H2,(H,25,28)
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1.5n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Displacement of [3H]YM-09151-2 from rat striatum D2 receptor


J Med Chem 50: 865-76 (2007)


Article DOI: 10.1021/jm061180b
BindingDB Entry DOI: 10.7270/Q2ZS309D
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50476118
PNG
(CHEMBL221743)
Show SMILES CC(C)Oc1ccccc1OCCNCc1cccc(c1)C1=CCCCC1 |t:23|
Show InChI InChI=1S/C24H31NO2/c1-19(2)27-24-14-7-6-13-23(24)26-16-15-25-18-20-9-8-12-22(17-20)21-10-4-3-5-11-21/h6-10,12-14,17,19,25H,3-5,11,15-16,18H2,1-2H3
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1.5n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Displacement of [3H]YM-09151-2 from rat striatum D2 receptor


J Med Chem 50: 865-76 (2007)


Article DOI: 10.1021/jm061180b
BindingDB Entry DOI: 10.7270/Q2ZS309D
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM50476732
PNG
(CHEMBL394606)
Show SMILES CNc1nc(CNCC2(F)CCN(CC2)C(=O)c2ccc(F)c(Cl)c2)ncc1C
Show InChI InChI=1S/C20H24ClF2N5O/c1-13-10-26-17(27-18(13)24-2)11-25-12-20(23)5-7-28(8-6-20)19(29)14-3-4-16(22)15(21)9-14/h3-4,9-10,25H,5-8,11-12H2,1-2H3,(H,24,26,27)
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1.70n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Binding affinity to 5HT1A receptor in rat cortex membrane


J Med Chem 50: 5024-33 (2007)


Article DOI: 10.1021/jm070714l
BindingDB Entry DOI: 10.7270/Q2HH6NTB
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM50476124
PNG
(CHEMBL375297)
Show SMILES C(COc1cccc2OCCOc12)NCc1cccc(c1)C1=CCCC1 |t:24|
Show InChI InChI=1S/C22H25NO3/c1-2-7-18(6-1)19-8-3-5-17(15-19)16-23-11-12-24-20-9-4-10-21-22(20)26-14-13-25-21/h3-6,8-10,15,23H,1-2,7,11-14,16H2
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1.70n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Displacement of [3H]OH-DPAT from rat cortex 5HT1A receptor


J Med Chem 50: 865-76 (2007)


Article DOI: 10.1021/jm061180b
BindingDB Entry DOI: 10.7270/Q2ZS309D
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM10755
PNG
(14C-5-hydroxy tryptamine creatinine disulfate | 2-...)
Show SMILES NCCc1c[nH]c2ccc(O)cc12
Show InChI InChI=1S/C10H12N2O/c11-4-3-7-6-12-10-2-1-8(13)5-9(7)10/h1-2,5-6,12-13H,3-4,11H2
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1.90n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Binding affinity to 5HT1A receptor in rat cortex membrane


J Med Chem 50: 5024-33 (2007)


Article DOI: 10.1021/jm070714l
BindingDB Entry DOI: 10.7270/Q2HH6NTB
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM50476734
PNG
(CHEMBL230963)
Show SMILES Cc1cnc(CNCC2(F)CCN(CC2)C(=O)c2ccc(F)c(Cl)c2)nc1
Show InChI InChI=1S/C19H21ClF2N4O/c1-13-9-24-17(25-10-13)11-23-12-19(22)4-6-26(7-5-19)18(27)14-2-3-16(21)15(20)8-14/h2-3,8-10,23H,4-7,11-12H2,1H3
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2.20n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Binding affinity to 5HT1A receptor in rat cortex membrane


J Med Chem 50: 5024-33 (2007)


Article DOI: 10.1021/jm070714l
BindingDB Entry DOI: 10.7270/Q2HH6NTB
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM50027256
PNG
(Sarizotan)
Show SMILES Fc1ccc(cc1)-c1cncc(CNC[C@H]2CCc3ccccc3O2)c1
Show InChI InChI=1S/C22H21FN2O/c23-20-8-5-17(6-9-20)19-11-16(12-24-14-19)13-25-15-21-10-7-18-3-1-2-4-22(18)26-21/h1-6,8-9,11-12,14,21,25H,7,10,13,15H2/t21-/m1/s1
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2.20n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Displacement of [3H]OH-DPAT from rat cortex 5HT1A receptor


J Med Chem 50: 865-76 (2007)


Article DOI: 10.1021/jm061180b
BindingDB Entry DOI: 10.7270/Q2ZS309D
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM50476736
PNG
(CHEMBL394778)
Show SMILES CN(C)c1ccnc(CNCC2(F)CCN(CC2)C(=O)c2ccc(F)c(Cl)c2)n1
Show InChI InChI=1S/C20H24ClF2N5O/c1-27(2)18-5-8-25-17(26-18)12-24-13-20(23)6-9-28(10-7-20)19(29)14-3-4-16(22)15(21)11-14/h3-5,8,11,24H,6-7,9-10,12-13H2,1-2H3
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2.30n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Binding affinity to 5HT1A receptor in rat cortex membrane


J Med Chem 50: 5024-33 (2007)


Article DOI: 10.1021/jm070714l
BindingDB Entry DOI: 10.7270/Q2HH6NTB
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM248056
PNG
(1-(2,3-dihydro-1,4-benzodioxin-5-yl)-4-[[5-(4-fluo...)
Show SMILES Fc1ccc(cc1)-c1cncc(CN2CCN(CC2)c2cccc3OCCOc23)c1
Show InChI InChI=1S/C24H24FN3O2/c25-21-6-4-19(5-7-21)20-14-18(15-26-16-20)17-27-8-10-28(11-9-27)22-2-1-3-23-24(22)30-13-12-29-23/h1-7,14-16H,8-13,17H2
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2.30n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Displacement of [3H]OH-DPAT from rat cortex 5HT1A receptor


J Med Chem 50: 865-76 (2007)


Article DOI: 10.1021/jm061180b
BindingDB Entry DOI: 10.7270/Q2ZS309D
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50476117
PNG
(CHEMBL441546)
Show SMILES C(COc1cccc2OCOc12)NCc1cccc(c1)C1=CCCC1 |t:23|
Show InChI InChI=1S/C21H23NO3/c1-2-7-17(6-1)18-8-3-5-16(13-18)14-22-11-12-23-19-9-4-10-20-21(19)25-15-24-20/h3-6,8-10,13,22H,1-2,7,11-12,14-15H2
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2.60n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Displacement of [3H]YM-09151-2 from rat striatum D2 receptor


J Med Chem 50: 865-76 (2007)


Article DOI: 10.1021/jm061180b
BindingDB Entry DOI: 10.7270/Q2ZS309D
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50476121
PNG
(CHEMBL221957)
Show SMILES CC(C)Oc1ccccc1OCCNCc1cccc(c1)C1=CCCCCC1 |t:23|
Show InChI InChI=1S/C25H33NO2/c1-20(2)28-25-15-8-7-14-24(25)27-17-16-26-19-21-10-9-13-23(18-21)22-11-5-3-4-6-12-22/h7-11,13-15,18,20,26H,3-6,12,16-17,19H2,1-2H3
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3.10n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Displacement of [3H]YM-09151-2 from rat striatum D2 receptor


J Med Chem 50: 865-76 (2007)


Article DOI: 10.1021/jm061180b
BindingDB Entry DOI: 10.7270/Q2ZS309D
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM50476737
PNG
(CHEMBL231273)
Show SMILES Fc1ccc(cc1Cl)C(=O)N1CCC(F)(CNCc2ncc(Cl)cn2)CC1
Show InChI InChI=1S/C18H18Cl2F2N4O/c19-13-8-24-16(25-9-13)10-23-11-18(22)3-5-26(6-4-18)17(27)12-1-2-15(21)14(20)7-12/h1-2,7-9,23H,3-6,10-11H2
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3.40n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Binding affinity to 5HT1A receptor in rat cortex membrane


J Med Chem 50: 5024-33 (2007)


Article DOI: 10.1021/jm070714l
BindingDB Entry DOI: 10.7270/Q2HH6NTB
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM50476120
PNG
(CHEMBL221920)
Show SMILES C(COc1cccc2CC3(CC3)Oc12)NCc1cncc(c1)C1=CCCC1 |t:26|
Show InChI InChI=1S/C23H26N2O2/c1-2-5-18(4-1)20-12-17(15-25-16-20)14-24-10-11-26-21-7-3-6-19-13-23(8-9-23)27-22(19)21/h3-4,6-7,12,15-16,24H,1-2,5,8-11,13-14H2
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3.60n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Displacement of [3H]OH-DPAT from rat cortex 5HT1A receptor


J Med Chem 50: 865-76 (2007)


Article DOI: 10.1021/jm061180b
BindingDB Entry DOI: 10.7270/Q2ZS309D
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM50476723
PNG
(CHEMBL230327)
Show SMILES FC(F)c1ccc(CNCC2(F)CCN(CC2)C(=O)c2ccc(F)c(Cl)c2)nc1
Show InChI InChI=1S/C20H20ClF4N3O/c21-16-9-13(2-4-17(16)22)19(29)28-7-5-20(25,6-8-28)12-26-11-15-3-1-14(10-27-15)18(23)24/h1-4,9-10,18,26H,5-8,11-12H2
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3.80n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Binding affinity to 5HT1A receptor in rat cortex membrane


J Med Chem 50: 5024-33 (2007)


Article DOI: 10.1021/jm070714l
BindingDB Entry DOI: 10.7270/Q2HH6NTB
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM248056
PNG
(1-(2,3-dihydro-1,4-benzodioxin-5-yl)-4-[[5-(4-fluo...)
Show SMILES Fc1ccc(cc1)-c1cncc(CN2CCN(CC2)c2cccc3OCCOc23)c1
Show InChI InChI=1S/C24H24FN3O2/c25-21-6-4-19(5-7-21)20-14-18(15-26-16-20)17-27-8-10-28(11-9-27)22-2-1-3-23-24(22)30-13-12-29-23/h1-7,14-16H,8-13,17H2
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4n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Displacement of [3H]YM-09151-2 from rat striatum D2 receptor


J Med Chem 50: 865-76 (2007)


Article DOI: 10.1021/jm061180b
BindingDB Entry DOI: 10.7270/Q2ZS309D
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM21398
PNG
(4-[4-(4-Chloro-phenyl)-4-hydroxy-piperidin-1-yl]-1...)
Show SMILES OC1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C21H23ClFNO2/c22-18-7-5-17(6-8-18)21(26)11-14-24(15-12-21)13-1-2-20(25)16-3-9-19(23)10-4-16/h3-10,26H,1-2,11-15H2
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4.40n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Displacement of [3H]YM-09151-2 from rat striatum D2 receptor


J Med Chem 50: 865-76 (2007)


Article DOI: 10.1021/jm061180b
BindingDB Entry DOI: 10.7270/Q2ZS309D
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM50476720
PNG
(CHEMBL231373)
Show SMILES CNc1ccnc(CNCC2(F)CCN(CC2)C(=O)c2ccc(F)c(Cl)c2)n1
Show InChI InChI=1S/C19H22ClF2N5O/c1-23-16-4-7-25-17(26-16)11-24-12-19(22)5-8-27(9-6-19)18(28)13-2-3-15(21)14(20)10-13/h2-4,7,10,24H,5-6,8-9,11-12H2,1H3,(H,23,25,26)
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4.80n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Binding affinity to 5HT1A receptor in rat cortex membrane


J Med Chem 50: 5024-33 (2007)


Article DOI: 10.1021/jm070714l
BindingDB Entry DOI: 10.7270/Q2HH6NTB
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM50476123
PNG
(CHEMBL221131)
Show SMILES CCC1(C)Cc2cccc(OCCNCc3cccc(c3)C3=CCCC3)c2O1 |t:22|
Show InChI InChI=1S/C25H31NO2/c1-3-25(2)17-22-12-7-13-23(24(22)28-25)27-15-14-26-18-19-8-6-11-21(16-19)20-9-4-5-10-20/h6-9,11-13,16,26H,3-5,10,14-15,17-18H2,1-2H3
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5.5n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Displacement of [3H]OH-DPAT from rat cortex 5HT1A receptor


J Med Chem 50: 865-76 (2007)


Article DOI: 10.1021/jm061180b
BindingDB Entry DOI: 10.7270/Q2ZS309D
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM50476725
PNG
(CHEMBL230961)
Show SMILES Cc1ccc(CNCC2(F)CCN(CC2)C(=O)c2ccc(F)c(Cl)c2)nn1
Show InChI InChI=1S/C19H21ClF2N4O/c1-13-2-4-15(25-24-13)11-23-12-19(22)6-8-26(9-7-19)18(27)14-3-5-17(21)16(20)10-14/h2-5,10,23H,6-9,11-12H2,1H3
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5.60n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Binding affinity to 5HT1A receptor in rat cortex membrane


J Med Chem 50: 5024-33 (2007)


Article DOI: 10.1021/jm070714l
BindingDB Entry DOI: 10.7270/Q2HH6NTB
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM50476132
PNG
(CHEMBL218261)
Show SMILES CC1(C)Cc2cccc(OCCNCc3cccc(c3)C3=CCCC3)c2O1 |t:21|
Show InChI InChI=1S/C24H29NO2/c1-24(2)16-21-11-6-12-22(23(21)27-24)26-14-13-25-17-18-7-5-10-20(15-18)19-8-3-4-9-19/h5-8,10-12,15,25H,3-4,9,13-14,16-17H2,1-2H3
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5.80n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Displacement of [3H]OH-DPAT from rat cortex 5HT1A receptor


J Med Chem 50: 865-76 (2007)


Article DOI: 10.1021/jm061180b
BindingDB Entry DOI: 10.7270/Q2ZS309D
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM50476131
PNG
(CHEMBL218313)
Show SMILES C(COc1cccc2CC3(CC3)Oc12)NCc1cccc(c1)C1=CCCC1 |t:26|
Show InChI InChI=1S/C24H27NO2/c1-2-7-19(6-1)20-8-3-5-18(15-20)17-25-13-14-26-22-10-4-9-21-16-24(11-12-24)27-23(21)22/h3-6,8-10,15,25H,1-2,7,11-14,16-17H2
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6.20n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Displacement of [3H]OH-DPAT from rat cortex 5HT1A receptor


J Med Chem 50: 865-76 (2007)


Article DOI: 10.1021/jm061180b
BindingDB Entry DOI: 10.7270/Q2ZS309D
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM50476739
PNG
(CHEMBL231372)
Show SMILES COc1ccnc(CNCC2(F)CCN(CC2)C(=O)c2ccc(F)c(Cl)c2)n1
Show InChI InChI=1S/C19H21ClF2N4O2/c1-28-17-4-7-24-16(25-17)11-23-12-19(22)5-8-26(9-6-19)18(27)13-2-3-15(21)14(20)10-13/h2-4,7,10,23H,5-6,8-9,11-12H2,1H3
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6.5n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Binding affinity to 5HT1A receptor in rat cortex membrane


J Med Chem 50: 5024-33 (2007)


Article DOI: 10.1021/jm070714l
BindingDB Entry DOI: 10.7270/Q2HH6NTB
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM50476738
PNG
(CHEMBL230425)
Show SMILES OCc1ccc(CNCC2(F)CCN(CC2)C(=O)c2ccc(F)c(Cl)c2)nc1
Show InChI InChI=1S/C20H22ClF2N3O2/c21-17-9-15(2-4-18(17)22)19(28)26-7-5-20(23,6-8-26)13-24-11-16-3-1-14(12-27)10-25-16/h1-4,9-10,24,27H,5-8,11-13H2
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7.40n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Binding affinity to 5HT1A receptor in rat cortex membrane


J Med Chem 50: 5024-33 (2007)


Article DOI: 10.1021/jm070714l
BindingDB Entry DOI: 10.7270/Q2HH6NTB
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM50476126
PNG
(CHEMBL219486)
Show SMILES CC1(C)Oc2cccc(OCCNCc3cccc(c3)C3=CCCC3)c2O1 |t:21|
Show InChI InChI=1S/C23H27NO3/c1-23(2)26-21-12-6-11-20(22(21)27-23)25-14-13-24-16-17-7-5-10-19(15-17)18-8-3-4-9-18/h5-8,10-12,15,24H,3-4,9,13-14,16H2,1-2H3
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9.5n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Displacement of [3H]OH-DPAT from rat cortex 5HT1A receptor


J Med Chem 50: 865-76 (2007)


Article DOI: 10.1021/jm061180b
BindingDB Entry DOI: 10.7270/Q2ZS309D
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50476123
PNG
(CHEMBL221131)
Show SMILES CCC1(C)Cc2cccc(OCCNCc3cccc(c3)C3=CCCC3)c2O1 |t:22|
Show InChI InChI=1S/C25H31NO2/c1-3-25(2)17-22-12-7-13-23(24(22)28-25)27-15-14-26-18-19-8-6-11-21(16-19)20-9-4-5-10-20/h6-9,11-13,16,26H,3-5,10,14-15,17-18H2,1-2H3
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11n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Displacement of [3H]YM-09151-2 from rat striatum D2 receptor


J Med Chem 50: 865-76 (2007)


Article DOI: 10.1021/jm061180b
BindingDB Entry DOI: 10.7270/Q2ZS309D
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM50476735
PNG
(Addyi | BIMT-17 | BIMT-17-BS | Flibanserin)
Show SMILES FC(F)(F)c1cccc(c1)N1CCN(CCn2c3ccccc3[nH]c2=O)CC1
Show InChI InChI=1S/C20H21F3N4O/c21-20(22,23)15-4-3-5-16(14-15)26-11-8-25(9-12-26)10-13-27-18-7-2-1-6-17(18)24-19(27)28/h1-7,14H,8-13H2,(H,24,28)
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12n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Binding affinity to 5HT1A receptor in rat cortex membrane


J Med Chem 50: 5024-33 (2007)


Article DOI: 10.1021/jm070714l
BindingDB Entry DOI: 10.7270/Q2HH6NTB
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM50476118
PNG
(CHEMBL221743)
Show SMILES CC(C)Oc1ccccc1OCCNCc1cccc(c1)C1=CCCCC1 |t:23|
Show InChI InChI=1S/C24H31NO2/c1-19(2)27-24-14-7-6-13-23(24)26-16-15-25-18-20-9-8-12-22(17-20)21-10-4-3-5-11-21/h6-10,12-14,17,19,25H,3-5,11,15-16,18H2,1-2H3
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12n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Displacement of [3H]OH-DPAT from rat cortex 5HT1A receptor


J Med Chem 50: 865-76 (2007)


Article DOI: 10.1021/jm061180b
BindingDB Entry DOI: 10.7270/Q2ZS309D
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM50476130
PNG
(CHEMBL413777)
Show SMILES CC(C)Oc1ccccc1OCCNCc1cccc(c1)C1CCCC1
Show InChI InChI=1S/C23H31NO2/c1-18(2)26-23-13-6-5-12-22(23)25-15-14-24-17-19-8-7-11-21(16-19)20-9-3-4-10-20/h5-8,11-13,16,18,20,24H,3-4,9-10,14-15,17H2,1-2H3
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17n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Displacement of [3H]OH-DPAT from rat cortex 5HT1A receptor


J Med Chem 50: 865-76 (2007)


Article DOI: 10.1021/jm061180b
BindingDB Entry DOI: 10.7270/Q2ZS309D
More data for this
Ligand-Target Pair
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