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25 similar compounds to monomer 50327593

Compile data set for download or QSAR
Wt: 451.5
BDBM50327590
Wt: 437.4
BDBM50327592
Wt: 447.5
BDBM50327597
Wt: 433.5
BDBM50327599
Wt: 419.4
BDBM50327601
Wt: 419.4
BDBM50327603
Wt: 433.5
BDBM50327605
Wt: 419.4
BDBM50327609
Wt: 433.5
BDBM50327615
Wt: 433.5
BDBM50327617
Wt: 451.5
BDBM50327618
Wt: 437.4
BDBM50327619
Wt: 433.5
BDBM50327620
Wt: 437.4
BDBM50327623
Wt: 451.5
BDBM50327627
Displayed 1 to 15 (of 25 total )  |  Next  |  Last  >>

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 63 hits for monomerid = 50327590,50327592,50327597,50327599,50327601,50327603,50327605,50327609,50327615,50327617,50327618,50327619,50327620,50327623,50327627   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (Human))
BDBM50327601
PNG
(6-(3-(4-(8-fluoronaphthalen-1-yl)piperazin-1-yl)pr...)
Show SMILES Fc1cccc2cccc(N3CCN(CCCOc4ccc5CNC(=O)c5c4)CC3)c12
Show InChI InChI=1S/C25H26FN3O2/c26-22-6-1-4-18-5-2-7-23(24(18)22)29-13-11-28(12-14-29)10-3-15-31-20-9-8-19-17-27-25(30)21(19)16-20/h1-2,4-9,16H,3,10-15,17H2,(H,27,30)
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0.0141n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]-8-OH-DPAT from human 5HT1A receptor expressed in HeLa cells


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (Human))
BDBM50327603
PNG
(6-(3-(4-(7-fluoronaphthalen-1-yl)piperazin-1-yl)pr...)
Show SMILES Fc1ccc2cccc(N3CCN(CCCOc4ccc5CNC(=O)c5c4)CC3)c2c1
Show InChI InChI=1S/C25H26FN3O2/c26-20-7-5-18-3-1-4-24(22(18)15-20)29-12-10-28(11-13-29)9-2-14-31-21-8-6-19-17-27-25(30)23(19)16-21/h1,3-8,15-16H,2,9-14,17H2,(H,27,30)
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0.0447n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]-8-OH-DPAT from human 5HT1A receptor expressed in HeLa cells


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (Human))
BDBM50327605
PNG
(6-(4-(4-(8-fluoronaphthalen-1-yl)piperazin-1-yl)bu...)
Show SMILES Fc1cccc2cccc(N3CCN(CCCCOc4ccc5CNC(=O)c5c4)CC3)c12
Show InChI InChI=1S/C26H28FN3O2/c27-23-7-3-5-19-6-4-8-24(25(19)23)30-14-12-29(13-15-30)11-1-2-16-32-21-10-9-20-18-28-26(31)22(20)17-21/h3-10,17H,1-2,11-16,18H2,(H,28,31)
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0.0504n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]-8-OH-DPAT from human 5HT1A receptor expressed in HeLa cells


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (Human))
BDBM50327609
PNG
(7-fluoro-6-(3-(4-(naphthalen-1-yl)piperazin-1-yl)p...)
Show SMILES Fc1c2C(=O)NCc2ccc1OCCCN1CCN(CC1)c1cccc2ccccc12
Show InChI InChI=1S/C25H26FN3O2/c26-24-22(10-9-19-17-27-25(30)23(19)24)31-16-4-11-28-12-14-29(15-13-28)21-8-3-6-18-5-1-2-7-20(18)21/h1-3,5-10H,4,11-17H2,(H,27,30)
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0.128n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Binding affinity to human 5HT1A receptor expressed in HeLa cells by scintillation proximity assay


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (Human))
BDBM50327590
PNG
(7-fluoro-6-(4-(4-(8-fluoronaphthalen-1-yl)piperazi...)
Show SMILES Fc1cccc2cccc(N3CCN(CCCCOc4ccc5CNC(=O)c5c4F)CC3)c12
Show InChI InChI=1S/C26H27F2N3O2/c27-20-7-3-5-18-6-4-8-21(23(18)20)31-14-12-30(13-15-31)11-1-2-16-33-22-10-9-19-17-29-26(32)24(19)25(22)28/h3-10H,1-2,11-17H2,(H,29,32)
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0.568n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Binding affinity to human 5HT2A receptor


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (Human))
BDBM50327615
PNG
(5-fluoro-6-(4-(4-(naphthalen-1-yl)piperazin-1-yl)b...)
Show SMILES Fc1cc2CNC(=O)c2cc1OCCCCN1CCN(CC1)c1cccc2ccccc12
Show InChI InChI=1S/C26H28FN3O2/c27-23-16-20-18-28-26(31)22(20)17-25(23)32-15-4-3-10-29-11-13-30(14-12-29)24-9-5-7-19-6-1-2-8-21(19)24/h1-2,5-9,16-17H,3-4,10-15,18H2,(H,28,31)
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0.637n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Binding affinity to human 5HT1A receptor expressed in HeLa cells by scintillation proximity assay


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (Human))
BDBM50327617
PNG
(6-(4-(4-(7-fluoronaphthalen-1-yl)piperazin-1-yl)bu...)
Show SMILES Fc1ccc2cccc(N3CCN(CCCCOc4ccc5CNC(=O)c5c4)CC3)c2c1
Show InChI InChI=1S/C26H28FN3O2/c27-21-8-6-19-4-3-5-25(23(19)16-21)30-13-11-29(12-14-30)10-1-2-15-32-22-9-7-20-18-28-26(31)24(20)17-22/h3-9,16-17H,1-2,10-15,18H2,(H,28,31)
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0.838n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]-8-OH-DPAT from human 5HT1A receptor expressed in HeLa cells


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50327615
PNG
(5-fluoro-6-(4-(4-(naphthalen-1-yl)piperazin-1-yl)b...)
Show SMILES Fc1cc2CNC(=O)c2cc1OCCCCN1CCN(CC1)c1cccc2ccccc12
Show InChI InChI=1S/C26H28FN3O2/c27-23-16-20-18-28-26(31)22(20)17-25(23)32-15-4-3-10-29-11-13-30(14-12-29)24-9-5-7-19-6-1-2-8-21(19)24/h1-2,5-9,16-17H,3-4,10-15,18H2,(H,28,31)
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0.877n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]-Spiperone from human dopamine D2L receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (Human))
BDBM50327592
PNG
(5-fluoro-6-(3-(4-(6-fluoronaphthalen-1-yl)piperazi...)
Show SMILES Fc1ccc2c(cccc2c1)N1CCN(CCCOc2cc3C(=O)NCc3cc2F)CC1
Show InChI InChI=1S/C25H25F2N3O2/c26-19-5-6-20-17(13-19)3-1-4-23(20)30-10-8-29(9-11-30)7-2-12-32-24-15-21-18(14-22(24)27)16-28-25(21)31/h1,3-6,13-15H,2,7-12,16H2,(H,28,31)
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0.880n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Binding affinity to human 5HT1A receptor expressed in HeLa cells by scintillation proximity assay


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50327618
PNG
(5-fluoro-6-(4-(4-(6-fluoronaphthalen-1-yl)piperazi...)
Show SMILES Fc1ccc2c(cccc2c1)N1CCN(CCCCOc2cc3C(=O)NCc3cc2F)CC1
Show InChI InChI=1S/C26H27F2N3O2/c27-20-6-7-21-18(14-20)4-3-5-24(21)31-11-9-30(10-12-31)8-1-2-13-33-25-16-22-19(15-23(25)28)17-29-26(22)32/h3-7,14-16H,1-2,8-13,17H2,(H,29,32)
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0.891n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]-Spiperone from human dopamine D2L receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (Human))
BDBM50327619
PNG
(7-fluoro-6-(3-(4-(7-fluoronaphthalen-1-yl)piperazi...)
Show SMILES Fc1ccc2cccc(N3CCN(CCCOc4ccc5CNC(=O)c5c4F)CC3)c2c1
Show InChI InChI=1S/C25H25F2N3O2/c26-19-7-5-17-3-1-4-21(20(17)15-19)30-12-10-29(11-13-30)9-2-14-32-22-8-6-18-16-28-25(31)23(18)24(22)27/h1,3-8,15H,2,9-14,16H2,(H,28,31)
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0.904n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Binding affinity to human 5HT2A receptor


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (Human))
BDBM50327605
PNG
(6-(4-(4-(8-fluoronaphthalen-1-yl)piperazin-1-yl)bu...)
Show SMILES Fc1cccc2cccc(N3CCN(CCCCOc4ccc5CNC(=O)c5c4)CC3)c12
Show InChI InChI=1S/C26H28FN3O2/c27-23-7-3-5-19-6-4-8-24(25(19)23)30-14-12-29(13-15-30)11-1-2-16-32-21-10-9-20-18-28-26(31)22(20)17-21/h3-10,17H,1-2,11-16,18H2,(H,28,31)
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0.951n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Binding affinity to human 5HT1A receptor expressed in HeLa cells by scintillation proximity assay


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (Human))
BDBM50327620
PNG
(7-fluoro-6-(4-(4-(naphthalen-1-yl)piperazin-1-yl)b...)
Show SMILES Fc1c2C(=O)NCc2ccc1OCCCCN1CCN(CC1)c1cccc2ccccc12
Show InChI InChI=1S/C26H28FN3O2/c27-25-23(11-10-20-18-28-26(31)24(20)25)32-17-4-3-12-29-13-15-30(16-14-29)22-9-5-7-19-6-1-2-8-21(19)22/h1-2,5-11H,3-4,12-18H2,(H,28,31)
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1.08n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Binding affinity to human 5HT2A receptor


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (Human))
BDBM50327623
PNG
(5-fluoro-6-(3-(4-(8-fluoronaphthalen-1-yl)piperazi...)
Show SMILES Fc1cc2CNC(=O)c2cc1OCCCN1CCN(CC1)c1cccc2cccc(F)c12
Show InChI InChI=1S/C25H25F2N3O2/c26-20-6-1-4-17-5-2-7-22(24(17)20)30-11-9-29(10-12-30)8-3-13-32-23-15-19-18(14-21(23)27)16-28-25(19)31/h1-2,4-7,14-15H,3,8-13,16H2,(H,28,31)
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1.19n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Binding affinity to human 5HT2A receptor


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (Human))
BDBM50327627
PNG
(5-fluoro-6-(4-(4-(7-fluoronaphthalen-1-yl)piperazi...)
Show SMILES Fc1ccc2cccc(N3CCN(CCCCOc4cc5C(=O)NCc5cc4F)CC3)c2c1
Show InChI InChI=1S/C26H27F2N3O2/c27-20-7-6-18-4-3-5-24(21(18)15-20)31-11-9-30(10-12-31)8-1-2-13-33-25-16-22-19(14-23(25)28)17-29-26(22)32/h3-7,14-16H,1-2,8-13,17H2,(H,29,32)
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1.77n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Binding affinity to human 5HT1A receptor expressed in HeLa cells by scintillation proximity assay


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (Human))
BDBM50327605
PNG
(6-(4-(4-(8-fluoronaphthalen-1-yl)piperazin-1-yl)bu...)
Show SMILES Fc1cccc2cccc(N3CCN(CCCCOc4ccc5CNC(=O)c5c4)CC3)c12
Show InChI InChI=1S/C26H28FN3O2/c27-23-7-3-5-19-6-4-8-24(25(19)23)30-14-12-29(13-15-30)11-1-2-16-32-21-10-9-20-18-28-26(31)22(20)17-21/h3-10,17H,1-2,11-16,18H2,(H,28,31)
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1.83n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Binding affinity to human 5HT2A receptor


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50327592
PNG
(5-fluoro-6-(3-(4-(6-fluoronaphthalen-1-yl)piperazi...)
Show SMILES Fc1ccc2c(cccc2c1)N1CCN(CCCOc2cc3C(=O)NCc3cc2F)CC1
Show InChI InChI=1S/C25H25F2N3O2/c26-19-5-6-20-17(13-19)3-1-4-23(20)30-10-8-29(9-11-30)7-2-12-32-24-15-21-18(14-22(24)27)16-28-25(21)31/h1,3-6,13-15H,2,7-12,16H2,(H,28,31)
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1.86n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]-Spiperone from human dopamine D2L receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (Human))
BDBM50327590
PNG
(7-fluoro-6-(4-(4-(8-fluoronaphthalen-1-yl)piperazi...)
Show SMILES Fc1cccc2cccc(N3CCN(CCCCOc4ccc5CNC(=O)c5c4F)CC3)c12
Show InChI InChI=1S/C26H27F2N3O2/c27-20-7-3-5-18-6-4-8-21(23(18)20)31-14-12-30(13-15-31)11-1-2-16-33-22-10-9-19-17-29-26(32)24(19)25(22)28/h3-10H,1-2,11-17H2,(H,29,32)
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2.09n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Binding affinity to human 5HT1A receptor expressed in HeLa cells by scintillation proximity assay


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (Human))
BDBM50327609
PNG
(7-fluoro-6-(3-(4-(naphthalen-1-yl)piperazin-1-yl)p...)
Show SMILES Fc1c2C(=O)NCc2ccc1OCCCN1CCN(CC1)c1cccc2ccccc12
Show InChI InChI=1S/C25H26FN3O2/c26-24-22(10-9-19-17-27-25(30)23(19)24)31-16-4-11-28-12-14-29(15-13-28)21-8-3-6-18-5-1-2-7-20(18)21/h1-3,5-10H,4,11-17H2,(H,27,30)
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2.21n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Binding affinity to human 5HT2A receptor


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50327597
PNG
(6-(4-(4-(8-fluoronaphthalen-1-yl)piperazin-1-yl)bu...)
Show SMILES Cc1cc2CNC(=O)c2cc1OCCCCN1CCN(CC1)c1cccc2cccc(F)c12
Show InChI InChI=1S/C27H30FN3O2/c1-19-16-21-18-29-27(32)22(21)17-25(19)33-15-3-2-10-30-11-13-31(14-12-30)24-9-5-7-20-6-4-8-23(28)26(20)24/h4-9,16-17H,2-3,10-15,18H2,1H3,(H,29,32)
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2.34n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]-Spiperone from human dopamine D2L receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (Human))
BDBM50327618
PNG
(5-fluoro-6-(4-(4-(6-fluoronaphthalen-1-yl)piperazi...)
Show SMILES Fc1ccc2c(cccc2c1)N1CCN(CCCCOc2cc3C(=O)NCc3cc2F)CC1
Show InChI InChI=1S/C26H27F2N3O2/c27-20-6-7-21-18(14-20)4-3-5-24(21)31-11-9-30(10-12-31)8-1-2-13-33-25-16-22-19(15-23(25)28)17-29-26(22)32/h3-7,14-16H,1-2,8-13,17H2,(H,29,32)
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2.71n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Binding affinity to human 5HT1A receptor expressed in HeLa cells by scintillation proximity assay


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50327605
PNG
(6-(4-(4-(8-fluoronaphthalen-1-yl)piperazin-1-yl)bu...)
Show SMILES Fc1cccc2cccc(N3CCN(CCCCOc4ccc5CNC(=O)c5c4)CC3)c12
Show InChI InChI=1S/C26H28FN3O2/c27-23-7-3-5-19-6-4-8-24(25(19)23)30-14-12-29(13-15-30)11-1-2-16-32-21-10-9-20-18-28-26(31)22(20)17-21/h3-10,17H,1-2,11-16,18H2,(H,28,31)
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3.18n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]-Spiperone from human dopamine D2L receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (Human))
BDBM50327603
PNG
(6-(3-(4-(7-fluoronaphthalen-1-yl)piperazin-1-yl)pr...)
Show SMILES Fc1ccc2cccc(N3CCN(CCCOc4ccc5CNC(=O)c5c4)CC3)c2c1
Show InChI InChI=1S/C25H26FN3O2/c26-20-7-5-18-3-1-4-24(22(18)15-20)29-12-10-28(11-13-29)9-2-14-31-21-8-6-19-17-27-25(30)23(19)16-21/h1,3-8,15-16H,2,9-14,17H2,(H,27,30)
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3.37n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Binding affinity to human 5HT2A receptor


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (Human))
BDBM50327597
PNG
(6-(4-(4-(8-fluoronaphthalen-1-yl)piperazin-1-yl)bu...)
Show SMILES Cc1cc2CNC(=O)c2cc1OCCCCN1CCN(CC1)c1cccc2cccc(F)c12
Show InChI InChI=1S/C27H30FN3O2/c1-19-16-21-18-29-27(32)22(21)17-25(19)33-15-3-2-10-30-11-13-31(14-12-30)24-9-5-7-20-6-4-8-23(28)26(20)24/h4-9,16-17H,2-3,10-15,18H2,1H3,(H,29,32)
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3.61n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Binding affinity to human 5HT1A receptor expressed in HeLa cells by scintillation proximity assay


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (Human))
BDBM50327620
PNG
(7-fluoro-6-(4-(4-(naphthalen-1-yl)piperazin-1-yl)b...)
Show SMILES Fc1c2C(=O)NCc2ccc1OCCCCN1CCN(CC1)c1cccc2ccccc12
Show InChI InChI=1S/C26H28FN3O2/c27-25-23(11-10-20-18-28-26(31)24(20)25)32-17-4-3-12-29-13-15-30(16-14-29)22-9-5-7-19-6-1-2-8-21(19)22/h1-2,5-11H,3-4,12-18H2,(H,28,31)
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3.62n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Binding affinity to human 5HT1A receptor expressed in HeLa cells by scintillation proximity assay


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Homo sapiens (Human))
BDBM50327618
PNG
(5-fluoro-6-(4-(4-(6-fluoronaphthalen-1-yl)piperazi...)
Show SMILES Fc1ccc2c(cccc2c1)N1CCN(CCCCOc2cc3C(=O)NCc3cc2F)CC1
Show InChI InChI=1S/C26H27F2N3O2/c27-20-6-7-21-18(14-20)4-3-5-24(21)31-11-9-30(10-12-31)8-1-2-13-33-25-16-22-19(15-23(25)28)17-29-26(22)32/h3-7,14-16H,1-2,8-13,17H2,(H,29,32)
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9.10n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]-citalopram from human serotonin transporter expressed in HEK 293 cells


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Homo sapiens (Human))
BDBM50327592
PNG
(5-fluoro-6-(3-(4-(6-fluoronaphthalen-1-yl)piperazi...)
Show SMILES Fc1ccc2c(cccc2c1)N1CCN(CCCOc2cc3C(=O)NCc3cc2F)CC1
Show InChI InChI=1S/C25H25F2N3O2/c26-19-5-6-20-17(13-19)3-1-4-23(20)30-10-8-29(9-11-30)7-2-12-32-24-15-21-18(14-22(24)27)16-28-25(21)31/h1,3-6,13-15H,2,7-12,16H2,(H,28,31)
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9.22n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]-citalopram from human serotonin transporter expressed in HEK 293 cells by scintillation proximity assay


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (Human))
BDBM50327599
PNG
(6-(4-(4-(6-fluoronaphthalen-1-yl)piperazin-1-yl)bu...)
Show SMILES Fc1ccc2c(cccc2c1)N1CCN(CCCCOc2ccc3CNC(=O)c3c2)CC1
Show InChI InChI=1S/C26H28FN3O2/c27-21-7-9-23-19(16-21)4-3-5-25(23)30-13-11-29(12-14-30)10-1-2-15-32-22-8-6-20-18-28-26(31)24(20)17-22/h3-9,16-17H,1-2,10-15,18H2,(H,28,31)
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9.53n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Binding affinity to human 5HT2A receptor


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50327623
PNG
(5-fluoro-6-(3-(4-(8-fluoronaphthalen-1-yl)piperazi...)
Show SMILES Fc1cc2CNC(=O)c2cc1OCCCN1CCN(CC1)c1cccc2cccc(F)c12
Show InChI InChI=1S/C25H25F2N3O2/c26-20-6-1-4-17-5-2-7-22(24(17)20)30-11-9-29(10-12-30)8-3-13-32-23-15-19-18(14-21(23)27)16-28-25(19)31/h1-2,4-7,14-15H,3,8-13,16H2,(H,28,31)
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9.54n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]-Spiperone from human dopamine D2L receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (Human))
BDBM50327627
PNG
(5-fluoro-6-(4-(4-(7-fluoronaphthalen-1-yl)piperazi...)
Show SMILES Fc1ccc2cccc(N3CCN(CCCCOc4cc5C(=O)NCc5cc4F)CC3)c2c1
Show InChI InChI=1S/C26H27F2N3O2/c27-20-7-6-18-4-3-5-24(21(18)15-20)31-11-9-30(10-12-31)8-1-2-13-33-25-16-22-19(14-23(25)28)17-29-26(22)32/h3-7,14-16H,1-2,8-13,17H2,(H,29,32)
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10n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Binding affinity to human 5HT2A receptor


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50327619
PNG
(7-fluoro-6-(3-(4-(7-fluoronaphthalen-1-yl)piperazi...)
Show SMILES Fc1ccc2cccc(N3CCN(CCCOc4ccc5CNC(=O)c5c4F)CC3)c2c1
Show InChI InChI=1S/C25H25F2N3O2/c26-19-7-5-17-3-1-4-21(20(17)15-19)30-12-10-29(11-13-30)9-2-14-32-22-8-6-18-16-28-25(31)23(18)24(22)27/h1,3-8,15H,2,9-14,16H2,(H,28,31)
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10.3n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]-Spiperone from human dopamine D2L receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50327627
PNG
(5-fluoro-6-(4-(4-(7-fluoronaphthalen-1-yl)piperazi...)
Show SMILES Fc1ccc2cccc(N3CCN(CCCCOc4cc5C(=O)NCc5cc4F)CC3)c2c1
Show InChI InChI=1S/C26H27F2N3O2/c27-20-7-6-18-4-3-5-24(21(18)15-20)31-11-9-30(10-12-31)8-1-2-13-33-25-16-22-19(14-23(25)28)17-29-26(22)32/h3-7,14-16H,1-2,8-13,17H2,(H,29,32)
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11.2n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]-Spiperone from human dopamine D2L receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (Human))
BDBM50327601
PNG
(6-(3-(4-(8-fluoronaphthalen-1-yl)piperazin-1-yl)pr...)
Show SMILES Fc1cccc2cccc(N3CCN(CCCOc4ccc5CNC(=O)c5c4)CC3)c12
Show InChI InChI=1S/C25H26FN3O2/c26-22-6-1-4-18-5-2-7-23(24(18)22)29-13-11-28(12-14-29)10-3-15-31-20-9-8-19-17-27-25(30)21(19)16-20/h1-2,4-9,16H,3,10-15,17H2,(H,27,30)
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11.3n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Binding affinity to human 5HT2A receptor


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (Human))
BDBM50327617
PNG
(6-(4-(4-(7-fluoronaphthalen-1-yl)piperazin-1-yl)bu...)
Show SMILES Fc1ccc2cccc(N3CCN(CCCCOc4ccc5CNC(=O)c5c4)CC3)c2c1
Show InChI InChI=1S/C26H28FN3O2/c27-21-8-6-19-4-3-5-25(23(19)16-21)30-13-11-29(12-14-30)10-1-2-15-32-22-9-7-20-18-28-26(31)24(20)17-22/h3-9,16-17H,1-2,10-15,18H2,(H,28,31)
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11.4n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Binding affinity to human 5HT2A receptor


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Homo sapiens (Human))
BDBM50327618
PNG
(5-fluoro-6-(4-(4-(6-fluoronaphthalen-1-yl)piperazi...)
Show SMILES Fc1ccc2c(cccc2c1)N1CCN(CCCCOc2cc3C(=O)NCc3cc2F)CC1
Show InChI InChI=1S/C26H27F2N3O2/c27-20-6-7-21-18(14-20)4-3-5-24(21)31-11-9-30(10-12-31)8-1-2-13-33-25-16-22-19(15-23(25)28)17-29-26(22)32/h3-7,14-16H,1-2,8-13,17H2,(H,29,32)
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13n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]-citalopram from human serotonin transporter expressed in HEK 293 cells by scintillation proximity assay


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (Human))
BDBM50327615
PNG
(5-fluoro-6-(4-(4-(naphthalen-1-yl)piperazin-1-yl)b...)
Show SMILES Fc1cc2CNC(=O)c2cc1OCCCCN1CCN(CC1)c1cccc2ccccc12
Show InChI InChI=1S/C26H28FN3O2/c27-23-16-20-18-28-26(31)22(20)17-25(23)32-15-4-3-10-29-11-13-30(14-12-29)24-9-5-7-19-6-1-2-8-21(19)24/h1-2,5-9,16-17H,3-4,10-15,18H2,(H,28,31)
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13n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Binding affinity to human 5HT2A receptor


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (Human))
BDBM50327599
PNG
(6-(4-(4-(6-fluoronaphthalen-1-yl)piperazin-1-yl)bu...)
Show SMILES Fc1ccc2c(cccc2c1)N1CCN(CCCCOc2ccc3CNC(=O)c3c2)CC1
Show InChI InChI=1S/C26H28FN3O2/c27-21-7-9-23-19(16-21)4-3-5-25(23)30-13-11-29(12-14-30)10-1-2-15-32-22-8-6-20-18-28-26(31)24(20)17-22/h3-9,16-17H,1-2,10-15,18H2,(H,28,31)
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13.4n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]-8-OH-DPAT from human 5HT1A receptor expressed in HeLa cells


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50327601
PNG
(6-(3-(4-(8-fluoronaphthalen-1-yl)piperazin-1-yl)pr...)
Show SMILES Fc1cccc2cccc(N3CCN(CCCOc4ccc5CNC(=O)c5c4)CC3)c12
Show InChI InChI=1S/C25H26FN3O2/c26-22-6-1-4-18-5-2-7-23(24(18)22)29-13-11-28(12-14-29)10-3-15-31-20-9-8-19-17-27-25(30)21(19)16-20/h1-2,4-9,16H,3,10-15,17H2,(H,27,30)
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13.6n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]-Spiperone from human dopamine D2L receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50327609
PNG
(7-fluoro-6-(3-(4-(naphthalen-1-yl)piperazin-1-yl)p...)
Show SMILES Fc1c2C(=O)NCc2ccc1OCCCN1CCN(CC1)c1cccc2ccccc12
Show InChI InChI=1S/C25H26FN3O2/c26-24-22(10-9-19-17-27-25(30)23(19)24)31-16-4-11-28-12-14-29(15-13-28)21-8-3-6-18-5-1-2-7-20(18)21/h1-3,5-10H,4,11-17H2,(H,27,30)
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13.8n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]-Spiperone from human dopamine D2L receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (Human))
BDBM50327618
PNG
(5-fluoro-6-(4-(4-(6-fluoronaphthalen-1-yl)piperazi...)
Show SMILES Fc1ccc2c(cccc2c1)N1CCN(CCCCOc2cc3C(=O)NCc3cc2F)CC1
Show InChI InChI=1S/C26H27F2N3O2/c27-20-6-7-21-18(14-20)4-3-5-24(21)31-11-9-30(10-12-31)8-1-2-13-33-25-16-22-19(15-23(25)28)17-29-26(22)32/h3-7,14-16H,1-2,8-13,17H2,(H,29,32)
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13.8n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Binding affinity to human 5HT2A receptor


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Homo sapiens (Human))
BDBM50327623
PNG
(5-fluoro-6-(3-(4-(8-fluoronaphthalen-1-yl)piperazi...)
Show SMILES Fc1cc2CNC(=O)c2cc1OCCCN1CCN(CC1)c1cccc2cccc(F)c12
Show InChI InChI=1S/C25H25F2N3O2/c26-20-6-1-4-17-5-2-7-22(24(17)20)30-11-9-29(10-12-30)8-3-13-32-23-15-19-18(14-21(23)27)16-28-25(19)31/h1-2,4-7,14-15H,3,8-13,16H2,(H,28,31)
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15.6n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]-citalopram from human serotonin transporter expressed in HEK 293 cells


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Homo sapiens (Human))
BDBM50327592
PNG
(5-fluoro-6-(3-(4-(6-fluoronaphthalen-1-yl)piperazi...)
Show SMILES Fc1ccc2c(cccc2c1)N1CCN(CCCOc2cc3C(=O)NCc3cc2F)CC1
Show InChI InChI=1S/C25H25F2N3O2/c26-19-5-6-20-17(13-19)3-1-4-23(20)30-10-8-29(9-11-30)7-2-12-32-24-15-21-18(14-22(24)27)16-28-25(21)31/h1,3-6,13-15H,2,7-12,16H2,(H,28,31)
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22.2n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]-citalopram from human serotonin transporter expressed in HEK 293 cells


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50327620
PNG
(7-fluoro-6-(4-(4-(naphthalen-1-yl)piperazin-1-yl)b...)
Show SMILES Fc1c2C(=O)NCc2ccc1OCCCCN1CCN(CC1)c1cccc2ccccc12
Show InChI InChI=1S/C26H28FN3O2/c27-25-23(11-10-20-18-28-26(31)24(20)25)32-17-4-3-12-29-13-15-30(16-14-29)22-9-5-7-19-6-1-2-8-21(19)22/h1-2,5-11H,3-4,12-18H2,(H,28,31)
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22.3n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]-Spiperone from human dopamine D2L receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Homo sapiens (Human))
BDBM50327605
PNG
(6-(4-(4-(8-fluoronaphthalen-1-yl)piperazin-1-yl)bu...)
Show SMILES Fc1cccc2cccc(N3CCN(CCCCOc4ccc5CNC(=O)c5c4)CC3)c12
Show InChI InChI=1S/C26H28FN3O2/c27-23-7-3-5-19-6-4-8-24(25(19)23)30-14-12-29(13-15-30)11-1-2-16-32-21-10-9-20-18-28-26(31)22(20)17-21/h3-10,17H,1-2,11-16,18H2,(H,28,31)
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26n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]-citalopram from human serotonin transporter expressed in HEK 293 cells


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50327603
PNG
(6-(3-(4-(7-fluoronaphthalen-1-yl)piperazin-1-yl)pr...)
Show SMILES Fc1ccc2cccc(N3CCN(CCCOc4ccc5CNC(=O)c5c4)CC3)c2c1
Show InChI InChI=1S/C25H26FN3O2/c26-20-7-5-18-3-1-4-24(22(18)15-20)29-12-10-28(11-13-29)9-2-14-31-21-8-6-19-17-27-25(30)23(19)16-21/h1,3-8,15-16H,2,9-14,17H2,(H,27,30)
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27.8n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]-Spiperone from human dopamine D2L receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Homo sapiens (Human))
BDBM50327615
PNG
(5-fluoro-6-(4-(4-(naphthalen-1-yl)piperazin-1-yl)b...)
Show SMILES Fc1cc2CNC(=O)c2cc1OCCCCN1CCN(CC1)c1cccc2ccccc12
Show InChI InChI=1S/C26H28FN3O2/c27-23-16-20-18-28-26(31)22(20)17-25(23)32-15-4-3-10-29-11-13-30(14-12-29)24-9-5-7-19-6-1-2-8-21(19)24/h1-2,5-9,16-17H,3-4,10-15,18H2,(H,28,31)
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30.8n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]-citalopram from human serotonin transporter expressed in HEK 293 cells


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50327617
PNG
(6-(4-(4-(7-fluoronaphthalen-1-yl)piperazin-1-yl)bu...)
Show SMILES Fc1ccc2cccc(N3CCN(CCCCOc4ccc5CNC(=O)c5c4)CC3)c2c1
Show InChI InChI=1S/C26H28FN3O2/c27-21-8-6-19-4-3-5-25(23(19)16-21)30-13-11-29(12-14-30)10-1-2-15-32-22-9-7-20-18-28-26(31)24(20)17-22/h3-9,16-17H,1-2,10-15,18H2,(H,28,31)
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33.8n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]-Spiperone from human dopamine D2L receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50327590
PNG
(7-fluoro-6-(4-(4-(8-fluoronaphthalen-1-yl)piperazi...)
Show SMILES Fc1cccc2cccc(N3CCN(CCCCOc4ccc5CNC(=O)c5c4F)CC3)c12
Show InChI InChI=1S/C26H27F2N3O2/c27-20-7-3-5-18-6-4-8-21(23(18)20)31-14-12-30(13-15-31)11-1-2-16-33-22-10-9-19-17-29-26(32)24(19)25(22)28/h3-10H,1-2,11-17H2,(H,29,32)
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35.2n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]-Spiperone from human dopamine D2L receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (Human))
BDBM50327592
PNG
(5-fluoro-6-(3-(4-(6-fluoronaphthalen-1-yl)piperazi...)
Show SMILES Fc1ccc2c(cccc2c1)N1CCN(CCCOc2cc3C(=O)NCc3cc2F)CC1
Show InChI InChI=1S/C25H25F2N3O2/c26-19-5-6-20-17(13-19)3-1-4-23(20)30-10-8-29(9-11-30)7-2-12-32-24-15-21-18(14-22(24)27)16-28-25(21)31/h1,3-6,13-15H,2,7-12,16H2,(H,28,31)
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38.5n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Binding affinity to human 5HT2A receptor


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Homo sapiens (Human))
BDBM50327590
PNG
(7-fluoro-6-(4-(4-(8-fluoronaphthalen-1-yl)piperazi...)
Show SMILES Fc1cccc2cccc(N3CCN(CCCCOc4ccc5CNC(=O)c5c4F)CC3)c12
Show InChI InChI=1S/C26H27F2N3O2/c27-20-7-3-5-18-6-4-8-21(23(18)20)31-14-12-30(13-15-31)11-1-2-16-33-22-10-9-19-17-29-26(32)24(19)25(22)28/h3-10H,1-2,11-17H2,(H,29,32)
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48.1n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]-citalopram from human serotonin transporter expressed in HEK 293 cells by scintillation proximity assay


Bioorg Med Chem Lett 20: 5666-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.023
BindingDB Entry DOI: 10.7270/Q2HH6K9S
More data for this
Ligand-Target Pair
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