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Compile Data Set for Download or QSAR

Found 197 hits with Last Name = 'elmaleh' and Initial = 'dr'   
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
Sodium-dependent dopamine transporter


(Homo sapiens (Human))
BDBM50084332
PNG
((2-Benzhydryloxy-ethyl)-[1-(3-phenyl-propyl)-piper...)
Show SMILES C(CN1CCCC(CNCCOC(c2ccccc2)c2ccccc2)C1)Cc1ccccc1
Show InChI InChI=1S/C30H38N2O/c1-4-12-26(13-5-1)14-10-21-32-22-11-15-27(25-32)24-31-20-23-33-30(28-16-6-2-7-17-28)29-18-8-3-9-19-29/h1-9,12-13,16-19,27,30-31H,10-11,14-15,20-25H2
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18n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Inhibition of [125I]RTI-55 binding to dopamine transporter


J Med Chem 43: 205-13 (2000)


BindingDB Entry DOI: 10.7270/Q2JH3MW0
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(Homo sapiens (Human))
BDBM50084332
PNG
((2-Benzhydryloxy-ethyl)-[1-(3-phenyl-propyl)-piper...)
Show SMILES C(CN1CCCC(CNCCOC(c2ccccc2)c2ccccc2)C1)Cc1ccccc1
Show InChI InChI=1S/C30H38N2O/c1-4-12-26(13-5-1)14-10-21-32-22-11-15-27(25-32)24-31-20-23-33-30(28-16-6-2-7-17-28)29-18-8-3-9-19-29/h1-9,12-13,16-19,27,30-31H,10-11,14-15,20-25H2
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23n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Binding affinity at the norepinephrine transporter was measured using [125I]RTI-55 as a radioligand


J Med Chem 43: 205-13 (2000)


BindingDB Entry DOI: 10.7270/Q2JH3MW0
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Homo sapiens (Human))
BDBM50080561
PNG
(CHEMBL121460 | N,N'-Bis-{2-[bis-(4-fluoro-phenyl)-...)
Show SMILES CN(CCOC(c1ccc(F)cc1)c1ccc(F)cc1)CCN(C)CCOC(c1ccc(F)cc1)c1ccc(F)cc1
Show InChI InChI=1S/C34H36F4N2O2/c1-39(21-23-41-33(25-3-11-29(35)12-4-25)26-5-13-30(36)14-6-26)19-20-40(2)22-24-42-34(27-7-15-31(37)16-8-27)28-9-17-32(38)18-10-28/h3-18,33-34H,19-24H2,1-2H3
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26n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Inhibition of [125I]RTI-55 binding at Dopamine transporter (DAT) expressed in HEK cells


J Med Chem 42: 3647-56 (1999)


Article DOI: 10.1021/jm990161h
BindingDB Entry DOI: 10.7270/Q2BG2PPJ
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Homo sapiens (Human))
BDBM50080569
PNG
(CHEMBL121611 | N-{2-[Bis-(4-fluoro-phenyl)-methoxy...)
Show SMILES Fc1ccc(cc1)C(OCCNCCCNCCc1ccccc1)c1ccc(F)cc1
Show InChI InChI=1S/C26H30F2N2O/c27-24-11-7-22(8-12-24)26(23-9-13-25(28)14-10-23)31-20-19-30-17-4-16-29-18-15-21-5-2-1-3-6-21/h1-3,5-14,26,29-30H,4,15-20H2
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28n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Inhibition of [125I]RTI-55 binding at Dopamine transporter (DAT) expressed in HEK cells


J Med Chem 42: 3647-56 (1999)


Article DOI: 10.1021/jm990161h
BindingDB Entry DOI: 10.7270/Q2BG2PPJ
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(Homo sapiens (Human))
BDBM50084333
PNG
((2-Benzhydryloxy-ethyl)-[1-(3-phenyl-propyl)-piper...)
Show SMILES CN(CCOC(c1ccccc1)c1ccccc1)C1CCN(CCCc2ccccc2)CC1
Show InChI InChI=1S/C30H38N2O/c1-31(29-19-22-32(23-20-29)21-11-14-26-12-5-2-6-13-26)24-25-33-30(27-15-7-3-8-16-27)28-17-9-4-10-18-28/h2-10,12-13,15-18,29-30H,11,14,19-25H2,1H3
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29n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Binding affinity at the norepinephrine transporter was measured using [125I]RTI-55 as a radioligand


J Med Chem 43: 205-13 (2000)


BindingDB Entry DOI: 10.7270/Q2JH3MW0
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(Homo sapiens (Human))
BDBM50080566
PNG
(CHEMBL123252 | N-(2-Benzhydryloxy-ethyl)-N,N'-dime...)
Show SMILES CN(CCCN(C)CCOC(c1ccccc1)c1ccccc1)CCCc1ccccc1
Show InChI InChI=1S/C29H38N2O/c1-30(21-12-16-26-14-6-3-7-15-26)22-13-23-31(2)24-25-32-29(27-17-8-4-9-18-27)28-19-10-5-11-20-28/h3-11,14-15,17-20,29H,12-13,16,21-25H2,1-2H3
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30n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Inhibition of [125I]RTI-55 binding to norepinephrine transporter (NET) expressed in HEK cells


J Med Chem 42: 3647-56 (1999)


Article DOI: 10.1021/jm990161h
BindingDB Entry DOI: 10.7270/Q2BG2PPJ
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Homo sapiens (Human))
BDBM50080567
PNG
(CHEMBL121027 | N-(2-Benzhydryloxy-ethyl)-N'-[2-(4-...)
Show SMILES CN(CCOC(c1ccccc1)c1ccccc1)CCN(C)CCc1ccc(F)cc1
Show InChI InChI=1S/C27H33FN2O/c1-29(18-17-23-13-15-26(28)16-14-23)19-20-30(2)21-22-31-27(24-9-5-3-6-10-24)25-11-7-4-8-12-25/h3-16,27H,17-22H2,1-2H3
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30n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Inhibition of [125I]RTI-55 binding at Dopamine transporter (DAT) expressed in HEK cells


J Med Chem 42: 3647-56 (1999)


Article DOI: 10.1021/jm990161h
BindingDB Entry DOI: 10.7270/Q2BG2PPJ
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Homo sapiens (Human))
BDBM50084333
PNG
((2-Benzhydryloxy-ethyl)-[1-(3-phenyl-propyl)-piper...)
Show SMILES CN(CCOC(c1ccccc1)c1ccccc1)C1CCN(CCCc2ccccc2)CC1
Show InChI InChI=1S/C30H38N2O/c1-31(29-19-22-32(23-20-29)21-11-14-26-12-5-2-6-13-26)24-25-33-30(27-15-7-3-8-16-27)28-17-9-4-10-18-28/h2-10,12-13,15-18,29-30H,11,14,19-25H2,1H3
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30n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Inhibition of [125I]RTI-55 binding to dopamine transporter


J Med Chem 43: 205-13 (2000)


BindingDB Entry DOI: 10.7270/Q2JH3MW0
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(Homo sapiens (Human))
BDBM50084337
PNG
(CHEMBL67078 | [1-(2-Benzhydryloxy-ethyl)-piperidin...)
Show SMILES C(CNCC1CCCN(CCOC(c2ccccc2)c2ccccc2)C1)Cc1ccccc1
Show InChI InChI=1S/C30H38N2O/c1-4-12-26(13-5-1)14-10-20-31-24-27-15-11-21-32(25-27)22-23-33-30(28-16-6-2-7-17-28)29-18-8-3-9-19-29/h1-9,12-13,16-19,27,30-31H,10-11,14-15,20-25H2
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41n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Binding affinity at the norepinephrine transporter was measured using [125I]RTI-55 as a radioligand


J Med Chem 43: 205-13 (2000)


BindingDB Entry DOI: 10.7270/Q2JH3MW0
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(Homo sapiens (Human))
BDBM50084339
PNG
(CHEMBL443797 | [1-(2-Benzhydryloxy-ethyl)-piperidi...)
Show SMILES CN(CCCc1ccccc1)C1CCN(CCOC(c2ccccc2)c2ccccc2)CC1
Show InChI InChI=1S/C30H38N2O/c1-31(21-11-14-26-12-5-2-6-13-26)29-19-22-32(23-20-29)24-25-33-30(27-15-7-3-8-16-27)28-17-9-4-10-18-28/h2-10,12-13,15-18,29-30H,11,14,19-25H2,1H3
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42n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Binding affinity at the norepinephrine transporter was measured using [125I]RTI-55 as a radioligand


J Med Chem 43: 205-13 (2000)


BindingDB Entry DOI: 10.7270/Q2JH3MW0
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Homo sapiens (Human))
BDBM50080572
PNG
(CHEMBL333667 | N-(2-{2-[Bis-(4-fluoro-phenyl)-meth...)
Show SMILES Fc1ccc(cc1)C(OCCNCCNC(=O)Cc1ccccc1)c1ccc(F)cc1
Show InChI InChI=1S/C25H26F2N2O2/c26-22-10-6-20(7-11-22)25(21-8-12-23(27)13-9-21)31-17-16-28-14-15-29-24(30)18-19-4-2-1-3-5-19/h1-13,25,28H,14-18H2,(H,29,30)
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54n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Inhibition of [125I]RTI-55 binding at Dopamine transporter (DAT) expressed in HEK cells


J Med Chem 42: 3647-56 (1999)


Article DOI: 10.1021/jm990161h
BindingDB Entry DOI: 10.7270/Q2BG2PPJ
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Homo sapiens (Human))
BDBM50080571
PNG
(CHEMBL123830 | N-(2-{2-[Bis-(4-fluoro-phenyl)-meth...)
Show SMILES Fc1ccc(CC(=O)NCCNCCOC(c2ccc(F)cc2)c2ccc(F)cc2)cc1
Show InChI InChI=1S/C25H25F3N2O2/c26-21-7-1-18(2-8-21)17-24(31)30-14-13-29-15-16-32-25(19-3-9-22(27)10-4-19)20-5-11-23(28)12-6-20/h1-12,25,29H,13-17H2,(H,30,31)
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54n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Inhibition of [125I]RTI-55 binding at Dopamine transporter (DAT) expressed in HEK cells


J Med Chem 42: 3647-56 (1999)


Article DOI: 10.1021/jm990161h
BindingDB Entry DOI: 10.7270/Q2BG2PPJ
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Homo sapiens (Human))
BDBM50084334
PNG
(CHEMBL421867 | [1-(2-Benzhydryloxy-ethyl)-piperidi...)
Show SMILES C(CNC1CCN(CCOC(c2ccccc2)c2ccccc2)CC1)Cc1ccccc1
Show InChI InChI=1S/C29H36N2O/c1-4-11-25(12-5-1)13-10-20-30-28-18-21-31(22-19-28)23-24-32-29(26-14-6-2-7-15-26)27-16-8-3-9-17-27/h1-9,11-12,14-17,28-30H,10,13,18-24H2
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55n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Binding affinity for serotonin transporter using [125I]RTI-55


J Med Chem 43: 205-13 (2000)


BindingDB Entry DOI: 10.7270/Q2JH3MW0
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Homo sapiens (Human))
BDBM50080564
PNG
(CHEMBL420900 | N-(3-{2-[Bis-(4-fluoro-phenyl)-meth...)
Show SMILES Fc1ccc(cc1)C(OCCNCCCNC(=O)Cc1ccccc1)c1ccc(F)cc1
Show InChI InChI=1S/C26H28F2N2O2/c27-23-11-7-21(8-12-23)26(22-9-13-24(28)14-10-22)32-18-17-29-15-4-16-30-25(31)19-20-5-2-1-3-6-20/h1-3,5-14,26,29H,4,15-19H2,(H,30,31)
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61n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Inhibition of [125I]RTI-55 binding at Dopamine transporter (DAT) expressed in HEK cells


J Med Chem 42: 3647-56 (1999)


Article DOI: 10.1021/jm990161h
BindingDB Entry DOI: 10.7270/Q2BG2PPJ
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Homo sapiens (Human))
BDBM50084337
PNG
(CHEMBL67078 | [1-(2-Benzhydryloxy-ethyl)-piperidin...)
Show SMILES C(CNCC1CCCN(CCOC(c2ccccc2)c2ccccc2)C1)Cc1ccccc1
Show InChI InChI=1S/C30H38N2O/c1-4-12-26(13-5-1)14-10-20-31-24-27-15-11-21-32(25-27)22-23-33-30(28-16-6-2-7-17-28)29-18-8-3-9-19-29/h1-9,12-13,16-19,27,30-31H,10-11,14-15,20-25H2
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70n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Inhibition of [125I]RTI-55 binding to dopamine transporter


J Med Chem 43: 205-13 (2000)


BindingDB Entry DOI: 10.7270/Q2JH3MW0
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Homo sapiens (Human))
BDBM22167
PNG
(1-[2-(diphenylmethoxy)ethyl]-4-(3-phenylpropyl)pip...)
Show SMILES C(CN1CCN(CCOC(c2ccccc2)c2ccccc2)CC1)Cc1ccccc1
Show InChI InChI=1S/C28H34N2O/c1-4-11-25(12-5-1)13-10-18-29-19-21-30(22-20-29)23-24-31-28(26-14-6-2-7-15-26)27-16-8-3-9-17-27/h1-9,11-12,14-17,28H,10,13,18-24H2
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73n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Inhibition of [125I]RTI-55 binding to dopamine transporter


J Med Chem 43: 205-13 (2000)


BindingDB Entry DOI: 10.7270/Q2JH3MW0
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(Homo sapiens (Human))
BDBM50084335
PNG
(CHEMBL67024 | [1-(2-Benzhydryloxy-ethyl)-piperidin...)
Show SMILES Fc1ccc(CCNC2CCN(CCOC(c3ccccc3)c3ccccc3)CC2)cc1
Show InChI InChI=1S/C28H33FN2O/c29-26-13-11-23(12-14-26)15-18-30-27-16-19-31(20-17-27)21-22-32-28(24-7-3-1-4-8-24)25-9-5-2-6-10-25/h1-14,27-28,30H,15-22H2
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79n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Binding affinity at the norepinephrine transporter was measured using [125I]RTI-55 as a radioligand


J Med Chem 43: 205-13 (2000)


BindingDB Entry DOI: 10.7270/Q2JH3MW0
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(Homo sapiens (Human))
BDBM50080569
PNG
(CHEMBL121611 | N-{2-[Bis-(4-fluoro-phenyl)-methoxy...)
Show SMILES Fc1ccc(cc1)C(OCCNCCCNCCc1ccccc1)c1ccc(F)cc1
Show InChI InChI=1S/C26H30F2N2O/c27-24-11-7-22(8-12-24)26(23-9-13-25(28)14-10-23)31-20-19-30-17-4-16-29-18-15-21-5-2-1-3-6-21/h1-3,5-14,26,29-30H,4,15-20H2
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82n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Inhibition of [125I]RTI-55 binding to norepinephrine transporter (NET) expressed in HEK cells


J Med Chem 42: 3647-56 (1999)


Article DOI: 10.1021/jm990161h
BindingDB Entry DOI: 10.7270/Q2BG2PPJ
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Homo sapiens (Human))
BDBM50084341
PNG
((2-Benzhydryloxy-ethyl)-(1-benzyl-piperidin-4-yl)-...)
Show SMILES C(COC(c1ccccc1)c1ccccc1)NC1CCN(Cc2ccccc2)CC1
Show InChI InChI=1S/C27H32N2O/c1-4-10-23(11-5-1)22-29-19-16-26(17-20-29)28-18-21-30-27(24-12-6-2-7-13-24)25-14-8-3-9-15-25/h1-15,26-28H,16-22H2
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83n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Inhibition of [125I]RTI-55 binding to dopamine transporter


J Med Chem 43: 205-13 (2000)


BindingDB Entry DOI: 10.7270/Q2JH3MW0
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Homo sapiens (Human))
BDBM50084339
PNG
(CHEMBL443797 | [1-(2-Benzhydryloxy-ethyl)-piperidi...)
Show SMILES CN(CCCc1ccccc1)C1CCN(CCOC(c2ccccc2)c2ccccc2)CC1
Show InChI InChI=1S/C30H38N2O/c1-31(21-11-14-26-12-5-2-6-13-26)29-19-22-32(23-20-29)24-25-33-30(27-15-7-3-8-16-27)28-17-9-4-10-18-28/h2-10,12-13,15-18,29-30H,11,14,19-25H2,1H3
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87n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Binding affinity for serotonin transporter using [125I]RTI-55


J Med Chem 43: 205-13 (2000)


BindingDB Entry DOI: 10.7270/Q2JH3MW0
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Homo sapiens (Human))
BDBM50084340
PNG
(CHEMBL417035 | [1-(2-Benzhydryloxy-ethyl)-piperidi...)
Show SMILES Fc1ccc(CCNCC2CCCN(CCOC(c3ccccc3)c3ccccc3)C2)cc1
Show InChI InChI=1S/C29H35FN2O/c30-28-15-13-24(14-16-28)17-18-31-22-25-8-7-19-32(23-25)20-21-33-29(26-9-3-1-4-10-26)27-11-5-2-6-12-27/h1-6,9-16,25,29,31H,7-8,17-23H2
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87n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Inhibition of [125I]RTI-55 binding to dopamine transporter


J Med Chem 43: 205-13 (2000)


BindingDB Entry DOI: 10.7270/Q2JH3MW0
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Homo sapiens (Human))
BDBM50084336
PNG
(CHEMBL69380 | [1-(2-Benzhydryloxy-ethyl)-piperidin...)
Show SMILES CN(CCc1ccc(F)cc1)CC1CCCN(CCOC(c2ccccc2)c2ccccc2)C1
Show InChI InChI=1S/C30H37FN2O/c1-32(20-18-25-14-16-29(31)17-15-25)23-26-9-8-19-33(24-26)21-22-34-30(27-10-4-2-5-11-27)28-12-6-3-7-13-28/h2-7,10-17,26,30H,8-9,18-24H2,1H3
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90n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Inhibition of [125I]RTI-55 binding to dopamine transporter


J Med Chem 43: 205-13 (2000)


BindingDB Entry DOI: 10.7270/Q2JH3MW0
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Homo sapiens (Human))
BDBM50084338
PNG
((2-Benzhydryloxy-ethyl)-{1-[2-(4-fluoro-phenyl)-et...)
Show SMILES Fc1ccc(CCN2CCCC(CNCCOC(c3ccccc3)c3ccccc3)C2)cc1
Show InChI InChI=1S/C29H35FN2O/c30-28-15-13-24(14-16-28)17-20-32-19-7-8-25(23-32)22-31-18-21-33-29(26-9-3-1-4-10-26)27-11-5-2-6-12-27/h1-6,9-16,25,29,31H,7-8,17-23H2
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100n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Inhibition of [125I]RTI-55 binding to dopamine transporter


J Med Chem 43: 205-13 (2000)


BindingDB Entry DOI: 10.7270/Q2JH3MW0
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Homo sapiens (Human))
BDBM50084335
PNG
(CHEMBL67024 | [1-(2-Benzhydryloxy-ethyl)-piperidin...)
Show SMILES Fc1ccc(CCNC2CCN(CCOC(c3ccccc3)c3ccccc3)CC2)cc1
Show InChI InChI=1S/C28H33FN2O/c29-26-13-11-23(12-14-26)15-18-30-27-16-19-31(20-17-27)21-22-32-28(24-7-3-1-4-8-24)25-9-5-2-6-10-25/h1-14,27-28,30H,15-22H2
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110n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Inhibition of [125I]RTI-55 binding to dopamine transporter


J Med Chem 43: 205-13 (2000)


BindingDB Entry DOI: 10.7270/Q2JH3MW0
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(Homo sapiens (Human))
BDBM50084336
PNG
(CHEMBL69380 | [1-(2-Benzhydryloxy-ethyl)-piperidin...)
Show SMILES CN(CCc1ccc(F)cc1)CC1CCCN(CCOC(c2ccccc2)c2ccccc2)C1
Show InChI InChI=1S/C30H37FN2O/c1-32(20-18-25-14-16-29(31)17-15-25)23-26-9-8-19-33(24-26)21-22-34-30(27-10-4-2-5-11-27)28-12-6-3-7-13-28/h2-7,10-17,26,30H,8-9,18-24H2,1H3
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110n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Binding affinity at the norepinephrine transporter was measured using [125I]RTI-55 as a radioligand


J Med Chem 43: 205-13 (2000)


BindingDB Entry DOI: 10.7270/Q2JH3MW0
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Homo sapiens (Human))
BDBM50080568
PNG
(1-{2-[Bis-(4-fluoro-phenyl)-methoxy]-ethyl}-4-phen...)
Show SMILES Fc1ccc(cc1)C(OCCN1CCN(CCc2ccccc2)CC1=O)c1ccc(F)cc1
Show InChI InChI=1S/C27H28F2N2O2/c28-24-10-6-22(7-11-24)27(23-8-12-25(29)13-9-23)33-19-18-31-17-16-30(20-26(31)32)15-14-21-4-2-1-3-5-21/h1-13,27H,14-20H2
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114n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Inhibition of [125I]RTI-55 binding to serotonin transporter (SERT) expressed in HEK cells


J Med Chem 42: 3647-56 (1999)


Article DOI: 10.1021/jm990161h
BindingDB Entry DOI: 10.7270/Q2BG2PPJ
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(Homo sapiens (Human))
BDBM50084334
PNG
(CHEMBL421867 | [1-(2-Benzhydryloxy-ethyl)-piperidi...)
Show SMILES C(CNC1CCN(CCOC(c2ccccc2)c2ccccc2)CC1)Cc1ccccc1
Show InChI InChI=1S/C29H36N2O/c1-4-11-25(12-5-1)13-10-20-30-28-18-21-31(22-19-28)23-24-32-29(26-14-6-2-7-15-26)27-16-8-3-9-17-27/h1-9,11-12,14-17,28-30H,10,13,18-24H2
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120n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Binding affinity at the norepinephrine transporter was measured using [125I]RTI-55 as a radioligand


J Med Chem 43: 205-13 (2000)


BindingDB Entry DOI: 10.7270/Q2JH3MW0
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Homo sapiens (Human))
BDBM50080566
PNG
(CHEMBL123252 | N-(2-Benzhydryloxy-ethyl)-N,N'-dime...)
Show SMILES CN(CCCN(C)CCOC(c1ccccc1)c1ccccc1)CCCc1ccccc1
Show InChI InChI=1S/C29H38N2O/c1-30(21-12-16-26-14-6-3-7-15-26)22-13-23-31(2)24-25-32-29(27-17-8-4-9-18-27)28-19-10-5-11-20-28/h3-11,14-15,17-20,29H,12-13,16,21-25H2,1-2H3
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122n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Inhibition of [125I]RTI-55 binding at Dopamine transporter (DAT) expressed in HEK cells


J Med Chem 42: 3647-56 (1999)


Article DOI: 10.1021/jm990161h
BindingDB Entry DOI: 10.7270/Q2BG2PPJ
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Homo sapiens (Human))
BDBM50080569
PNG
(CHEMBL121611 | N-{2-[Bis-(4-fluoro-phenyl)-methoxy...)
Show SMILES Fc1ccc(cc1)C(OCCNCCCNCCc1ccccc1)c1ccc(F)cc1
Show InChI InChI=1S/C26H30F2N2O/c27-24-11-7-22(8-12-24)26(23-9-13-25(28)14-10-23)31-20-19-30-17-4-16-29-18-15-21-5-2-1-3-6-21/h1-3,5-14,26,29-30H,4,15-20H2
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125n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Inhibition of [125I]RTI-55 binding to serotonin transporter (SERT) expressed in HEK cells


J Med Chem 42: 3647-56 (1999)


Article DOI: 10.1021/jm990161h
BindingDB Entry DOI: 10.7270/Q2BG2PPJ
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(Homo sapiens (Human))
BDBM50084338
PNG
((2-Benzhydryloxy-ethyl)-{1-[2-(4-fluoro-phenyl)-et...)
Show SMILES Fc1ccc(CCN2CCCC(CNCCOC(c3ccccc3)c3ccccc3)C2)cc1
Show InChI InChI=1S/C29H35FN2O/c30-28-15-13-24(14-16-28)17-20-32-19-7-8-25(23-32)22-31-18-21-33-29(26-9-3-1-4-10-26)27-11-5-2-6-12-27/h1-6,9-16,25,29,31H,7-8,17-23H2
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150n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Binding affinity at the norepinephrine transporter was measured using [125I]RTI-55 as a radioligand


J Med Chem 43: 205-13 (2000)


BindingDB Entry DOI: 10.7270/Q2JH3MW0
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Homo sapiens (Human))
BDBM50084334
PNG
(CHEMBL421867 | [1-(2-Benzhydryloxy-ethyl)-piperidi...)
Show SMILES C(CNC1CCN(CCOC(c2ccccc2)c2ccccc2)CC1)Cc1ccccc1
Show InChI InChI=1S/C29H36N2O/c1-4-11-25(12-5-1)13-10-20-30-28-18-21-31(22-19-28)23-24-32-29(26-14-6-2-7-15-26)27-16-8-3-9-17-27/h1-9,11-12,14-17,28-30H,10,13,18-24H2
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160n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Inhibition of [125I]RTI-55 binding to dopamine transporter


J Med Chem 43: 205-13 (2000)


BindingDB Entry DOI: 10.7270/Q2JH3MW0
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(Homo sapiens (Human))
BDBM50084341
PNG
((2-Benzhydryloxy-ethyl)-(1-benzyl-piperidin-4-yl)-...)
Show SMILES C(COC(c1ccccc1)c1ccccc1)NC1CCN(Cc2ccccc2)CC1
Show InChI InChI=1S/C27H32N2O/c1-4-10-23(11-5-1)22-29-19-16-26(17-20-29)28-18-21-30-27(24-12-6-2-7-13-24)25-14-8-3-9-15-25/h1-15,26-28H,16-22H2
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180n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Binding affinity at the norepinephrine transporter was measured using [125I]RTI-55 as a radioligand


J Med Chem 43: 205-13 (2000)


BindingDB Entry DOI: 10.7270/Q2JH3MW0
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(Homo sapiens (Human))
BDBM50084340
PNG
(CHEMBL417035 | [1-(2-Benzhydryloxy-ethyl)-piperidi...)
Show SMILES Fc1ccc(CCNCC2CCCN(CCOC(c3ccccc3)c3ccccc3)C2)cc1
Show InChI InChI=1S/C29H35FN2O/c30-28-15-13-24(14-16-28)17-18-31-22-25-8-7-19-32(23-25)20-21-33-29(26-9-3-1-4-10-26)27-11-5-2-6-12-27/h1-6,9-16,25,29,31H,7-8,17-23H2
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190n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Binding affinity at the norepinephrine transporter was measured using [125I]RTI-55 as a radioligand


J Med Chem 43: 205-13 (2000)


BindingDB Entry DOI: 10.7270/Q2JH3MW0
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(Homo sapiens (Human))
BDBM50080565
PNG
(CHEMBL122452 | N-(2-Benzhydryloxy-ethyl)-N,N'-dime...)
Show SMILES CN(CCCN(C)CCc1ccccc1)CCOC(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C28H36N2O/c1-29(22-19-25-13-6-3-7-14-25)20-12-21-30(2)23-24-31-28(26-15-8-4-9-16-26)27-17-10-5-11-18-27/h3-11,13-18,28H,12,19-24H2,1-2H3
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194n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Inhibition of [125I]RTI-55 binding to norepinephrine transporter (NET) expressed in HEK cells


J Med Chem 42: 3647-56 (1999)


Article DOI: 10.1021/jm990161h
BindingDB Entry DOI: 10.7270/Q2BG2PPJ
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Homo sapiens (Human))
BDBM50084332
PNG
((2-Benzhydryloxy-ethyl)-[1-(3-phenyl-propyl)-piper...)
Show SMILES C(CN1CCCC(CNCCOC(c2ccccc2)c2ccccc2)C1)Cc1ccccc1
Show InChI InChI=1S/C30H38N2O/c1-4-12-26(13-5-1)14-10-21-32-22-11-15-27(25-32)24-31-20-23-33-30(28-16-6-2-7-17-28)29-18-8-3-9-19-29/h1-9,12-13,16-19,27,30-31H,10-11,14-15,20-25H2
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210n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Binding affinity for serotonin transporter using [125I]RTI-55


J Med Chem 43: 205-13 (2000)


BindingDB Entry DOI: 10.7270/Q2JH3MW0
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Homo sapiens (Human))
BDBM50084335
PNG
(CHEMBL67024 | [1-(2-Benzhydryloxy-ethyl)-piperidin...)
Show SMILES Fc1ccc(CCNC2CCN(CCOC(c3ccccc3)c3ccccc3)CC2)cc1
Show InChI InChI=1S/C28H33FN2O/c29-26-13-11-23(12-14-26)15-18-30-27-16-19-31(20-17-27)21-22-32-28(24-7-3-1-4-8-24)25-9-5-2-6-10-25/h1-14,27-28,30H,15-22H2
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220n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Binding affinity for serotonin transporter using [125I]RTI-55


J Med Chem 43: 205-13 (2000)


BindingDB Entry DOI: 10.7270/Q2JH3MW0
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(Homo sapiens (Human))
BDBM50080561
PNG
(CHEMBL121460 | N,N'-Bis-{2-[bis-(4-fluoro-phenyl)-...)
Show SMILES CN(CCOC(c1ccc(F)cc1)c1ccc(F)cc1)CCN(C)CCOC(c1ccc(F)cc1)c1ccc(F)cc1
Show InChI InChI=1S/C34H36F4N2O2/c1-39(21-23-41-33(25-3-11-29(35)12-4-25)26-5-13-30(36)14-6-26)19-20-40(2)22-24-42-34(27-7-15-31(37)16-8-27)28-9-17-32(38)18-10-28/h3-18,33-34H,19-24H2,1-2H3
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261n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Inhibition of [125I]RTI-55 binding to norepinephrine transporter (NET) expressed in HEK cells


J Med Chem 42: 3647-56 (1999)


Article DOI: 10.1021/jm990161h
BindingDB Entry DOI: 10.7270/Q2BG2PPJ
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Homo sapiens (Human))
BDBM50084337
PNG
(CHEMBL67078 | [1-(2-Benzhydryloxy-ethyl)-piperidin...)
Show SMILES C(CNCC1CCCN(CCOC(c2ccccc2)c2ccccc2)C1)Cc1ccccc1
Show InChI InChI=1S/C30H38N2O/c1-4-12-26(13-5-1)14-10-20-31-24-27-15-11-21-32(25-27)22-23-33-30(28-16-6-2-7-17-28)29-18-8-3-9-19-29/h1-9,12-13,16-19,27,30-31H,10-11,14-15,20-25H2
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320n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Binding affinity for serotonin transporter using [125I]RTI-55


J Med Chem 43: 205-13 (2000)


BindingDB Entry DOI: 10.7270/Q2JH3MW0
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Homo sapiens (Human))
BDBM50080565
PNG
(CHEMBL122452 | N-(2-Benzhydryloxy-ethyl)-N,N'-dime...)
Show SMILES CN(CCCN(C)CCc1ccccc1)CCOC(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C28H36N2O/c1-29(22-19-25-13-6-3-7-14-25)20-12-21-30(2)23-24-31-28(26-15-8-4-9-16-26)27-17-10-5-11-18-27/h3-11,13-18,28H,12,19-24H2,1-2H3
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322n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Inhibition of [125I]RTI-55 binding at Dopamine transporter (DAT) expressed in HEK cells


J Med Chem 42: 3647-56 (1999)


Article DOI: 10.1021/jm990161h
BindingDB Entry DOI: 10.7270/Q2BG2PPJ
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Homo sapiens (Human))
BDBM50084339
PNG
(CHEMBL443797 | [1-(2-Benzhydryloxy-ethyl)-piperidi...)
Show SMILES CN(CCCc1ccccc1)C1CCN(CCOC(c2ccccc2)c2ccccc2)CC1
Show InChI InChI=1S/C30H38N2O/c1-31(21-11-14-26-12-5-2-6-13-26)29-19-22-32(23-20-29)24-25-33-30(27-15-7-3-8-16-27)28-17-9-4-10-18-28/h2-10,12-13,15-18,29-30H,11,14,19-25H2,1H3
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340n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Inhibition of [125I]RTI-55 binding to dopamine transporter


J Med Chem 43: 205-13 (2000)


BindingDB Entry DOI: 10.7270/Q2JH3MW0
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Homo sapiens (Human))
BDBM50084338
PNG
((2-Benzhydryloxy-ethyl)-{1-[2-(4-fluoro-phenyl)-et...)
Show SMILES Fc1ccc(CCN2CCCC(CNCCOC(c3ccccc3)c3ccccc3)C2)cc1
Show InChI InChI=1S/C29H35FN2O/c30-28-15-13-24(14-16-28)17-20-32-19-7-8-25(23-32)22-31-18-21-33-29(26-9-3-1-4-10-26)27-11-5-2-6-12-27/h1-6,9-16,25,29,31H,7-8,17-23H2
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350n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Binding affinity for serotonin transporter using [125I]RTI-55


J Med Chem 43: 205-13 (2000)


BindingDB Entry DOI: 10.7270/Q2JH3MW0
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Homo sapiens (Human))
BDBM50080571
PNG
(CHEMBL123830 | N-(2-{2-[Bis-(4-fluoro-phenyl)-meth...)
Show SMILES Fc1ccc(CC(=O)NCCNCCOC(c2ccc(F)cc2)c2ccc(F)cc2)cc1
Show InChI InChI=1S/C25H25F3N2O2/c26-21-7-1-18(2-8-21)17-24(31)30-14-13-29-15-16-32-25(19-3-9-22(27)10-4-19)20-5-11-23(28)12-6-20/h1-12,25,29H,13-17H2,(H,30,31)
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351n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Inhibition of [125I]RTI-55 binding to serotonin transporter (SERT) expressed in HEK cells


J Med Chem 42: 3647-56 (1999)


Article DOI: 10.1021/jm990161h
BindingDB Entry DOI: 10.7270/Q2BG2PPJ
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(Homo sapiens (Human))
BDBM50080567
PNG
(CHEMBL121027 | N-(2-Benzhydryloxy-ethyl)-N'-[2-(4-...)
Show SMILES CN(CCOC(c1ccccc1)c1ccccc1)CCN(C)CCc1ccc(F)cc1
Show InChI InChI=1S/C27H33FN2O/c1-29(18-17-23-13-15-26(28)16-14-23)19-20-30(2)21-22-31-27(24-9-5-3-6-10-24)25-11-7-4-8-12-25/h3-16,27H,17-22H2,1-2H3
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370n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Inhibition of [125I]RTI-55 binding to norepinephrine transporter (NET) expressed in HEK cells


J Med Chem 42: 3647-56 (1999)


Article DOI: 10.1021/jm990161h
BindingDB Entry DOI: 10.7270/Q2BG2PPJ
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Homo sapiens (Human))
BDBM50084717
PNG
((+)-(1R,2R,3S,5S)-methyl 3-(benzoyloxy)-8-methyl-8...)
Show SMILES COC(=O)[C@@H]1C2CCC(C[C@@H]1C(=O)Oc1ccccc1)N2C |THB:2:4:20:6.7|
Show InChI InChI=1S/C17H21NO4/c1-18-11-8-9-14(18)15(17(20)21-2)13(10-11)16(19)22-12-6-4-3-5-7-12/h3-7,11,13-15H,8-10H2,1-2H3/t11?,13-,14?,15-/m0/s1
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387n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Inhibition of [125I]RTI-55 binding to serotonin transporter (SERT) expressed in HEK cells


J Med Chem 42: 3647-56 (1999)


Article DOI: 10.1021/jm990161h
BindingDB Entry DOI: 10.7270/Q2BG2PPJ
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Homo sapiens (Human))
BDBM50084717
PNG
((+)-(1R,2R,3S,5S)-methyl 3-(benzoyloxy)-8-methyl-8...)
Show SMILES COC(=O)[C@@H]1C2CCC(C[C@@H]1C(=O)Oc1ccccc1)N2C |THB:2:4:20:6.7|
Show InChI InChI=1S/C17H21NO4/c1-18-11-8-9-14(18)15(17(20)21-2)13(10-11)16(19)22-12-6-4-3-5-7-12/h3-7,11,13-15H,8-10H2,1-2H3/t11?,13-,14?,15-/m0/s1
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390n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Binding affinity for serotonin transporter using [125I]RTI-55


J Med Chem 43: 205-13 (2000)


BindingDB Entry DOI: 10.7270/Q2JH3MW0
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Homo sapiens (Human))
BDBM50080566
PNG
(CHEMBL123252 | N-(2-Benzhydryloxy-ethyl)-N,N'-dime...)
Show SMILES CN(CCCN(C)CCOC(c1ccccc1)c1ccccc1)CCCc1ccccc1
Show InChI InChI=1S/C29H38N2O/c1-30(21-12-16-26-14-6-3-7-15-26)22-13-23-31(2)24-25-32-29(27-17-8-4-9-18-27)28-19-10-5-11-20-28/h3-11,14-15,17-20,29H,12-13,16,21-25H2,1-2H3
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438n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Inhibition of [125I]RTI-55 binding to serotonin transporter (SERT) expressed in HEK cells


J Med Chem 42: 3647-56 (1999)


Article DOI: 10.1021/jm990161h
BindingDB Entry DOI: 10.7270/Q2BG2PPJ
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(Homo sapiens (Human))
BDBM50080564
PNG
(CHEMBL420900 | N-(3-{2-[Bis-(4-fluoro-phenyl)-meth...)
Show SMILES Fc1ccc(cc1)C(OCCNCCCNC(=O)Cc1ccccc1)c1ccc(F)cc1
Show InChI InChI=1S/C26H28F2N2O2/c27-23-11-7-21(8-12-23)26(22-9-13-24(28)14-10-22)32-18-17-29-15-4-16-30-25(31)19-20-5-2-1-3-6-20/h1-3,5-14,26,29H,4,15-19H2,(H,30,31)
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477n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Inhibition of [125I]RTI-55 binding to norepinephrine transporter (NET) expressed in HEK cells


J Med Chem 42: 3647-56 (1999)


Article DOI: 10.1021/jm990161h
BindingDB Entry DOI: 10.7270/Q2BG2PPJ
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Homo sapiens (Human))
BDBM50084336
PNG
(CHEMBL69380 | [1-(2-Benzhydryloxy-ethyl)-piperidin...)
Show SMILES CN(CCc1ccc(F)cc1)CC1CCCN(CCOC(c2ccccc2)c2ccccc2)C1
Show InChI InChI=1S/C30H37FN2O/c1-32(20-18-25-14-16-29(31)17-15-25)23-26-9-8-19-33(24-26)21-22-34-30(27-10-4-2-5-11-27)28-12-6-3-7-13-28/h2-7,10-17,26,30H,8-9,18-24H2,1H3
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530n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Binding affinity for serotonin transporter using [125I]RTI-55


J Med Chem 43: 205-13 (2000)


BindingDB Entry DOI: 10.7270/Q2JH3MW0
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Homo sapiens (Human))
BDBM50080567
PNG
(CHEMBL121027 | N-(2-Benzhydryloxy-ethyl)-N'-[2-(4-...)
Show SMILES CN(CCOC(c1ccccc1)c1ccccc1)CCN(C)CCc1ccc(F)cc1
Show InChI InChI=1S/C27H33FN2O/c1-29(18-17-23-13-15-26(28)16-14-23)19-20-30(2)21-22-31-27(24-9-5-3-6-10-24)25-11-7-4-8-12-25/h3-16,27H,17-22H2,1-2H3
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550n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Inhibition of [125I]RTI-55 binding to serotonin transporter (SERT) expressed in HEK cells


J Med Chem 42: 3647-56 (1999)


Article DOI: 10.1021/jm990161h
BindingDB Entry DOI: 10.7270/Q2BG2PPJ
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Homo sapiens (Human))
BDBM50080572
PNG
(CHEMBL333667 | N-(2-{2-[Bis-(4-fluoro-phenyl)-meth...)
Show SMILES Fc1ccc(cc1)C(OCCNCCNC(=O)Cc1ccccc1)c1ccc(F)cc1
Show InChI InChI=1S/C25H26F2N2O2/c26-22-10-6-20(7-11-22)25(21-8-12-23(27)13-9-21)31-17-16-28-14-15-29-24(30)18-19-4-2-1-3-5-19/h1-13,25,28H,14-18H2,(H,29,30)
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556n/an/an/an/an/an/an/an/a



Massachusetts General Hospital

Curated by ChEMBL


Assay Description
Inhibition of [125I]RTI-55 binding to serotonin transporter (SERT) expressed in HEK cells


J Med Chem 42: 3647-56 (1999)


Article DOI: 10.1021/jm990161h
BindingDB Entry DOI: 10.7270/Q2BG2PPJ
More data for this
Ligand-Target Pair
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