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Compile Data Set for Download or QSAR

Found 60 hits with Last Name = 'abdel-rahman' and Initial = 'aa'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM50014407
PNG
(2-(piperazin-1-yl)quinoline | 2-Piperazin-1-yl-qui...)
Show SMILES C1CN(CCN1)c1ccc2ccccc2n1
Show InChI InChI=1S/C13H15N3/c1-2-4-12-11(3-1)5-6-13(15-12)16-9-7-14-8-10-16/h1-6,14H,7-10H2
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2n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM50053631
PNG
(2-(4-Methyl-piperazin-1-yl)-quinoline | 2-(4-methy...)
Show SMILES CN1CCN(CC1)c1ccc2ccccc2n1
Show InChI InChI=1S/C14H17N3/c1-16-8-10-17(11-9-16)14-7-6-12-4-2-3-5-13(12)15-14/h2-7H,8-11H2,1H3
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3n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM50053617
PNG
(2-naphthyl biguanide | CHEMBL43078 | N-2-naphthyli...)
Show SMILES NC(=N)N=C(N)Nc1ccc2ccccc2c1 |w:3.2|
Show InChI InChI=1S/C12H13N5/c13-11(14)17-12(15)16-10-6-5-8-3-1-2-4-9(8)7-10/h1-7H,(H6,13,14,15,16,17)
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12n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM50027021
PNG
(1-(6-Chloro-pyridin-2-yl)-piperazine | CHEMBL45773)
Show SMILES Clc1cccc(n1)N1CCNCC1
Show InChI InChI=1S/C9H12ClN3/c10-8-2-1-3-9(12-8)13-6-4-11-5-7-13/h1-3,11H,4-7H2
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15n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM50053615
PNG
(3-Chloro-Phenyl biguanide | CHEMBL13790 | N-(3-chl...)
Show SMILES NC(=N)N=C(N)Nc1cccc(Cl)c1 |w:3.2|
Show InChI InChI=1S/C8H10ClN5/c9-5-2-1-3-6(4-5)13-8(12)14-7(10)11/h1-4H,(H6,10,11,12,13,14)
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17n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM50053604
PNG
(CHEMBL40567 | N-2-naphthylguanidine | N-Naphthalen...)
Show SMILES [#7]\[#6](-[#7])=[#7]\c1ccc2ccccc2c1
Show InChI InChI=1S/C11H11N3/c12-11(13)14-10-6-5-8-3-1-2-4-9(8)7-10/h1-7H,(H4,12,13,14)
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25n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM50007411
PNG
(1-Naphthalen-2-yl-piperazine | CHEMBL278509)
Show SMILES C1CN(CCN1)c1ccc2ccccc2c1
Show InChI InChI=1S/C14H16N2/c1-2-4-13-11-14(6-5-12(13)3-1)16-9-7-15-8-10-16/h1-6,11,15H,7-10H2
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32n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM50053608
PNG
(1N-amino(immino)methyl-3-chloroaniline | CHEMBL138...)
Show SMILES [#7]\[#6](-[#7])=[#7]\c1cccc(Cl)c1
Show InChI InChI=1S/C7H8ClN3/c8-5-2-1-3-6(4-5)11-7(9)10/h1-4H,(H4,9,10,11)
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35n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM50053611
PNG
(1-(6-Chloro-pyridin-2-yl)-4-methyl-piperazine | CH...)
Show SMILES CN1CCN(CC1)c1cccc(Cl)n1
Show InChI InChI=1S/C10H14ClN3/c1-13-5-7-14(8-6-13)10-4-2-3-9(11)12-10/h2-4H,5-8H2,1H3
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38n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM50053622
PNG
(CHEMBL43798 | N-[2-(3-Chloro-phenyl)-ethyl]-guanid...)
Show SMILES NC(=N)NCCc1cccc(Cl)c1
Show InChI InChI=1S/C9H12ClN3/c10-8-3-1-2-7(6-8)4-5-13-9(11)12/h1-3,6H,4-5H2,(H4,11,12,13)
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40n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM50022718
PNG
(1-(5-Chloro-2-methoxy-phenyl)-piperazine | CHEMBL6...)
Show SMILES COc1ccc(Cl)cc1N1CCNCC1
Show InChI InChI=1S/C11H15ClN2O/c1-15-11-3-2-9(12)8-10(11)14-6-4-13-5-7-14/h2-3,8,13H,4-7H2,1H3
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40n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM50053606
PNG
(1-(6-Iodo-pyridin-2-yl)-4-methyl-piperazine | CHEM...)
Show SMILES CN1CCN(CC1)c1cccc(I)n1
Show InChI InChI=1S/C10H14IN3/c1-13-5-7-14(8-6-13)10-4-2-3-9(11)12-10/h2-4H,5-8H2,1H3
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48n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM50053629
PNG
(2-Chloro-Phenyl biguanide | CHEMBL42752 | N-(2-chl...)
Show SMILES NC(=N)N=C(N)Nc1ccccc1Cl |w:3.2|
Show InChI InChI=1S/C8H10ClN5/c9-5-3-1-2-4-6(5)13-8(12)14-7(10)11/h1-4H,(H6,10,11,12,13,14)
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62n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM50001915
PNG
(1-(3-chlorophenyl)piperazine | CHEMBL478 | m-Chlor...)
Show SMILES Clc1cccc(c1)N1CCNCC1
Show InChI InChI=1S/C10H13ClN2/c11-9-2-1-3-10(8-9)13-6-4-12-5-7-13/h1-3,8,12H,4-7H2
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62n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM50053613
PNG
(2-Methoxy-5-Chloro-Phenyl biguanide | CHEMBL335877)
Show SMILES COc1ccc(Cl)cc1NC(N)=NC(N)=N |w:12.13|
Show InChI InChI=1S/C9H12ClN5O/c1-16-7-3-2-5(10)4-6(7)14-9(13)15-8(11)12/h2-4H,1H3,(H6,11,12,13,14,15)
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126n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM50053594
PNG
(CHEMBL131053 | N-[2-(2-Chloro-phenyl)-ethyl]-guani...)
Show SMILES NC(=N)NCCc1ccccc1Cl
Show InChI InChI=1S/C9H12ClN3/c10-8-4-2-1-3-7(8)5-6-13-9(11)12/h1-4H,5-6H2,(H4,11,12,13)
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150n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM50007407
PNG
(1-NP | 1-Naphthalen-1-yl-piperazine | 4-Naphthalen...)
Show SMILES C1CN(CCN1)c1cccc2ccccc12
Show InChI InChI=1S/C14H16N2/c1-2-6-13-12(4-1)5-3-7-14(13)16-10-8-15-9-11-16/h1-7,15H,8-11H2
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175n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM50053633
PNG
(1N-amino(immino)methyl-2-chloroaniline | CHEMBL418...)
Show SMILES [#7]\[#6](-[#7])=[#7]\c1ccccc1Cl
Show InChI InChI=1S/C7H8ClN3/c8-5-3-1-2-4-6(5)11-7(9)10/h1-4H,(H4,9,10,11)
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190n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM50053595
PNG
(4-Chloro-Phenyl biguanide | 4-Chlorophenylbiguanid...)
Show SMILES NC(=N)N=C(N)Nc1ccc(Cl)cc1 |w:3.2|
Show InChI InChI=1S/C8H10ClN5/c9-5-1-3-6(4-2-5)13-8(12)14-7(10)11/h1-4H,(H6,10,11,12,13,14)
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200n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM50053592
PNG
(3-Nitro-Phenyl biguanide | CHEMBL42538 | N-(3-nitr...)
Show SMILES NC(=N)[N-]\C(N)=[NH+]/c1cccc(c1)[N+]([O-])=O
Show InChI InChI=1S/C8H9N6O2/c9-7(10)13-8(11)12-5-2-1-3-6(4-5)14(15)16/h1-4H,(H5-,9,10,11,12,13)/q-1/p+1
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220n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM50053619
PNG
(3-Chloro-4-Methyl-Phenyl biguanide | CHEMBL40190 |...)
Show SMILES Cc1ccc(NC(N)=NC(N)=N)cc1Cl |w:8.8|
Show InChI InChI=1S/C9H12ClN5/c1-5-2-3-6(4-7(5)10)14-9(13)15-8(11)12/h2-4H,1H3,(H6,11,12,13,14,15)
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225n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM50053624
PNG
(CHEMBL129150 | N-[2-(4-Chloro-phenyl)-ethyl]-guani...)
Show SMILES NC(=N)NCCc1ccc(Cl)cc1
Show InChI InChI=1S/C9H12ClN3/c10-8-3-1-7(2-4-8)5-6-13-9(11)12/h1-4H,5-6H2,(H4,11,12,13)
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243n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM50053590
PNG
(1N-amino(immino)methyl-4-chloroaniline | CHEMBL410...)
Show SMILES [#7]\[#6](-[#7])=[#7]\c1ccc(Cl)cc1
Show InChI InChI=1S/C7H8ClN3/c8-5-1-3-6(4-2-5)11-7(9)10/h1-4H,(H4,9,10,11)
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320n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM50053628
PNG
(1-Methyl-4-(6-methyl-pyridin-2-yl)-piperazine | CH...)
Show SMILES CN1CCN(CC1)c1cccc(C)n1
Show InChI InChI=1S/C11H17N3/c1-10-4-3-5-11(12-10)14-8-6-13(2)7-9-14/h3-5H,6-9H2,1-2H3
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560n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM50053634
PNG
(1-(4-Methoxy-2-methyl-phenyl)-piperazine | CHEMBL1...)
Show SMILES COc1ccc(N2CCNCC2)c(C)c1
Show InChI InChI=1S/C12H18N2O/c1-10-9-11(15-2)3-4-12(10)14-7-5-13-6-8-14/h3-4,9,13H,5-8H2,1-2H3
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660n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM50053609
PNG
(2-Methyl-Phenyl biguanide | CHEMBL289319 | N-(3-me...)
Show SMILES Cc1cccc(NC(N)=NC(N)=N)c1 |w:9.9|
Show InChI InChI=1S/C9H13N5/c1-6-3-2-4-7(5-6)13-9(12)14-8(10)11/h2-5H,1H3,(H6,10,11,12,13,14)
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780n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM50053632
PNG
(CHEMBL131570 | N-(3-Chloro-benzyl)-guanidine)
Show SMILES NC(=N)NCc1cccc(Cl)c1
Show InChI InChI=1S/C8H10ClN3/c9-7-3-1-2-6(4-7)5-12-8(10)11/h1-4H,5H2,(H4,10,11,12)
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1.20E+3n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM50053596
PNG
(1-phenylbiguanide | CHEMBL13791 | N-phenylimidodic...)
Show SMILES NC(=N)NC(N)=Nc1ccccc1 |w:6.6|
Show InChI InChI=1S/C8H11N5/c9-7(10)13-8(11)12-6-4-2-1-3-5-6/h1-5H,(H6,9,10,11,12,13)
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1.20E+3n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM50053626
PNG
((1Z)-2-(3-chlorophenyl)ethanimidamide | 2-(3-Chlor...)
Show SMILES NC(=N)Cc1cccc(Cl)c1
Show InChI InChI=1S/C8H9ClN2/c9-7-3-1-2-6(4-7)5-8(10)11/h1-4H,5H2,(H3,10,11)
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1.20E+3n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM50053607
PNG
(CHEMBL40459 | N-[(E)-amino(imino)methyl]-N'-(3-chl...)
Show SMILES NC(=N)NC(=O)Nc1cccc(Cl)c1
Show InChI InChI=1S/C8H9ClN4O/c9-5-2-1-3-6(4-5)12-8(14)13-7(10)11/h1-4H,(H5,10,11,12,13,14)
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1.25E+3n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM50007406
PNG
(1-(3-(trifluoromethyl)phenyl)piperazine | 1-(3-Tri...)
Show SMILES FC(F)(F)c1cccc(c1)N1CCNCC1
Show InChI InChI=1S/C11H13F3N2/c12-11(13,14)9-2-1-3-10(8-9)16-6-4-15-5-7-16/h1-3,8,15H,4-7H2
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1.39E+3n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM50053616
PNG
(4-(3-Chloro-phenyl)-1,1-dimethyl-piperazin-1-ium |...)
Show SMILES C[N+]1(C)CCN(CC1)c1cccc(Cl)c1
Show InChI InChI=1S/C12H18ClN2/c1-15(2)8-6-14(7-9-15)12-5-3-4-11(13)10-12/h3-5,10H,6-9H2,1-2H3/q+1
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1.45E+3n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM96691
PNG
(2-(3-methoxyphenyl)guanidine;hydrochloride | CHEMB...)
Show SMILES [#6]-[#8]-c1cccc(c1)\[#7]=[#6](\[#7])-[#7]
Show InChI InChI=1S/C8H11N3O/c1-12-7-4-2-3-6(5-7)11-8(9)10/h2-5H,1H3,(H4,9,10,11)
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1.60E+3n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM50001913
PNG
(1-(4-Methoxy-phenyl)-piperazine | 4-METHOXYPHENYLP...)
Show SMILES COc1ccc(cc1)N1CCNCC1
Show InChI InChI=1S/C11H16N2O/c1-14-11-4-2-10(3-5-11)13-8-6-12-7-9-13/h2-5,12H,6-9H2,1H3
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1.64E+3n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM50001897
PNG
(1-(4-Chloro-phenyl)-piperazine | CHEMBL114478 | pC...)
Show SMILES Clc1ccc(cc1)N1CCNCC1
Show InChI InChI=1S/C10H13ClN2/c11-9-1-3-10(4-2-9)13-7-5-12-6-8-13/h1-4,12H,5-8H2
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2.16E+3n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM50053620
PNG
(1-phenylguanidine | 1N-amino(immino)methylaniline ...)
Show SMILES [#7]\[#6](-[#7])=[#7]\c1ccccc1
Show InChI InChI=1S/C7H9N3/c8-7(9)10-6-4-2-1-3-5-6/h1-5H,(H4,8,9,10)
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2.34E+3n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM50001862
PNG
((N-(o-methoxyphenyl)piperazine)1-(2-Methoxy-phenyl...)
Show SMILES COc1ccccc1N1CCNCC1
Show InChI InChI=1S/C11H16N2O/c1-14-11-5-3-2-4-10(11)13-8-6-12-7-9-13/h2-5,12H,6-9H2,1H3
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2.50E+3n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM50053612
PNG
(CHEMBL419966 | N-Pyridin-3-yl-guanidine | PYRAXINI...)
Show SMILES [#7]\[#6](-[#7])=[#7]\c1cccnc1
Show InChI InChI=1S/C6H8N4/c7-6(8)10-5-2-1-3-9-4-5/h1-4H,(H4,7,8,10)
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2.91E+3n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM50001898
PNG
(1-Phenyl-piperazine | CHEMBL9434 | PHENYLPIPERAZIN...)
Show SMILES C1CN(CCN1)c1ccccc1
Show InChI InChI=1S/C10H14N2/c1-2-4-10(5-3-1)12-8-6-11-7-9-12/h1-5,11H,6-9H2
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3.00E+3n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM50053603
PNG
(1N-amino(immino)methyl-3-trifluoromethylaniline | ...)
Show SMILES [#7]\[#6](-[#7])=[#7]\c1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C8H8F3N3/c9-8(10,11)5-2-1-3-6(4-5)14-7(12)13/h1-4H,(H4,12,13,14)
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5.70E+3n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM50053601
PNG
(CHEMBL295000 | N-(3-methylphenyl)guanidine | N-m-T...)
Show SMILES [#6]-c1cccc(c1)\[#7]=[#6](\[#7])-[#7]
Show InChI InChI=1S/C8H11N3/c1-6-3-2-4-7(5-6)11-8(9)10/h2-5H,1H3,(H4,9,10,11)
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PubMed
6.52E+3n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM50053621
PNG
(CHEMBL336107 | N*1*-(3-Chloro-phenyl)-propane-1,3-...)
Show SMILES NCCCNc1cccc(Cl)c1
Show InChI InChI=1S/C9H13ClN2/c10-8-3-1-4-9(7-8)12-6-2-5-11/h1,3-4,7,12H,2,5-6,11H2
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PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM50053605
PNG
(4-(3-Chloro-phenyl)-butylamine | CHEMBL131771)
Show SMILES NCCCCc1cccc(Cl)c1
Show InChI InChI=1S/C10H14ClN/c11-10-6-3-5-9(8-10)4-1-2-7-12/h3,5-6,8H,1-2,4,7,12H2
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PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM50007394
PNG
(4-(2-Methoxy-phenyl)-piperidin-4-ol | CHEMBL334036)
Show SMILES COc1ccccc1C1(O)CCNCC1
Show InChI InChI=1S/C12H17NO2/c1-15-11-5-3-2-4-10(11)12(14)6-8-13-9-7-12/h2-5,13-14H,6-9H2,1H3
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>1.00E+4n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM50053602
PNG
(CHEMBL130703 | N-Methyl-2-(3-chlorophenyl)ethylami...)
Show SMILES CNCCc1cccc(Cl)c1
Show InChI InChI=1S/C9H12ClN/c1-11-6-5-8-3-2-4-9(10)7-8/h2-4,7,11H,5-6H2,1H3
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PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM50053625
PNG
(3-Amino-N-(3-chloro-phenyl)-propionamide | CHEMBL1...)
Show SMILES NCCC(=O)Nc1cccc(Cl)c1
Show InChI InChI=1S/C9H11ClN2O/c10-7-2-1-3-8(6-7)12-9(13)4-5-11/h1-3,6H,4-5,11H2,(H,12,13)
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PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM50053623
PNG
(1-(2,4-Dimethoxy-phenyl)-piperazine | CHEMBL131525)
Show SMILES COc1ccc(N2CCNCC2)c(OC)c1
Show InChI InChI=1S/C12H18N2O2/c1-15-10-3-4-11(12(9-10)16-2)14-7-5-13-6-8-14/h3-4,9,13H,5-8H2,1-2H3
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PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM50053600
PNG
((3-Chloro-phenyl)-urea | CHEMBL131289)
Show SMILES NC(=O)Nc1cccc(Cl)c1
Show InChI InChI=1S/C7H7ClN2O/c8-5-2-1-3-6(4-5)10-7(9)11/h1-4H,(H3,9,10,11)
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PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM50053627
PNG
(1,1-Dimethyl-4-(3-trifluoromethyl-phenyl)-piperazi...)
Show SMILES C[N+]1(C)CCN(CC1)c1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C13H18F3N2/c1-18(2)8-6-17(7-9-18)12-5-3-4-11(10-12)13(14,15)16/h3-5,10H,6-9H2,1-2H3/q+1
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PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B/3C/3D/3E


(Homo sapiens (Human))
BDBM50053599
PNG
(2-(3-Chloro-benzyl)-4,5-dihydro-1H-imidazole | CHE...)
Show SMILES Clc1cccc(CC2=NCCN2)c1 |t:7|
Show InChI InChI=1S/C10H11ClN2/c11-9-3-1-2-8(6-9)7-10-12-4-5-13-10/h1-3,6H,4-5,7H2,(H,12,13)
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PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of [3H]-GR-65,630 binding to 5-hydroxytryptamine 3 receptor expressed in NG 108-15 cells


J Med Chem 39: 4017-26 (1996)


Article DOI: 10.1021/jm9603936
BindingDB Entry DOI: 10.7270/Q23F4NQT
More data for this
Ligand-Target Pair
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