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Compile Data Set for Download or QSAR

Found 122 hits Enz. Inhib. hit(s) with all data for entry = 50040757   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))
BDBM50399614
PNG
(CHEMBL2181170)
Show SMILES CCCN1CCC(COc2nc3c(F)cccc3c3ncccc23)CC1
Show InChI InChI=1S/C21H24FN3O/c1-2-11-25-12-8-15(9-13-25)14-26-21-17-6-4-10-23-19(17)16-5-3-7-18(22)20(16)24-21/h3-7,10,15H,2,8-9,11-14H2,1H3
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0.0398n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Displacement of radioligand from human 5HT4R by Cerep protocol based assay


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))
BDBM50399614
PNG
(CHEMBL2181170)
Show SMILES CCCN1CCC(COc2nc3c(F)cccc3c3ncccc23)CC1
Show InChI InChI=1S/C21H24FN3O/c1-2-11-25-12-8-15(9-13-25)14-26-21-17-6-4-10-23-19(17)16-5-3-7-18(22)20(16)24-21/h3-7,10,15H,2,8-9,11-14H2,1H3
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0.0400n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Displacement of radioligand from human 5HT4R by Cerep protocol based assay


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))
BDBM50399621
PNG
(CHEMBL2181166)
Show SMILES Fc1cccc2c1nc(OCC1CCN(CCCc3ccc(I)cc3)CC1)c1cccnc21
Show InChI InChI=1S/C27H27FIN3O/c28-24-7-1-5-22-25-23(6-2-14-30-25)27(31-26(22)24)33-18-20-12-16-32(17-13-20)15-3-4-19-8-10-21(29)11-9-19/h1-2,5-11,14,20H,3-4,12-13,15-18H2
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0.230n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Displacement of radioligand from human 5HT4R by Cerep protocol based assay


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))
BDBM50399622
PNG
(CHEMBL2181168)
Show SMILES CCCN1CCC(COc2nc3c(I)cccc3c3ncccc23)CC1
Show InChI InChI=1S/C21H24IN3O/c1-2-11-25-12-8-15(9-13-25)14-26-21-17-6-4-10-23-19(17)16-5-3-7-18(22)20(16)24-21/h3-7,10,15H,2,8-9,11-14H2,1H3
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0.260n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Displacement of radioligand from human 5HT4R by Cerep protocol based assay


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))
BDBM50399623
PNG
(CHEMBL2181169)
Show SMILES CCCN1CCC(COc2nc3c(I)cccc3c3ccccc23)CC1
Show InChI InChI=1S/C22H25IN2O/c1-2-12-25-13-10-16(11-14-25)15-26-22-19-7-4-3-6-17(19)18-8-5-9-20(23)21(18)24-22/h3-9,16H,2,10-15H2,1H3
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1.20n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Displacement of radioligand from human 5HT4R by Cerep protocol based assay


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(GUINEA PIG)
BDBM50399614
PNG
(CHEMBL2181170)
Show SMILES CCCN1CCC(COc2nc3c(F)cccc3c3ncccc23)CC1
Show InChI InChI=1S/C21H24FN3O/c1-2-11-25-12-8-15(9-13-25)14-26-21-17-6-4-10-23-19(17)16-5-3-7-18(22)20(16)24-21/h3-7,10,15H,2,8-9,11-14H2,1H3
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2.20n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Displacement of [3H]GR113808 from 5HT4R in guinea pig striatal membranes


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(GUINEA PIG)
BDBM50399621
PNG
(CHEMBL2181166)
Show SMILES Fc1cccc2c1nc(OCC1CCN(CCCc3ccc(I)cc3)CC1)c1cccnc21
Show InChI InChI=1S/C27H27FIN3O/c28-24-7-1-5-22-25-23(6-2-14-30-25)27(31-26(22)24)33-18-20-12-16-32(17-13-20)15-3-4-19-8-10-21(29)11-9-19/h1-2,5-11,14,20H,3-4,12-13,15-18H2
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2.5n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Displacement of [3H]GR113808 from 5HT4R in guinea pig striatal membranes


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))
BDBM50399619
PNG
(CHEMBL2181189)
Show SMILES CCCN1CCC(COc2nc3c(F)cccc3c3ccccc23)CC1
Show InChI InChI=1S/C22H25FN2O/c1-2-12-25-13-10-16(11-14-25)15-26-22-19-7-4-3-6-17(19)18-8-5-9-20(23)21(18)24-22/h3-9,16H,2,10-15H2,1H3
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3.10n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Displacement of [3H]GR113808 from human recombinant 5HT4R expressed in HEK293T cells


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(GUINEA PIG)
BDBM50399622
PNG
(CHEMBL2181168)
Show SMILES CCCN1CCC(COc2nc3c(I)cccc3c3ncccc23)CC1
Show InChI InChI=1S/C21H24IN3O/c1-2-11-25-12-8-15(9-13-25)14-26-21-17-6-4-10-23-19(17)16-5-3-7-18(22)20(16)24-21/h3-7,10,15H,2,8-9,11-14H2,1H3
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4.60n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Displacement of [3H]GR113808 from 5HT4R in guinea pig striatal membranes


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))
BDBM50399616
PNG
(CHEMBL2181188)
Show SMILES CCCN1CCC(COc2nc3c(Cl)cccc3c3ccccc23)CC1
Show InChI InChI=1S/C22H25ClN2O/c1-2-12-25-13-10-16(11-14-25)15-26-22-19-7-4-3-6-17(19)18-8-5-9-20(23)21(18)24-22/h3-9,16H,2,10-15H2,1H3
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5n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Displacement of [3H]GR113808 from human recombinant 5HT4R expressed in HEK293T cells


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))
BDBM50399615
PNG
(CHEMBL2181171)
Show SMILES CCCN1CCC(COc2nc3ccccc3c3ncccc23)CC1
Show InChI InChI=1S/C21H25N3O/c1-2-12-24-13-9-16(10-14-24)15-25-21-18-7-5-11-22-20(18)17-6-3-4-8-19(17)23-21/h3-8,11,16H,2,9-10,12-15H2,1H3
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7.5n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Displacement of [3H]GR113808 from human recombinant 5HT4R expressed in HEK293T cells


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(GUINEA PIG)
BDBM50399615
PNG
(CHEMBL2181171)
Show SMILES CCCN1CCC(COc2nc3ccccc3c3ncccc23)CC1
Show InChI InChI=1S/C21H25N3O/c1-2-12-24-13-9-16(10-14-24)15-25-21-18-7-5-11-22-20(18)17-6-3-4-8-19(17)23-21/h3-8,11,16H,2,9-10,12-15H2,1H3
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13.1n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Displacement of [3H]GR113808 from 5HT4R in guinea pig striatal membranes


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(GUINEA PIG)
BDBM50399623
PNG
(CHEMBL2181169)
Show SMILES CCCN1CCC(COc2nc3c(I)cccc3c3ccccc23)CC1
Show InChI InChI=1S/C22H25IN2O/c1-2-12-25-13-10-16(11-14-25)15-26-22-19-7-4-3-6-17(19)18-8-5-9-20(23)21(18)24-22/h3-9,16H,2,10-15H2,1H3
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13.5n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Displacement of [3H]GR113808 from 5HT4R in guinea pig striatal membranes


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))
BDBM50399620
PNG
(CHEMBL2181187)
Show SMILES CCCN1CCC(COc2nc3c(OC)cccc3c3ccccc23)CC1
Show InChI InChI=1S/C23H28N2O2/c1-3-13-25-14-11-17(12-15-25)16-27-23-20-8-5-4-7-18(20)19-9-6-10-21(26-2)22(19)24-23/h4-10,17H,3,11-16H2,1-2H3
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17n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Displacement of [3H]GR113808 from human recombinant 5HT4R expressed in HEK293T cells


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(GUINEA PIG)
BDBM50399619
PNG
(CHEMBL2181189)
Show SMILES CCCN1CCC(COc2nc3c(F)cccc3c3ccccc23)CC1
Show InChI InChI=1S/C22H25FN2O/c1-2-12-25-13-10-16(11-14-25)15-26-22-19-7-4-3-6-17(19)18-8-5-9-20(23)21(18)24-22/h3-9,16H,2,10-15H2,1H3
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20.1n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Displacement of [3H]GR113808 from 5HT4R in guinea pig striatal membranes


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(GUINEA PIG)
BDBM50399633
PNG
(CHEMBL2181190)
Show SMILES CCCN1CCC(COc2nc3ccccc3c3cccc(F)c23)CC1
Show InChI InChI=1S/C22H25FN2O/c1-2-12-25-13-10-16(11-14-25)15-26-22-21-18(7-5-8-19(21)23)17-6-3-4-9-20(17)24-22/h3-9,16H,2,10-15H2,1H3
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21.6n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Displacement of [3H]GR113808 from 5HT4R in guinea pig striatal membranes


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(GUINEA PIG)
BDBM50399616
PNG
(CHEMBL2181188)
Show SMILES CCCN1CCC(COc2nc3c(Cl)cccc3c3ccccc23)CC1
Show InChI InChI=1S/C22H25ClN2O/c1-2-12-25-13-10-16(11-14-25)15-26-22-19-7-4-3-6-17(19)18-8-5-9-20(23)21(18)24-22/h3-9,16H,2,10-15H2,1H3
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21.9n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Displacement of [3H]GR113808 from 5HT4R in guinea pig striatal membranes


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(GUINEA PIG)
BDBM50399617
PNG
(CHEMBL2181172)
Show SMILES CCCN1CCC(COc2nc3ccccc3c3cnccc23)CC1
Show InChI InChI=1S/C21H25N3O/c1-2-11-24-12-8-16(9-13-24)15-25-21-18-7-10-22-14-19(18)17-5-3-4-6-20(17)23-21/h3-7,10,14,16H,2,8-9,11-13,15H2,1H3
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22.8n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Displacement of [3H]GR113808 from 5HT4R in guinea pig striatal membranes


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50399620
PNG
(CHEMBL2181187)
Show SMILES CCCN1CCC(COc2nc3c(OC)cccc3c3ccccc23)CC1
Show InChI InChI=1S/C23H28N2O2/c1-3-13-25-14-11-17(12-15-25)16-27-23-20-8-5-4-7-18(20)19-9-6-10-21(26-2)22(19)24-23/h4-10,17H,3,11-16H2,1-2H3
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29.3n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Binding affinity to human 5HT2B by Cerep protocol based assay


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))
BDBM50399618
PNG
(CHEMBL2181185)
Show SMILES CCCN1CCC(COc2nc3cc(F)ccc3c3ccccc23)CC1
Show InChI InChI=1S/C22H25FN2O/c1-2-11-25-12-9-16(10-13-25)15-26-22-20-6-4-3-5-18(20)19-8-7-17(23)14-21(19)24-22/h3-8,14,16H,2,9-13,15H2,1H3
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33n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Displacement of [3H]GR113808 from human recombinant 5HT4R expressed in HEK293T cells


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(GUINEA PIG)
BDBM50399620
PNG
(CHEMBL2181187)
Show SMILES CCCN1CCC(COc2nc3c(OC)cccc3c3ccccc23)CC1
Show InChI InChI=1S/C23H28N2O2/c1-3-13-25-14-11-17(12-15-25)16-27-23-20-8-5-4-7-18(20)19-9-6-10-21(26-2)22(19)24-23/h4-10,17H,3,11-16H2,1-2H3
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35n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Displacement of [3H]GR113808 from 5HT4R in guinea pig striatal membranes


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50399619
PNG
(CHEMBL2181189)
Show SMILES CCCN1CCC(COc2nc3c(F)cccc3c3ccccc23)CC1
Show InChI InChI=1S/C22H25FN2O/c1-2-12-25-13-10-16(11-14-25)15-26-22-19-7-4-3-6-17(19)18-8-5-9-20(23)21(18)24-22/h3-9,16H,2,10-15H2,1H3
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40.4n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Binding affinity to human 5HT2B by Cerep protocol based assay


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(GUINEA PIG)
BDBM50399632
PNG
(CHEMBL2177145)
Show SMILES CCCN1CCC(COc2nc3ccccc3c3ccccc23)CC1
Show InChI InChI=1S/C22H26N2O/c1-2-13-24-14-11-17(12-15-24)16-25-22-20-9-4-3-7-18(20)19-8-5-6-10-21(19)23-22/h3-10,17H,2,11-16H2,1H3
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51.5n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Displacement of [3H]GR113808 from 5HT4R in guinea pig striatal membranes


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50399616
PNG
(CHEMBL2181188)
Show SMILES CCCN1CCC(COc2nc3c(Cl)cccc3c3ccccc23)CC1
Show InChI InChI=1S/C22H25ClN2O/c1-2-12-25-13-10-16(11-14-25)15-26-22-19-7-4-3-6-17(19)18-8-5-9-20(23)21(18)24-22/h3-9,16H,2,10-15H2,1H3
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98n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Binding affinity to human 5HT2B by Cerep protocol based assay


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(GUINEA PIG)
BDBM50399631
PNG
(CHEMBL2181186)
Show SMILES CCCN1CCC(COc2nc3c(C)cccc3c3ccccc23)CC1
Show InChI InChI=1S/C23H28N2O/c1-3-13-25-14-11-18(12-15-25)16-26-23-21-9-5-4-8-19(21)20-10-6-7-17(2)22(20)24-23/h4-10,18H,3,11-16H2,1-2H3
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100n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Displacement of [3H]GR113808 from 5HT4R in guinea pig striatal membranes


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(GUINEA PIG)
BDBM50399618
PNG
(CHEMBL2181185)
Show SMILES CCCN1CCC(COc2nc3cc(F)ccc3c3ccccc23)CC1
Show InChI InChI=1S/C22H25FN2O/c1-2-11-25-12-9-16(10-13-25)15-26-22-20-6-4-3-5-18(20)19-8-7-17(23)14-21(19)24-22/h3-8,14,16H,2,9-13,15H2,1H3
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101n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Displacement of [3H]GR113808 from 5HT4R in guinea pig striatal membranes


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(GUINEA PIG)
BDBM50399630
PNG
(CHEMBL2181167)
Show SMILES Ic1ccc(CCCN2CCC(COc3nc4ccccc4c4ccccc34)CC2)cc1
Show InChI InChI=1S/C28H29IN2O/c29-23-13-11-21(12-14-23)6-5-17-31-18-15-22(16-19-31)20-32-28-26-9-2-1-7-24(26)25-8-3-4-10-27(25)30-28/h1-4,7-14,22H,5-6,15-20H2
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115n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Displacement of [3H]GR113808 from 5HT4R in guinea pig striatal membranes


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50399614
PNG
(CHEMBL2181170)
Show SMILES CCCN1CCC(COc2nc3c(F)cccc3c3ncccc23)CC1
Show InChI InChI=1S/C21H24FN3O/c1-2-11-25-12-8-15(9-13-25)14-26-21-17-6-4-10-23-19(17)16-5-3-7-18(22)20(16)24-21/h3-7,10,15H,2,8-9,11-14H2,1H3
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136n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Binding affinity to human 5HT2B by Cerep protocol based assay


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Homo sapiens (Human))
BDBM50399621
PNG
(CHEMBL2181166)
Show SMILES Fc1cccc2c1nc(OCC1CCN(CCCc3ccc(I)cc3)CC1)c1cccnc21
Show InChI InChI=1S/C27H27FIN3O/c28-24-7-1-5-22-25-23(6-2-14-30-25)27(31-26(22)24)33-18-20-12-16-32(17-13-20)15-3-4-19-8-10-21(29)11-9-19/h1-2,5-11,14,20H,3-4,12-13,15-18H2
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150n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Binding affinity to human 5HT7 by Cerep protocol based assay


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Homo sapiens (Human))
BDBM50399623
PNG
(CHEMBL2181169)
Show SMILES CCCN1CCC(COc2nc3c(I)cccc3c3ccccc23)CC1
Show InChI InChI=1S/C22H25IN2O/c1-2-12-25-13-10-16(11-14-25)15-26-22-19-7-4-3-6-17(19)18-8-5-9-20(23)21(18)24-22/h3-9,16H,2,10-15H2,1H3
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153n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Binding affinity to human 5HT7 by Cerep protocol based assay


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(GUINEA PIG)
BDBM50399629
PNG
(CHEMBL2181175)
Show SMILES CCCN1CCC(COc2nc3ccccc3c3ccc(F)cc23)CC1
Show InChI InChI=1S/C22H25FN2O/c1-2-11-25-12-9-16(10-13-25)15-26-22-20-14-17(23)7-8-18(20)19-5-3-4-6-21(19)24-22/h3-8,14,16H,2,9-13,15H2,1H3
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154n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Displacement of [3H]GR113808 from 5HT4R in guinea pig striatal membranes


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50399623
PNG
(CHEMBL2181169)
Show SMILES CCCN1CCC(COc2nc3c(I)cccc3c3ccccc23)CC1
Show InChI InChI=1S/C22H25IN2O/c1-2-12-25-13-10-16(11-14-25)15-26-22-19-7-4-3-6-17(19)18-8-5-9-20(23)21(18)24-22/h3-9,16H,2,10-15H2,1H3
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162n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Binding affinity to human 5HT2B by Cerep protocol based assay


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(GUINEA PIG)
BDBM50399628
PNG
(CHEMBL2181173)
Show SMILES CCCN1CCC(COc2nc3ccccc3c3cc(F)ccc23)CC1
Show InChI InChI=1S/C22H25FN2O/c1-2-11-25-12-9-16(10-13-25)15-26-22-19-8-7-17(23)14-20(19)18-5-3-4-6-21(18)24-22/h3-8,14,16H,2,9-13,15H2,1H3
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209n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Displacement of [3H]GR113808 from 5HT4R in guinea pig striatal membranes


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(GUINEA PIG)
BDBM50399627
PNG
(CHEMBL2181181)
Show SMILES CCCN1CCC(COc2nc3ccc(OC)cc3c3ccccc23)CC1
Show InChI InChI=1S/C23H28N2O2/c1-3-12-25-13-10-17(11-14-25)16-27-23-20-7-5-4-6-19(20)21-15-18(26-2)8-9-22(21)24-23/h4-9,15,17H,3,10-14,16H2,1-2H3
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233n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Displacement of [3H]GR113808 from 5HT4R in guinea pig striatal membranes


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(GUINEA PIG)
BDBM50399626
PNG
(CHEMBL2181180)
Show SMILES CCCN1CCC(COc2nc3ccc(C)cc3c3ccccc23)CC1
Show InChI InChI=1S/C23H28N2O/c1-3-12-25-13-10-18(11-14-25)16-26-23-20-7-5-4-6-19(20)21-15-17(2)8-9-22(21)24-23/h4-9,15,18H,3,10-14,16H2,1-2H3
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246n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Displacement of [3H]GR113808 from 5HT4R in guinea pig striatal membranes


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50399621
PNG
(CHEMBL2181166)
Show SMILES Fc1cccc2c1nc(OCC1CCN(CCCc3ccc(I)cc3)CC1)c1cccnc21
Show InChI InChI=1S/C27H27FIN3O/c28-24-7-1-5-22-25-23(6-2-14-30-25)27(31-26(22)24)33-18-20-12-16-32(17-13-20)15-3-4-19-8-10-21(29)11-9-19/h1-2,5-11,14,20H,3-4,12-13,15-18H2
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340n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Binding affinity to human 5HT2B by Cerep protocol based assay


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2C


(Homo sapiens (Human))
BDBM50399622
PNG
(CHEMBL2181168)
Show SMILES CCCN1CCC(COc2nc3c(I)cccc3c3ncccc23)CC1
Show InChI InChI=1S/C21H24IN3O/c1-2-11-25-12-8-15(9-13-25)14-26-21-17-6-4-10-23-19(17)16-5-3-7-18(22)20(16)24-21/h3-7,10,15H,2,8-9,11-14H2,1H3
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341n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Binding affinity to human 5HT2C by Cerep protocol based assay


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Homo sapiens (Human))
BDBM50399619
PNG
(CHEMBL2181189)
Show SMILES CCCN1CCC(COc2nc3c(F)cccc3c3ccccc23)CC1
Show InChI InChI=1S/C22H25FN2O/c1-2-12-25-13-10-16(11-14-25)15-26-22-19-7-4-3-6-17(19)18-8-5-9-20(23)21(18)24-22/h3-9,16H,2,10-15H2,1H3
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384n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Binding affinity to human 5HT7 by Cerep protocol based assay


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2C


(Homo sapiens (Human))
BDBM50399621
PNG
(CHEMBL2181166)
Show SMILES Fc1cccc2c1nc(OCC1CCN(CCCc3ccc(I)cc3)CC1)c1cccnc21
Show InChI InChI=1S/C27H27FIN3O/c28-24-7-1-5-22-25-23(6-2-14-30-25)27(31-26(22)24)33-18-20-12-16-32(17-13-20)15-3-4-19-8-10-21(29)11-9-19/h1-2,5-11,14,20H,3-4,12-13,15-18H2
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400n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Binding affinity to human 5HT2C by Cerep protocol based assay


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))
BDBM50399617
PNG
(CHEMBL2181172)
Show SMILES CCCN1CCC(COc2nc3ccccc3c3cnccc23)CC1
Show InChI InChI=1S/C21H25N3O/c1-2-11-24-12-8-16(9-13-24)15-25-21-18-7-10-22-14-19(18)17-5-3-4-6-20(17)23-21/h3-7,10,14,16H,2,8-9,11-13,15H2,1H3
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403n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Displacement of [3H]GR113808 from human recombinant 5HT4R expressed in HEK293T cells


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A


(Homo sapiens (Human))
BDBM50399621
PNG
(CHEMBL2181166)
Show SMILES Fc1cccc2c1nc(OCC1CCN(CCCc3ccc(I)cc3)CC1)c1cccnc21
Show InChI InChI=1S/C27H27FIN3O/c28-24-7-1-5-22-25-23(6-2-14-30-25)27(31-26(22)24)33-18-20-12-16-32(17-13-20)15-3-4-19-8-10-21(29)11-9-19/h1-2,5-11,14,20H,3-4,12-13,15-18H2
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410n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Binding affinity to human 5HT3 by Cerep protocol based assay


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2C


(Homo sapiens (Human))
BDBM50399614
PNG
(CHEMBL2181170)
Show SMILES CCCN1CCC(COc2nc3c(F)cccc3c3ncccc23)CC1
Show InChI InChI=1S/C21H24FN3O/c1-2-11-25-12-8-15(9-13-25)14-26-21-17-6-4-10-23-19(17)16-5-3-7-18(22)20(16)24-21/h3-7,10,15H,2,8-9,11-14H2,1H3
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492n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Binding affinity to human 5HT2C by Cerep protocol based assay


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50399615
PNG
(CHEMBL2181171)
Show SMILES CCCN1CCC(COc2nc3ccccc3c3ncccc23)CC1
Show InChI InChI=1S/C21H25N3O/c1-2-12-24-13-9-16(10-14-24)15-25-21-18-7-5-11-22-20(18)17-6-3-4-8-19(17)23-21/h3-8,11,16H,2,9-10,12-15H2,1H3
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627n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Binding affinity to human 5HT2B by Cerep protocol based assay


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A


(Homo sapiens (Human))
BDBM50399614
PNG
(CHEMBL2181170)
Show SMILES CCCN1CCC(COc2nc3c(F)cccc3c3ncccc23)CC1
Show InChI InChI=1S/C21H24FN3O/c1-2-11-25-12-8-15(9-13-25)14-26-21-17-6-4-10-23-19(17)16-5-3-7-18(22)20(16)24-21/h3-7,10,15H,2,8-9,11-14H2,1H3
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641n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Binding affinity to human 5HT3 by Cerep protocol based assay


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A


(Homo sapiens (Human))
BDBM50399615
PNG
(CHEMBL2181171)
Show SMILES CCCN1CCC(COc2nc3ccccc3c3ncccc23)CC1
Show InChI InChI=1S/C21H25N3O/c1-2-12-24-13-9-16(10-14-24)15-25-21-18-7-5-11-22-20(18)17-6-3-4-8-19(17)23-21/h3-8,11,16H,2,9-10,12-15H2,1H3
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680n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Binding affinity to human 5HT3 by Cerep protocol based assay


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50399621
PNG
(CHEMBL2181166)
Show SMILES Fc1cccc2c1nc(OCC1CCN(CCCc3ccc(I)cc3)CC1)c1cccnc21
Show InChI InChI=1S/C27H27FIN3O/c28-24-7-1-5-22-25-23(6-2-14-30-25)27(31-26(22)24)33-18-20-12-16-32(17-13-20)15-3-4-19-8-10-21(29)11-9-19/h1-2,5-11,14,20H,3-4,12-13,15-18H2
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680n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Binding affinity to human 5HT1A by Cerep protocol based assay


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(GUINEA PIG)
BDBM50399625
PNG
(CHEMBL2181184)
Show SMILES CCCN1CCC(COc2nc3cc(C)ccc3c3ccccc23)CC1
Show InChI InChI=1S/C23H28N2O/c1-3-12-25-13-10-18(11-14-25)16-26-23-21-7-5-4-6-19(21)20-9-8-17(2)15-22(20)24-23/h4-9,15,18H,3,10-14,16H2,1-2H3
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691n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Displacement of [3H]GR113808 from 5HT4R in guinea pig striatal membranes


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A


(Homo sapiens (Human))
BDBM50399619
PNG
(CHEMBL2181189)
Show SMILES CCCN1CCC(COc2nc3c(F)cccc3c3ccccc23)CC1
Show InChI InChI=1S/C22H25FN2O/c1-2-12-25-13-10-16(11-14-25)15-26-22-19-7-4-3-6-17(19)18-8-5-9-20(23)21(18)24-22/h3-9,16H,2,10-15H2,1H3
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710n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Binding affinity to human 5HT3 by Cerep protocol based assay


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2C


(Homo sapiens (Human))
BDBM50399616
PNG
(CHEMBL2181188)
Show SMILES CCCN1CCC(COc2nc3c(Cl)cccc3c3ccccc23)CC1
Show InChI InChI=1S/C22H25ClN2O/c1-2-12-25-13-10-16(11-14-25)15-26-22-19-7-4-3-6-17(19)18-8-5-9-20(23)21(18)24-22/h3-9,16H,2,10-15H2,1H3
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729n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Binding affinity to human 5HT2C by Cerep protocol based assay


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2C


(Homo sapiens (Human))
BDBM50399623
PNG
(CHEMBL2181169)
Show SMILES CCCN1CCC(COc2nc3c(I)cccc3c3ccccc23)CC1
Show InChI InChI=1S/C22H25IN2O/c1-2-12-25-13-10-16(11-14-25)15-26-22-19-7-4-3-6-17(19)18-8-5-9-20(23)21(18)24-22/h3-9,16H,2,10-15H2,1H3
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772n/an/an/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Binding affinity to human 5HT2C by Cerep protocol based assay


J Med Chem 55: 9693-707 (2012)


Article DOI: 10.1021/jm300943r
BindingDB Entry DOI: 10.7270/Q2ZC8417
More data for this
Ligand-Target Pair
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