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13 similar compounds to monomer 50103837

Compile data set for download or QSAR
Wt: 401.4
BDBM50103826
Wt: 410.4
BDBM50103828
Wt: 403.4
BDBM50103833
Wt: 391.4
BDBM50103835
Wt: 399.4
BDBM50103836
Wt: 399.4
BDBM50103838
Wt: 404.4
BDBM50103839
Wt: 386.4
BDBM50103843
Wt: 419.9
BDBM50103845
Wt: 404.4
BDBM50103846
Wt: 410.4
BDBM50103847
Wt: 415.4
BDBM50103848
Wt: 385.4
BDBM50241119
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 39 hits for monomerid = 50103826,50103828,50103833,50103835,50103836,50103838,50103839,50103843,50103845,50103846,50103847,50103848,50241119   
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
D(2) dopamine receptor


(Homo sapiens (Human))
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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PubMed
0.0400n/an/an/an/an/an/an/an/a



NeuroSearch Sweden AB

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human dopamine D2 receptor at high affinity state expressed in HEK293 cells


J Med Chem 53: 2510-20 (2010)


Article DOI: 10.1021/jm901689v
BindingDB Entry DOI: 10.7270/Q2NG4RKK
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
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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0.100n/an/an/an/an/an/an/an/a



NeuroSearch Sweden AB

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human dopamine D2 receptor at low affinity state expressed in HEK293 cells


J Med Chem 53: 2510-20 (2010)


Article DOI: 10.1021/jm901689v
BindingDB Entry DOI: 10.7270/Q2NG4RKK
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50103826
PNG
(7-[4-(6-Hydroxy-biphenyl-3-ylmethyl)-piperazin-1-y...)
Show SMILES Oc1ccc(CN2CCN(CC2)c2cccc3[nH]c(=O)oc23)cc1-c1ccccc1
Show InChI InChI=1S/C24H23N3O3/c28-22-10-9-17(15-19(22)18-5-2-1-3-6-18)16-26-11-13-27(14-12-26)21-8-4-7-20-23(21)30-24(29)25-20/h1-10,15,28H,11-14,16H2,(H,25,29)
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0.410n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Binding affinity for dopamine receptor D2 determined using [3H]-spiperone


Bioorg Med Chem Lett 11: 2345-9 (2001)


Article DOI: 10.1016/s0960-894x(01)00425-5
BindingDB Entry DOI: 10.7270/Q2RR1XH9
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50103839
PNG
(7-{4-[4-(4-Fluoro-phenyl)-pyridin-2-ylmethyl]-pipe...)
Show SMILES Fc1ccc(cc1)-c1ccnc(CN2CCN(CC2)c2cccc3[nH]c(=O)oc23)c1
Show InChI InChI=1S/C23H21FN4O2/c24-18-6-4-16(5-7-18)17-8-9-25-19(14-17)15-27-10-12-28(13-11-27)21-3-1-2-20-22(21)30-23(29)26-20/h1-9,14H,10-13,15H2,(H,26,29)
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0.470n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Binding affinity for dopamine receptor D2 determined using [3H]-spiperone


Bioorg Med Chem Lett 11: 2345-9 (2001)


Article DOI: 10.1016/s0960-894x(01)00425-5
BindingDB Entry DOI: 10.7270/Q2RR1XH9
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
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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0.600n/an/an/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Displacement of [3H]raclopride from human D2 dopamine receptor expressed in CHO cell membranes


Bioorg Med Chem Lett 23: 543-7 (2012)


Article DOI: 10.1016/j.bmcl.2012.11.023
BindingDB Entry DOI: 10.7270/Q2639R2X
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50103835
PNG
(7-[4-(3-Thiophen-3-yl-benzyl)-piperazin-1-yl]-3H-b...)
Show SMILES O=c1[nH]c2cccc(N3CCN(Cc4cccc(c4)-c4ccsc4)CC3)c2o1
Show InChI InChI=1S/C22H21N3O2S/c26-22-23-19-5-2-6-20(21(19)27-22)25-10-8-24(9-11-25)14-16-3-1-4-17(13-16)18-7-12-28-15-18/h1-7,12-13,15H,8-11,14H2,(H,23,26)
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1.30n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Binding affinity for dopamine receptor D2 determined using [3H]-spiperone


Bioorg Med Chem Lett 11: 2345-9 (2001)


Article DOI: 10.1016/s0960-894x(01)00425-5
BindingDB Entry DOI: 10.7270/Q2RR1XH9
More data for this
Ligand-Target Pair
Dopamine D2 receptor and Serotonin 2a receptor (D2 and 5HT2a)


(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)

More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50103843
PNG
(7-[4-(5-Phenyl-pyridin-3-ylmethyl)-piperazin-1-yl]...)
Show SMILES O=c1[nH]c2cccc(N3CCN(Cc4cncc(c4)-c4ccccc4)CC3)c2o1
Show InChI InChI=1S/C23H22N4O2/c28-23-25-20-7-4-8-21(22(20)29-23)27-11-9-26(10-12-27)16-17-13-19(15-24-14-17)18-5-2-1-3-6-18/h1-8,13-15H,9-12,16H2,(H,25,28)
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1.80n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Binding affinity for dopamine receptor D2 determined using [3H]-spiperone


Bioorg Med Chem Lett 11: 2345-9 (2001)


Article DOI: 10.1016/s0960-894x(01)00425-5
BindingDB Entry DOI: 10.7270/Q2RR1XH9
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50103847
PNG
(3'-[4-(2-Oxo-2,3-dihydro-benzooxazol-7-yl)-piperaz...)
Show SMILES O=c1[nH]c2cccc(N3CCN(Cc4cccc(c4)-c4ccccc4C#N)CC3)c2o1
Show InChI InChI=1S/C25H22N4O2/c26-16-20-6-1-2-8-21(20)19-7-3-5-18(15-19)17-28-11-13-29(14-12-28)23-10-4-9-22-24(23)31-25(30)27-22/h1-10,15H,11-14,17H2,(H,27,30)
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2n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Binding affinity for dopamine receptor D2 determined using [3H]-spiperone


Bioorg Med Chem Lett 11: 2345-9 (2001)


Article DOI: 10.1016/s0960-894x(01)00425-5
BindingDB Entry DOI: 10.7270/Q2RR1XH9
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
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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2.20n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Binding affinity for dopamine receptor D2 determined using [3H]-spiperone


Bioorg Med Chem Lett 11: 2345-9 (2001)


Article DOI: 10.1016/s0960-894x(01)00425-5
BindingDB Entry DOI: 10.7270/Q2RR1XH9
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
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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2.20n/an/an/an/an/an/an/an/a



Universidade Federal do Rio Grande do Sul

Curated by ChEMBL


Assay Description
Agonist activity at dopamine D2 receptor


Bioorg Med Chem 18: 1925-35 (2010)


Article DOI: 10.1016/j.bmc.2010.01.040
BindingDB Entry DOI: 10.7270/Q2S75H99
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
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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2.30n/an/an/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Displacement of [3H]nemonapride from dopamine D2L receptor (unknown origin) expressed in African green monkey COS7 cells


J Med Chem 57: 5823-8 (2014)


Article DOI: 10.1021/jm5003759
BindingDB Entry DOI: 10.7270/Q2D79D04
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50103846
PNG
(7-{4-[2-(4-Fluoro-phenyl)-pyridin-4-ylmethyl]-pipe...)
Show SMILES Fc1ccc(cc1)-c1cc(CN2CCN(CC2)c2cccc3[nH]c(=O)oc23)ccn1
Show InChI InChI=1S/C23H21FN4O2/c24-18-6-4-17(5-7-18)20-14-16(8-9-25-20)15-27-10-12-28(13-11-27)21-3-1-2-19-22(21)30-23(29)26-19/h1-9,14H,10-13,15H2,(H,26,29)
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2.90n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Binding affinity for dopamine receptor D2 determined using [3H]-spiperone


Bioorg Med Chem Lett 11: 2345-9 (2001)


Article DOI: 10.1016/s0960-894x(01)00425-5
BindingDB Entry DOI: 10.7270/Q2RR1XH9
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50103828
PNG
(3'-[4-(2-Oxo-2,3-dihydro-benzooxazol-7-yl)-piperaz...)
Show SMILES O=c1[nH]c2cccc(N3CCN(Cc4cccc(c4)-c4cccc(c4)C#N)CC3)c2o1
Show InChI InChI=1S/C25H22N4O2/c26-16-18-4-1-6-20(14-18)21-7-2-5-19(15-21)17-28-10-12-29(13-11-28)23-9-3-8-22-24(23)31-25(30)27-22/h1-9,14-15H,10-13,17H2,(H,27,30)
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6n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Binding affinity for dopamine receptor D2 determined using [3H]-spiperone


Bioorg Med Chem Lett 11: 2345-9 (2001)


Article DOI: 10.1016/s0960-894x(01)00425-5
BindingDB Entry DOI: 10.7270/Q2RR1XH9
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
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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7.19 -11.5n/an/an/an/an/a7.437



King Fahd University of Petroleum & Minerals



Assay Description
Human-cloned 5-HT1A serotonin receptors stably expressed in HEK293-EBNA cells (Perkin-Elmer, Waltham, MA) were radiolabeled with 1.0nM [3H]-8-OH-DPAT...


J Enzyme Inhib Med Chem 29: 281-91 (2014)


Article DOI: 10.3109/14756366.2013.776556
BindingDB Entry DOI: 10.7270/Q2SN07WV
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50103826
PNG
(7-[4-(6-Hydroxy-biphenyl-3-ylmethyl)-piperazin-1-y...)
Show SMILES Oc1ccc(CN2CCN(CC2)c2cccc3[nH]c(=O)oc23)cc1-c1ccccc1
Show InChI InChI=1S/C24H23N3O3/c28-22-10-9-17(15-19(22)18-5-2-1-3-6-18)16-26-11-13-27(14-12-26)21-8-4-7-20-23(21)30-24(29)25-20/h1-10,15,28H,11-14,16H2,(H,25,29)
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7.60n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Binding affinity for 5-hydroxytryptamine 1A receptor determined using [3H]-8-OH-DPAT as radioligand


Bioorg Med Chem Lett 11: 2345-9 (2001)


Article DOI: 10.1016/s0960-894x(01)00425-5
BindingDB Entry DOI: 10.7270/Q2RR1XH9
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50103843
PNG
(7-[4-(5-Phenyl-pyridin-3-ylmethyl)-piperazin-1-yl]...)
Show SMILES O=c1[nH]c2cccc(N3CCN(Cc4cncc(c4)-c4ccccc4)CC3)c2o1
Show InChI InChI=1S/C23H22N4O2/c28-23-25-20-7-4-8-21(22(20)29-23)27-11-9-26(10-12-27)16-17-13-19(15-24-14-17)18-5-2-1-3-6-18/h1-8,13-15H,9-12,16H2,(H,25,28)
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7.80n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Binding affinity for 5-hydroxytryptamine 1A receptor determined using [3H]-8-OH-DPAT as radioligand


Bioorg Med Chem Lett 11: 2345-9 (2001)


Article DOI: 10.1016/s0960-894x(01)00425-5
BindingDB Entry DOI: 10.7270/Q2RR1XH9
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50103833
PNG
(7-[4-(4'-Fluoro-biphenyl-3-ylmethyl)-piperazin-1-y...)
Show SMILES Fc1ccc(cc1)-c1cccc(CN2CCN(CC2)c2cccc3[nH]c(=O)oc23)c1
Show InChI InChI=1S/C24H22FN3O2/c25-20-9-7-18(8-10-20)19-4-1-3-17(15-19)16-27-11-13-28(14-12-27)22-6-2-5-21-23(22)30-24(29)26-21/h1-10,15H,11-14,16H2,(H,26,29)
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8.10n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Binding affinity for dopamine receptor D2 determined using [3H]-spiperone


Bioorg Med Chem Lett 11: 2345-9 (2001)


Article DOI: 10.1016/s0960-894x(01)00425-5
BindingDB Entry DOI: 10.7270/Q2RR1XH9
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
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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PubMed
8.81 -11.0n/an/an/an/an/a7.425



King Fahd University of Petroleum & Minerals



Assay Description
Human-cloned dopamine D2L receptors stably expressed in C6 rat glioma cells (kindly donated by Professor Roberto Maggio, Università di L'Aquil...


J Enzyme Inhib Med Chem 29: 281-91 (2014)


Article DOI: 10.3109/14756366.2013.776556
BindingDB Entry DOI: 10.7270/Q2SN07WV
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
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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9.30n/an/an/an/an/an/an/an/a



Universidade Federal do Rio Grande do Sul

Curated by ChEMBL


Assay Description
Agonist activity at 5HT1A receptor


Bioorg Med Chem 18: 1925-35 (2010)


Article DOI: 10.1016/j.bmc.2010.01.040
BindingDB Entry DOI: 10.7270/Q2S75H99
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
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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9.30n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Binding affinity for 5-hydroxytryptamine 1A receptor determined using [3H]-8-OH-DPAT as radioligand


Bioorg Med Chem Lett 11: 2345-9 (2001)


Article DOI: 10.1016/s0960-894x(01)00425-5
BindingDB Entry DOI: 10.7270/Q2RR1XH9
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50103838
PNG
(7-[4-(3'-Methyl-biphenyl-3-ylmethyl)-piperazin-1-y...)
Show SMILES Cc1cccc(c1)-c1cccc(CN2CCN(CC2)c2cccc3[nH]c(=O)oc23)c1
Show InChI InChI=1S/C25H25N3O2/c1-18-5-2-7-20(15-18)21-8-3-6-19(16-21)17-27-11-13-28(14-12-27)23-10-4-9-22-24(23)30-25(29)26-22/h2-10,15-16H,11-14,17H2,1H3,(H,26,29)
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9.30n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Binding affinity for dopamine receptor D2 determined using [3H]-spiperone


Bioorg Med Chem Lett 11: 2345-9 (2001)


Article DOI: 10.1016/s0960-894x(01)00425-5
BindingDB Entry DOI: 10.7270/Q2RR1XH9
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50103848
PNG
(7-[4-(3'-Methoxy-biphenyl-3-ylmethyl)-piperazin-1-...)
Show SMILES COc1cccc(c1)-c1cccc(CN2CCN(CC2)c2cccc3[nH]c(=O)oc23)c1
Show InChI InChI=1S/C25H25N3O3/c1-30-21-8-3-7-20(16-21)19-6-2-5-18(15-19)17-27-11-13-28(14-12-27)23-10-4-9-22-24(23)31-25(29)26-22/h2-10,15-16H,11-14,17H2,1H3,(H,26,29)
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10n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Binding affinity for dopamine receptor D2 determined using [3H]-spiperone


Bioorg Med Chem Lett 11: 2345-9 (2001)


Article DOI: 10.1016/s0960-894x(01)00425-5
BindingDB Entry DOI: 10.7270/Q2RR1XH9
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50103836
PNG
(7-(4-Biphenyl-3-ylmethyl-piperazin-1-yl)-3-methyl-...)
Show SMILES Cn1c2cccc(N3CCN(Cc4cccc(c4)-c4ccccc4)CC3)c2oc1=O
Show InChI InChI=1S/C25H25N3O2/c1-26-22-11-6-12-23(24(22)30-25(26)29)28-15-13-27(14-16-28)18-19-7-5-10-21(17-19)20-8-3-2-4-9-20/h2-12,17H,13-16,18H2,1H3
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10n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Binding affinity for dopamine receptor D2 determined using [3H]-spiperone


Bioorg Med Chem Lett 11: 2345-9 (2001)


Article DOI: 10.1016/s0960-894x(01)00425-5
BindingDB Entry DOI: 10.7270/Q2RR1XH9
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50103833
PNG
(7-[4-(4'-Fluoro-biphenyl-3-ylmethyl)-piperazin-1-y...)
Show SMILES Fc1ccc(cc1)-c1cccc(CN2CCN(CC2)c2cccc3[nH]c(=O)oc23)c1
Show InChI InChI=1S/C24H22FN3O2/c25-20-9-7-18(8-10-20)19-4-1-3-17(15-19)16-27-11-13-28(14-12-27)22-6-2-5-21-23(22)30-24(29)26-21/h1-10,15H,11-14,16H2,(H,26,29)
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14n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Binding affinity for 5-hydroxytryptamine 1A receptor determined using [3H]-8-OH-DPAT as radioligand


Bioorg Med Chem Lett 11: 2345-9 (2001)


Article DOI: 10.1016/s0960-894x(01)00425-5
BindingDB Entry DOI: 10.7270/Q2RR1XH9
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50103839
PNG
(7-{4-[4-(4-Fluoro-phenyl)-pyridin-2-ylmethyl]-pipe...)
Show SMILES Fc1ccc(cc1)-c1ccnc(CN2CCN(CC2)c2cccc3[nH]c(=O)oc23)c1
Show InChI InChI=1S/C23H21FN4O2/c24-18-6-4-16(5-7-18)17-8-9-25-19(14-17)15-27-10-12-28(13-11-27)21-3-1-2-20-22(21)30-23(29)26-20/h1-9,14H,10-13,15H2,(H,26,29)
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16n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Binding affinity for 5-hydroxytryptamine 1A receptor determined using [3H]-8-OH-DPAT as radioligand


Bioorg Med Chem Lett 11: 2345-9 (2001)


Article DOI: 10.1016/s0960-894x(01)00425-5
BindingDB Entry DOI: 10.7270/Q2RR1XH9
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50103835
PNG
(7-[4-(3-Thiophen-3-yl-benzyl)-piperazin-1-yl]-3H-b...)
Show SMILES O=c1[nH]c2cccc(N3CCN(Cc4cccc(c4)-c4ccsc4)CC3)c2o1
Show InChI InChI=1S/C22H21N3O2S/c26-22-23-19-5-2-6-20(21(19)27-22)25-10-8-24(9-11-25)14-16-3-1-4-17(13-16)18-7-12-28-15-18/h1-7,12-13,15H,8-11,14H2,(H,23,26)
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17n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Binding affinity for 5-hydroxytryptamine 1A receptor determined using [3H]-8-OH-DPAT as radioligand


Bioorg Med Chem Lett 11: 2345-9 (2001)


Article DOI: 10.1016/s0960-894x(01)00425-5
BindingDB Entry DOI: 10.7270/Q2RR1XH9
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50103845
PNG
(7-[4-(3'-Chloro-biphenyl-3-ylmethyl)-piperazin-1-y...)
Show SMILES Clc1cccc(c1)-c1cccc(CN2CCN(CC2)c2cccc3[nH]c(=O)oc23)c1
Show InChI InChI=1S/C24H22ClN3O2/c25-20-7-2-6-19(15-20)18-5-1-4-17(14-18)16-27-10-12-28(13-11-27)22-9-3-8-21-23(22)30-24(29)26-21/h1-9,14-15H,10-13,16H2,(H,26,29)
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18n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Binding affinity for dopamine receptor D2 determined using [3H]-spiperone


Bioorg Med Chem Lett 11: 2345-9 (2001)


Article DOI: 10.1016/s0960-894x(01)00425-5
BindingDB Entry DOI: 10.7270/Q2RR1XH9
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50103846
PNG
(7-{4-[2-(4-Fluoro-phenyl)-pyridin-4-ylmethyl]-pipe...)
Show SMILES Fc1ccc(cc1)-c1cc(CN2CCN(CC2)c2cccc3[nH]c(=O)oc23)ccn1
Show InChI InChI=1S/C23H21FN4O2/c24-18-6-4-17(5-7-18)20-14-16(8-9-25-20)15-27-10-12-28(13-11-27)21-3-1-2-19-22(21)30-23(29)26-19/h1-9,14H,10-13,15H2,(H,26,29)
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21n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Binding affinity for 5-hydroxytryptamine 1A receptor determined using [3H]-8-OH-DPAT as radioligand


Bioorg Med Chem Lett 11: 2345-9 (2001)


Article DOI: 10.1016/s0960-894x(01)00425-5
BindingDB Entry DOI: 10.7270/Q2RR1XH9
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50103848
PNG
(7-[4-(3'-Methoxy-biphenyl-3-ylmethyl)-piperazin-1-...)
Show SMILES COc1cccc(c1)-c1cccc(CN2CCN(CC2)c2cccc3[nH]c(=O)oc23)c1
Show InChI InChI=1S/C25H25N3O3/c1-30-21-8-3-7-20(16-21)19-6-2-5-18(15-19)17-27-11-13-28(14-12-27)23-10-4-9-22-24(23)31-25(29)26-22/h2-10,15-16H,11-14,17H2,1H3,(H,26,29)
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21n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Binding affinity for 5-hydroxytryptamine 1A receptor determined using [3H]-8-OH-DPAT as radioligand


Bioorg Med Chem Lett 11: 2345-9 (2001)


Article DOI: 10.1016/s0960-894x(01)00425-5
BindingDB Entry DOI: 10.7270/Q2RR1XH9
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50103828
PNG
(3'-[4-(2-Oxo-2,3-dihydro-benzooxazol-7-yl)-piperaz...)
Show SMILES O=c1[nH]c2cccc(N3CCN(Cc4cccc(c4)-c4cccc(c4)C#N)CC3)c2o1
Show InChI InChI=1S/C25H22N4O2/c26-16-18-4-1-6-20(14-18)21-7-2-5-19(15-21)17-28-10-12-29(13-11-28)23-9-3-8-22-24(23)31-25(30)27-22/h1-9,14-15H,10-13,17H2,(H,27,30)
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23n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Binding affinity for 5-hydroxytryptamine 1A receptor determined using [3H]-8-OH-DPAT as radioligand


Bioorg Med Chem Lett 11: 2345-9 (2001)


Article DOI: 10.1016/s0960-894x(01)00425-5
BindingDB Entry DOI: 10.7270/Q2RR1XH9
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50103847
PNG
(3'-[4-(2-Oxo-2,3-dihydro-benzooxazol-7-yl)-piperaz...)
Show SMILES O=c1[nH]c2cccc(N3CCN(Cc4cccc(c4)-c4ccccc4C#N)CC3)c2o1
Show InChI InChI=1S/C25H22N4O2/c26-16-20-6-1-2-8-21(20)19-7-3-5-18(15-19)17-28-11-13-29(14-12-28)23-10-4-9-22-24(23)31-25(30)27-22/h1-10,15H,11-14,17H2,(H,27,30)
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32n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Binding affinity for 5-hydroxytryptamine 1A receptor determined using [3H]-8-OH-DPAT as radioligand


Bioorg Med Chem Lett 11: 2345-9 (2001)


Article DOI: 10.1016/s0960-894x(01)00425-5
BindingDB Entry DOI: 10.7270/Q2RR1XH9
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50103838
PNG
(7-[4-(3'-Methyl-biphenyl-3-ylmethyl)-piperazin-1-y...)
Show SMILES Cc1cccc(c1)-c1cccc(CN2CCN(CC2)c2cccc3[nH]c(=O)oc23)c1
Show InChI InChI=1S/C25H25N3O2/c1-18-5-2-7-20(15-18)21-8-3-6-19(16-21)17-27-11-13-28(14-12-27)23-10-4-9-22-24(23)30-25(29)26-22/h2-10,15-16H,11-14,17H2,1H3,(H,26,29)
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35n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Binding affinity for 5-hydroxytryptamine 1A receptor determined using [3H]-8-OH-DPAT as radioligand


Bioorg Med Chem Lett 11: 2345-9 (2001)


Article DOI: 10.1016/s0960-894x(01)00425-5
BindingDB Entry DOI: 10.7270/Q2RR1XH9
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50103845
PNG
(7-[4-(3'-Chloro-biphenyl-3-ylmethyl)-piperazin-1-y...)
Show SMILES Clc1cccc(c1)-c1cccc(CN2CCN(CC2)c2cccc3[nH]c(=O)oc23)c1
Show InChI InChI=1S/C24H22ClN3O2/c25-20-7-2-6-19(15-20)18-5-1-4-17(14-18)16-27-10-12-28(13-11-27)22-9-3-8-21-23(22)30-24(29)26-21/h1-9,14-15H,10-13,16H2,(H,26,29)
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42n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Binding affinity for 5-hydroxytryptamine 1A receptor determined using [3H]-8-OH-DPAT as radioligand


Bioorg Med Chem Lett 11: 2345-9 (2001)


Article DOI: 10.1016/s0960-894x(01)00425-5
BindingDB Entry DOI: 10.7270/Q2RR1XH9
More data for this
Ligand-Target Pair
Serotonin 1 (5-HT1) 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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65n/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)

More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50103836
PNG
(7-(4-Biphenyl-3-ylmethyl-piperazin-1-yl)-3-methyl-...)
Show SMILES Cn1c2cccc(N3CCN(Cc4cccc(c4)-c4ccccc4)CC3)c2oc1=O
Show InChI InChI=1S/C25H25N3O2/c1-26-22-11-6-12-23(24(22)30-25(26)29)28-15-13-27(14-16-28)18-19-7-5-10-21(17-19)20-8-3-2-4-9-20/h2-12,17H,13-16,18H2,1H3
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130n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Binding affinity for 5-hydroxytryptamine 1A receptor determined using [3H]-8-OH-DPAT as radioligand


Bioorg Med Chem Lett 11: 2345-9 (2001)


Article DOI: 10.1016/s0960-894x(01)00425-5
BindingDB Entry DOI: 10.7270/Q2RR1XH9
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(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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PubMed
3.31E+3n/an/an/an/an/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


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


J Med Chem 50: 865-76 (2007)

More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
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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PubMed
n/an/an/an/a 324n/an/an/an/a



Pierre Fabre Research Center

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT1A receptor in HeLa cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 865-76 (2007)

More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
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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Article
PubMed
n/an/a 2.90n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Antagonist activity at human D2 dopamine receptor expressed in CHO cell membrane by GTPgammaS-binding assay


Bioorg Med Chem Lett 23: 543-7 (2012)


Article DOI: 10.1016/j.bmcl.2012.11.023
BindingDB Entry DOI: 10.7270/Q2639R2X
More data for this
Ligand-Target Pair