Found 68 hits with Last Name = 'johnson ii' and Initial = 'em' Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
Sodium-dependent dopamine transporter
(Rattus norvegicus (rat)) | BDBM50118599
(4-(2-(bis(4-fluorophenyl)methoxy)ethyl)-1-(naphtha...)Show SMILES Fc1ccc(cc1)C(OCCC1CCN(Cc2ccc3ccccc3c2)CC1)c1ccc(F)cc1 Show InChI InChI=1S/C31H31F2NO/c32-29-11-7-26(8-12-29)31(27-9-13-30(33)14-10-27)35-20-17-23-15-18-34(19-16-23)22-24-5-6-25-3-1-2-4-28(25)21-24/h1-14,21,23,31H,15-20,22H2 | Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 0.700 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Affinity at rat dopamine transporter using [125I]-RTI-55 displacement. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Rattus norvegicus (rat)) | BDBM50126814
(1-(4-(trifluoromethyl)benzyl)-4-(2-(bis(4-fluoroph...)Show SMILES Fc1ccc(cc1)C(OCCC1CCN(Cc2ccc(cc2)C(F)(F)F)CC1)c1ccc(F)cc1 Show InChI InChI=1S/C28H28F5NO/c29-25-9-3-22(4-10-25)27(23-5-11-26(30)12-6-23)35-18-15-20-13-16-34(17-14-20)19-21-1-7-24(8-2-21)28(31,32)33/h1-12,20,27H,13-19H2 | Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Affinity at rat dopamine transporter using [125I]-RTI-55 displacement. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Rattus norvegicus (rat)) | BDBM50126823
(1-(4-bromobenzyl)-4-(2-(bis(4-fluorophenyl)methoxy...)Show SMILES Fc1ccc(cc1)C(OCCC1CCN(Cc2ccc(Br)cc2)CC1)c1ccc(F)cc1 Show InChI InChI=1S/C27H28BrF2NO/c28-24-7-1-21(2-8-24)19-31-16-13-20(14-17-31)15-18-32-27(22-3-9-25(29)10-4-22)23-5-11-26(30)12-6-23/h1-12,20,27H,13-19H2 | Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Affinity at rat dopamine transporter using [125I]-RTI-55 displacement. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Rattus norvegicus (rat)) | BDBM50126817
(4-((4-(2-(bis(4-fluorophenyl)methoxy)ethyl)piperid...)Show SMILES Fc1ccc(cc1)C(OCCC1CCN(Cc2ccc(cc2)C#N)CC1)c1ccc(F)cc1 Show InChI InChI=1S/C28H28F2N2O/c29-26-9-5-24(6-10-26)28(25-7-11-27(30)12-8-25)33-18-15-21-13-16-32(17-14-21)20-23-3-1-22(19-31)2-4-23/h1-12,21,28H,13-18,20H2 | Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Affinity at rat dopamine transporter using [125I]-RTI-55 displacement. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Rattus norvegicus (rat)) | BDBM50126813
(1-(4-chlorobenzyl)-4-(2-(bis(4-fluorophenyl)methox...)Show SMILES Fc1ccc(cc1)C(OCCC1CCN(Cc2ccc(Cl)cc2)CC1)c1ccc(F)cc1 Show InChI InChI=1S/C27H28ClF2NO/c28-24-7-1-21(2-8-24)19-31-16-13-20(14-17-31)15-18-32-27(22-3-9-25(29)10-4-22)23-5-11-26(30)12-6-23/h1-12,20,27H,13-19H2 | Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Affinity at rat dopamine transporter using [125I]-RTI-55 displacement. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Rattus norvegicus (rat)) | BDBM50126820
(1-(4-nitrobenzyl)-4-(2-(bis(4-fluorophenyl)methoxy...)Show SMILES [O-][N+](=O)c1ccc(CN2CCC(CCOC(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1 Show InChI InChI=1S/C27H28F2N2O3/c28-24-7-3-22(4-8-24)27(23-5-9-25(29)10-6-23)34-18-15-20-13-16-30(17-14-20)19-21-1-11-26(12-2-21)31(32)33/h1-12,20,27H,13-19H2 | Reactome pathway
KEGG
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Affinity at rat dopamine transporter using [125I]-RTI-55 displacement. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Rattus norvegicus (rat)) | BDBM50126815
(1-(4-iodobenzyl)-4-(2-(bis(4-fluorophenyl)methoxy)...)Show SMILES Fc1ccc(cc1)C(OCCC1CCN(Cc2ccc(I)cc2)CC1)c1ccc(F)cc1 Show InChI InChI=1S/C27H28F2INO/c28-24-7-3-22(4-8-24)27(23-5-9-25(29)10-6-23)32-18-15-20-13-16-31(17-14-20)19-21-1-11-26(30)12-2-21/h1-12,20,27H,13-19H2 | Reactome pathway
KEGG
UniProtKB/SwissProt
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Affinity at rat dopamine transporter using [125I]-RTI-55 displacement. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Rattus norvegicus (rat)) | BDBM50126822
(1-(4-fluorobenzyl)-4-(2-(bis(4-fluorophenyl)methox...)Show SMILES Fc1ccc(CN2CCC(CCOC(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1 Show InChI InChI=1S/C27H28F3NO/c28-24-7-1-21(2-8-24)19-31-16-13-20(14-17-31)15-18-32-27(22-3-9-25(29)10-4-22)23-5-11-26(30)12-6-23/h1-12,20,27H,13-19H2 | Reactome pathway
KEGG
UniProtKB/SwissProt
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.30 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Affinity at rat dopamine transporter using [125I]-RTI-55 displacement. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Rattus norvegicus (rat)) | BDBM50055882
(4-(2-Benzhydryloxy-ethyl)-1-(4-nitro-benzyl)-piper...)Show SMILES [O-][N+](=O)c1ccc(CN2CCC(CCOC(c3ccccc3)c3ccccc3)CC2)cc1 Show InChI InChI=1S/C27H30N2O3/c30-29(31)26-13-11-23(12-14-26)21-28-18-15-22(16-19-28)17-20-32-27(24-7-3-1-4-8-24)25-9-5-2-6-10-25/h1-14,22,27H,15-21H2 | Reactome pathway
KEGG
UniProtKB/SwissProt
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Affinity at rat dopamine transporter using [125I]-RTI-55 displacement. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Rattus norvegicus (rat)) | BDBM50055882
(4-(2-Benzhydryloxy-ethyl)-1-(4-nitro-benzyl)-piper...)Show SMILES [O-][N+](=O)c1ccc(CN2CCC(CCOC(c3ccccc3)c3ccccc3)CC2)cc1 Show InChI InChI=1S/C27H30N2O3/c30-29(31)26-13-11-23(12-14-26)21-28-18-15-22(16-19-28)17-20-32-27(24-7-3-1-4-8-24)25-9-5-2-6-10-25/h1-14,22,27H,15-21H2 | Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.70 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Inhibition of [3H]-dopamine uptake via rat dopamine receptor. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Rattus norvegicus (rat)) | BDBM50098405
(4-(2-Benzhydryloxy-ethyl)-1-(4-trifluoromethyl-ben...)Show SMILES FC(F)(F)c1ccc(CN2CCC(CCOC(c3ccccc3)c3ccccc3)CC2)cc1 Show InChI InChI=1S/C28H30F3NO/c29-28(30,31)26-13-11-23(12-14-26)21-32-18-15-22(16-19-32)17-20-33-27(24-7-3-1-4-8-24)25-9-5-2-6-10-25/h1-14,22,27H,15-21H2 | Reactome pathway
KEGG
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GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 3.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Affinity at rat dopamine transporter using [125I]-RTI-55 displacement. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Rattus norvegicus (rat)) | BDBM22165
(1-{2-[bis(4-fluorophenyl)methoxy]ethyl}-4-(3-pheny...)Show SMILES Fc1ccc(cc1)C(OCCN1CCN(CCCc2ccccc2)CC1)c1ccc(F)cc1 Show InChI InChI=1S/C28H32F2N2O/c29-26-12-8-24(9-13-26)28(25-10-14-27(30)15-11-25)33-22-21-32-19-17-31(18-20-32)16-4-7-23-5-2-1-3-6-23/h1-3,5-6,8-15,28H,4,7,16-22H2 | Reactome pathway
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CHEMBL
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PC cid
PC sid
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| Article
PubMed
| 3.70 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Affinity at rat dopamine transporter using [125I]-RTI-55 displacement. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Rattus norvegicus (rat)) | BDBM50055879
(4-(2-Benzhydryloxy-ethyl)-1-(4-chloro-benzyl)-pipe...)Show SMILES Clc1ccc(CN2CCC(CCOC(c3ccccc3)c3ccccc3)CC2)cc1 Show InChI InChI=1S/C27H30ClNO/c28-26-13-11-23(12-14-26)21-29-18-15-22(16-19-29)17-20-30-27(24-7-3-1-4-8-24)25-9-5-2-6-10-25/h1-14,22,27H,15-21H2 | Reactome pathway
KEGG
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 3.80 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Affinity at rat dopamine transporter using [125I]-RTI-55 displacement. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Rattus norvegicus (rat)) | BDBM50126822
(1-(4-fluorobenzyl)-4-(2-(bis(4-fluorophenyl)methox...)Show SMILES Fc1ccc(CN2CCC(CCOC(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1 Show InChI InChI=1S/C27H28F3NO/c28-24-7-1-21(2-8-24)19-31-16-13-20(14-17-31)15-18-32-27(22-3-9-25(29)10-4-22)23-5-11-26(30)12-6-23/h1-12,20,27H,13-19H2 | Reactome pathway
KEGG
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 3.80 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Inhibition of [3H]-dopamine uptake via rat dopamine receptor. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Rattus norvegicus (rat)) | BDBM22165
(1-{2-[bis(4-fluorophenyl)methoxy]ethyl}-4-(3-pheny...)Show SMILES Fc1ccc(cc1)C(OCCN1CCN(CCCc2ccccc2)CC1)c1ccc(F)cc1 Show InChI InChI=1S/C28H32F2N2O/c29-26-12-8-24(9-13-26)28(25-10-14-27(30)15-11-25)33-22-21-32-19-17-31(18-20-32)16-4-7-23-5-2-1-3-6-23/h1-3,5-6,8-15,28H,4,7,16-22H2 | Reactome pathway
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CHEMBL
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PC cid
PC sid
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Patents
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| Article
PubMed
| 4.30 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Inhibition of [3H]-dopamine uptake via rat dopamine receptor. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Rattus norvegicus (rat)) | BDBM50108815
(4-(2-Benzhydryloxy-ethyl)-1-(4-iodo-benzyl)-piperi...)Show SMILES Ic1ccc(CN2CCC(CCOC(c3ccccc3)c3ccccc3)CC2)cc1 Show InChI InChI=1S/C27H30INO/c28-26-13-11-23(12-14-26)21-29-18-15-22(16-19-29)17-20-30-27(24-7-3-1-4-8-24)25-9-5-2-6-10-25/h1-14,22,27H,15-21H2 | Reactome pathway
KEGG
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PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 5.10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Inhibition of [3H]-dopamine uptake via rat dopamine receptor. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Rattus norvegicus (rat)) | BDBM50055876
(4-(2-Benzhydryloxy-ethyl)-1-(4-fluoro-benzyl)-pipe...)Show SMILES Fc1ccc(CN2CCC(CCOC(c3ccccc3)c3ccccc3)CC2)cc1 Show InChI InChI=1S/C27H30FNO/c28-26-13-11-23(12-14-26)21-29-18-15-22(16-19-29)17-20-30-27(24-7-3-1-4-8-24)25-9-5-2-6-10-25/h1-14,22,27H,15-21H2 | Reactome pathway
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PC cid
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UniChem
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PubMed
| 5.10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Affinity at rat dopamine transporter using [125I]-RTI-55 displacement. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Rattus norvegicus (rat)) | BDBM50055871
(4-(2-Benzhydryloxy-ethyl)-1-(4-bromo-benzyl)-piper...)Show SMILES Brc1ccc(CN2CCC(CCOC(c3ccccc3)c3ccccc3)CC2)cc1 Show InChI InChI=1S/C27H30BrNO/c28-26-13-11-23(12-14-26)21-29-18-15-22(16-19-29)17-20-30-27(24-7-3-1-4-8-24)25-9-5-2-6-10-25/h1-14,22,27H,15-21H2 | Reactome pathway
KEGG
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PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 5.30 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Inhibition of [3H]-dopamine uptake via rat dopamine receptor. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Rattus norvegicus (rat)) | BDBM50126816
(4-{2-[Bis-(4-fluoro-phenyl)-methoxy]-ethyl}-1-(4-m...)Show SMILES Cc1ccc(CN2CCC(CCOC(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1 Show InChI InChI=1S/C28H31F2NO/c1-21-2-4-23(5-3-21)20-31-17-14-22(15-18-31)16-19-32-28(24-6-10-26(29)11-7-24)25-8-12-27(30)13-9-25/h2-13,22,28H,14-20H2,1H3 | Reactome pathway
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PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 5.70 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Affinity at rat dopamine transporter using [125I]-RTI-55 displacement. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Rattus norvegicus (rat)) | BDBM50098393
(4-[4-(2-Benzhydryloxy-ethyl)-piperidin-1-ylmethyl]...)Show SMILES N#Cc1ccc(CN2CCC(CCOC(c3ccccc3)c3ccccc3)CC2)cc1 Show InChI InChI=1S/C28H30N2O/c29-21-24-11-13-25(14-12-24)22-30-18-15-23(16-19-30)17-20-31-28(26-7-3-1-4-8-26)27-9-5-2-6-10-27/h1-14,23,28H,15-20,22H2 | Reactome pathway
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PC cid
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| Article
PubMed
| 5.70 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Affinity at rat dopamine transporter using [125I]-RTI-55 displacement. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Rattus norvegicus (rat)) | BDBM50055871
(4-(2-Benzhydryloxy-ethyl)-1-(4-bromo-benzyl)-piper...)Show SMILES Brc1ccc(CN2CCC(CCOC(c3ccccc3)c3ccccc3)CC2)cc1 Show InChI InChI=1S/C27H30BrNO/c28-26-13-11-23(12-14-26)21-29-18-15-22(16-19-29)17-20-30-27(24-7-3-1-4-8-24)25-9-5-2-6-10-25/h1-14,22,27H,15-21H2 | Reactome pathway
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PubMed
| 6.40 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Affinity at rat dopamine transporter using [125I]-RTI-55 displacement. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Rattus norvegicus (rat)) | BDBM50126820
(1-(4-nitrobenzyl)-4-(2-(bis(4-fluorophenyl)methoxy...)Show SMILES [O-][N+](=O)c1ccc(CN2CCC(CCOC(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1 Show InChI InChI=1S/C27H28F2N2O3/c28-24-7-3-22(4-8-24)27(23-5-9-25(29)10-6-23)34-18-15-20-13-16-30(17-14-20)19-21-1-11-26(12-2-21)31(32)33/h1-12,20,27H,13-19H2 | Reactome pathway
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| 6.90 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Inhibition of [3H]-dopamine uptake via rat dopamine receptor. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Rattus norvegicus (rat)) | BDBM50108815
(4-(2-Benzhydryloxy-ethyl)-1-(4-iodo-benzyl)-piperi...)Show SMILES Ic1ccc(CN2CCC(CCOC(c3ccccc3)c3ccccc3)CC2)cc1 Show InChI InChI=1S/C27H30INO/c28-26-13-11-23(12-14-26)21-29-18-15-22(16-19-29)17-20-30-27(24-7-3-1-4-8-24)25-9-5-2-6-10-25/h1-14,22,27H,15-21H2 | Reactome pathway
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| 7.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Affinity at rat dopamine transporter using [125I]-RTI-55 displacement. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Rattus norvegicus (rat)) | BDBM50118599
(4-(2-(bis(4-fluorophenyl)methoxy)ethyl)-1-(naphtha...)Show SMILES Fc1ccc(cc1)C(OCCC1CCN(Cc2ccc3ccccc3c2)CC1)c1ccc(F)cc1 Show InChI InChI=1S/C31H31F2NO/c32-29-11-7-26(8-12-29)31(27-9-13-30(33)14-10-27)35-20-17-23-15-18-34(19-16-23)22-24-5-6-25-3-1-2-4-28(25)21-24/h1-14,21,23,31H,15-20,22H2 | Reactome pathway
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| 7.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Inhibition of [3H]-dopamine uptake via rat dopamine receptor. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Rattus norvegicus (rat)) | BDBM50126819
(1-(4-methoxybenzyl)-4-(2-(bis(4-fluorophenyl)metho...)Show SMILES COc1ccc(CN2CCC(CCOC(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1 Show InChI InChI=1S/C28H31F2NO2/c1-32-27-12-2-22(3-13-27)20-31-17-14-21(15-18-31)16-19-33-28(23-4-8-25(29)9-5-23)24-6-10-26(30)11-7-24/h2-13,21,28H,14-20H2,1H3 | Reactome pathway
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| 7.90 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Affinity at rat dopamine transporter using [125I]-RTI-55 displacement. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Rattus norvegicus (rat)) | BDBM50049365
(1-Benzyl-4-{2-[bis-(4-fluoro-phenyl)-methoxy]-ethy...)Show SMILES Fc1ccc(cc1)C(OCCC1CCN(Cc2ccccc2)CC1)c1ccc(F)cc1 Show InChI InChI=1S/C27H29F2NO/c28-25-10-6-23(7-11-25)27(24-8-12-26(29)13-9-24)31-19-16-21-14-17-30(18-15-21)20-22-4-2-1-3-5-22/h1-13,21,27H,14-20H2 | Reactome pathway
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| 9.90 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Affinity at rat dopamine transporter using [125I]-RTI-55 displacement. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Rattus norvegicus (rat)) | BDBM50126818
(1-(3-methoxybenzyl)-4-(2-(bis(4-fluorophenyl)metho...)Show SMILES COc1cccc(CN2CCC(CCOC(c3ccc(F)cc3)c3ccc(F)cc3)CC2)c1 Show InChI InChI=1S/C28H31F2NO2/c1-32-27-4-2-3-22(19-27)20-31-16-13-21(14-17-31)15-18-33-28(23-5-9-25(29)10-6-23)24-7-11-26(30)12-8-24/h2-12,19,21,28H,13-18,20H2,1H3 | Reactome pathway
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| 13.3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Affinity at rat dopamine transporter using [125I]-RTI-55 displacement. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Rattus norvegicus (rat)) | BDBM50126815
(1-(4-iodobenzyl)-4-(2-(bis(4-fluorophenyl)methoxy)...)Show SMILES Fc1ccc(cc1)C(OCCC1CCN(Cc2ccc(I)cc2)CC1)c1ccc(F)cc1 Show InChI InChI=1S/C27H28F2INO/c28-24-7-3-22(4-8-24)27(23-5-9-25(29)10-6-23)32-18-15-20-13-16-31(17-14-20)19-21-1-11-26(30)12-2-21/h1-12,20,27H,13-19H2 | Reactome pathway
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| 13.6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Inhibition of [3H]-dopamine uptake via rat dopamine receptor. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Rattus norvegicus (rat)) | BDBM50118602
(4-(2-(bis(4-fluorophenyl)methoxy)ethyl)-1-(naphtha...)Show SMILES Fc1ccc(cc1)C(OCCC1CCN(Cc2cccc3ccccc23)CC1)c1ccc(F)cc1 Show InChI InChI=1S/C31H31F2NO/c32-28-12-8-25(9-13-28)31(26-10-14-29(33)15-11-26)35-21-18-23-16-19-34(20-17-23)22-27-6-3-5-24-4-1-2-7-30(24)27/h1-15,23,31H,16-22H2 | Reactome pathway
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| 16 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Affinity at rat dopamine transporter using [125I]-RTI-55 displacement. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Rattus norvegicus (rat)) | BDBM50126821
(1-(2-methoxybenzyl)-4-(2-(bis(4-fluorophenyl)metho...)Show SMILES COc1ccccc1CN1CCC(CCOC(c2ccc(F)cc2)c2ccc(F)cc2)CC1 Show InChI InChI=1S/C28H31F2NO2/c1-32-27-5-3-2-4-24(27)20-31-17-14-21(15-18-31)16-19-33-28(22-6-10-25(29)11-7-22)23-8-12-26(30)13-9-23/h2-13,21,28H,14-20H2,1H3 | Reactome pathway
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| 63 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Affinity at rat dopamine transporter using [125I]-RTI-55 displacement. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Rattus norvegicus (rat)) | BDBM22165
(1-{2-[bis(4-fluorophenyl)methoxy]ethyl}-4-(3-pheny...)Show SMILES Fc1ccc(cc1)C(OCCN1CCN(CCCc2ccccc2)CC1)c1ccc(F)cc1 Show InChI InChI=1S/C28H32F2N2O/c29-26-12-8-24(9-13-26)28(25-10-14-27(30)15-11-25)33-22-21-32-19-17-31(18-20-32)16-4-7-23-5-2-1-3-6-23/h1-3,5-6,8-15,28H,4,7,16-22H2 | PDB
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| 73 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Inhibition of [3H]-5-HT uptake at the rat serotonin transporter. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
Transporter
(Rattus norvegicus) | BDBM22165
(1-{2-[bis(4-fluorophenyl)methoxy]ethyl}-4-(3-pheny...)Show SMILES Fc1ccc(cc1)C(OCCN1CCN(CCCc2ccccc2)CC1)c1ccc(F)cc1 Show InChI InChI=1S/C28H32F2N2O/c29-26-12-8-24(9-13-26)28(25-10-14-27(30)15-11-25)33-22-21-32-19-17-31(18-20-32)16-4-7-23-5-2-1-3-6-23/h1-3,5-6,8-15,28H,4,7,16-22H2 | Reactome pathway
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| 79 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Inhibition of [3H]-norepinephrine uptake at the rat norepinephrine transporter. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Rattus norvegicus (rat)) | BDBM50118599
(4-(2-(bis(4-fluorophenyl)methoxy)ethyl)-1-(naphtha...)Show SMILES Fc1ccc(cc1)C(OCCC1CCN(Cc2ccc3ccccc3c2)CC1)c1ccc(F)cc1 Show InChI InChI=1S/C31H31F2NO/c32-29-11-7-26(8-12-29)31(27-9-13-30(33)14-10-27)35-20-17-23-15-18-34(19-16-23)22-24-5-6-25-3-1-2-4-28(25)21-24/h1-14,21,23,31H,15-20,22H2 | PDB
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| 88 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Affinity at rat serotonin transporter using [125I]-RTI-55 displacement. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
Transporter
(Rattus norvegicus) | BDBM50118599
(4-(2-(bis(4-fluorophenyl)methoxy)ethyl)-1-(naphtha...)Show SMILES Fc1ccc(cc1)C(OCCC1CCN(Cc2ccc3ccccc3c2)CC1)c1ccc(F)cc1 Show InChI InChI=1S/C31H31F2NO/c32-29-11-7-26(8-12-29)31(27-9-13-30(33)14-10-27)35-20-17-23-15-18-34(19-16-23)22-24-5-6-25-3-1-2-4-28(25)21-24/h1-14,21,23,31H,15-20,22H2 | Reactome pathway
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| 93 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Inhibition of [3H]-norepinephrine uptake at the rat norepinephrine transporter. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Rattus norvegicus (rat)) | BDBM22165
(1-{2-[bis(4-fluorophenyl)methoxy]ethyl}-4-(3-pheny...)Show SMILES Fc1ccc(cc1)C(OCCN1CCN(CCCc2ccccc2)CC1)c1ccc(F)cc1 Show InChI InChI=1S/C28H32F2N2O/c29-26-12-8-24(9-13-26)28(25-10-14-27(30)15-11-25)33-22-21-32-19-17-31(18-20-32)16-4-7-23-5-2-1-3-6-23/h1-3,5-6,8-15,28H,4,7,16-22H2 | PDB
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| 126 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Affinity at rat serotonin transporter using [125I]-RTI-55 displacement. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Rattus norvegicus (rat)) | BDBM50126818
(1-(3-methoxybenzyl)-4-(2-(bis(4-fluorophenyl)metho...)Show SMILES COc1cccc(CN2CCC(CCOC(c3ccc(F)cc3)c3ccc(F)cc3)CC2)c1 Show InChI InChI=1S/C28H31F2NO2/c1-32-27-4-2-3-22(19-27)20-31-16-13-21(14-17-31)15-18-33-28(23-5-9-25(29)10-6-23)24-7-11-26(30)12-8-24/h2-12,19,21,28H,13-18,20H2,1H3 | PDB
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| 161 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Affinity at rat serotonin transporter using [125I]-RTI-55 displacement. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Rattus norvegicus (rat)) | BDBM50049365
(1-Benzyl-4-{2-[bis-(4-fluoro-phenyl)-methoxy]-ethy...)Show SMILES Fc1ccc(cc1)C(OCCC1CCN(Cc2ccccc2)CC1)c1ccc(F)cc1 Show InChI InChI=1S/C27H29F2NO/c28-25-10-6-23(7-11-25)27(24-8-12-26(29)13-9-24)31-19-16-21-14-17-30(18-15-21)20-22-4-2-1-3-5-22/h1-13,21,27H,14-20H2 | PDB
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| 171 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Affinity at rat serotonin transporter using [125I]-RTI-55 displacement. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Rattus norvegicus (rat)) | BDBM50126823
(1-(4-bromobenzyl)-4-(2-(bis(4-fluorophenyl)methoxy...)Show SMILES Fc1ccc(cc1)C(OCCC1CCN(Cc2ccc(Br)cc2)CC1)c1ccc(F)cc1 Show InChI InChI=1S/C27H28BrF2NO/c28-24-7-1-21(2-8-24)19-31-16-13-20(14-17-31)15-18-32-27(22-3-9-25(29)10-4-22)23-5-11-26(30)12-6-23/h1-12,20,27H,13-19H2 | PDB
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| 199 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Affinity at rat serotonin transporter using [125I]-RTI-55 displacement. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Rattus norvegicus (rat)) | BDBM50126815
(1-(4-iodobenzyl)-4-(2-(bis(4-fluorophenyl)methoxy)...)Show SMILES Fc1ccc(cc1)C(OCCC1CCN(Cc2ccc(I)cc2)CC1)c1ccc(F)cc1 Show InChI InChI=1S/C27H28F2INO/c28-24-7-3-22(4-8-24)27(23-5-9-25(29)10-6-23)32-18-15-20-13-16-31(17-14-20)19-21-1-11-26(30)12-2-21/h1-12,20,27H,13-19H2 | PDB
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| 205 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Affinity at rat serotonin transporter using [125I]-RTI-55 displacement. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
Transporter
(Rattus norvegicus) | BDBM50055882
(4-(2-Benzhydryloxy-ethyl)-1-(4-nitro-benzyl)-piper...)Show SMILES [O-][N+](=O)c1ccc(CN2CCC(CCOC(c3ccccc3)c3ccccc3)CC2)cc1 Show InChI InChI=1S/C27H30N2O3/c30-29(31)26-13-11-23(12-14-26)21-28-18-15-22(16-19-28)17-20-32-27(24-7-3-1-4-8-24)25-9-5-2-6-10-25/h1-14,22,27H,15-21H2 | Reactome pathway
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| 208 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Inhibition of [3H]-norepinephrine uptake at the rat norepinephrine transporter. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Rattus norvegicus (rat)) | BDBM50118599
(4-(2-(bis(4-fluorophenyl)methoxy)ethyl)-1-(naphtha...)Show SMILES Fc1ccc(cc1)C(OCCC1CCN(Cc2ccc3ccccc3c2)CC1)c1ccc(F)cc1 Show InChI InChI=1S/C31H31F2NO/c32-29-11-7-26(8-12-29)31(27-9-13-30(33)14-10-27)35-20-17-23-15-18-34(19-16-23)22-24-5-6-25-3-1-2-4-28(25)21-24/h1-14,21,23,31H,15-20,22H2 | PDB
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PubMed
| 227 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Inhibition of [3H]-5-HT uptake at the rat serotonin transporter. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
Transporter
(Rattus norvegicus) | BDBM50126820
(1-(4-nitrobenzyl)-4-(2-(bis(4-fluorophenyl)methoxy...)Show SMILES [O-][N+](=O)c1ccc(CN2CCC(CCOC(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1 Show InChI InChI=1S/C27H28F2N2O3/c28-24-7-3-22(4-8-24)27(23-5-9-25(29)10-6-23)34-18-15-20-13-16-30(17-14-20)19-21-1-11-26(12-2-21)31(32)33/h1-12,20,27H,13-19H2 | Reactome pathway
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| 231 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Inhibition of [3H]-norepinephrine uptake at the rat norepinephrine transporter. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Rattus norvegicus (rat)) | BDBM50126813
(1-(4-chlorobenzyl)-4-(2-(bis(4-fluorophenyl)methox...)Show SMILES Fc1ccc(cc1)C(OCCC1CCN(Cc2ccc(Cl)cc2)CC1)c1ccc(F)cc1 Show InChI InChI=1S/C27H28ClF2NO/c28-24-7-1-21(2-8-24)19-31-16-13-20(14-17-31)15-18-32-27(22-3-9-25(29)10-4-22)23-5-11-26(30)12-6-23/h1-12,20,27H,13-19H2 | PDB
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| 238 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Affinity at rat serotonin transporter using [125I]-RTI-55 displacement. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Rattus norvegicus (rat)) | BDBM50126816
(4-{2-[Bis-(4-fluoro-phenyl)-methoxy]-ethyl}-1-(4-m...)Show SMILES Cc1ccc(CN2CCC(CCOC(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1 Show InChI InChI=1S/C28H31F2NO/c1-21-2-4-23(5-3-21)20-31-17-14-22(15-18-31)16-19-32-28(24-6-10-26(29)11-7-24)25-8-12-27(30)13-9-25/h2-13,22,28H,14-20H2,1H3 | PDB
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| 239 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Affinity at rat serotonin transporter using [125I]-RTI-55 displacement. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Rattus norvegicus (rat)) | BDBM50126822
(1-(4-fluorobenzyl)-4-(2-(bis(4-fluorophenyl)methox...)Show SMILES Fc1ccc(CN2CCC(CCOC(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1 Show InChI InChI=1S/C27H28F3NO/c28-24-7-1-21(2-8-24)19-31-16-13-20(14-17-31)15-18-32-27(22-3-9-25(29)10-4-22)23-5-11-26(30)12-6-23/h1-12,20,27H,13-19H2 | PDB
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| 245 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Affinity at rat serotonin transporter using [125I]-RTI-55 displacement. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Rattus norvegicus (rat)) | BDBM50126821
(1-(2-methoxybenzyl)-4-(2-(bis(4-fluorophenyl)metho...)Show SMILES COc1ccccc1CN1CCC(CCOC(c2ccc(F)cc2)c2ccc(F)cc2)CC1 Show InChI InChI=1S/C28H31F2NO2/c1-32-27-5-3-2-4-24(27)20-31-17-14-21(15-18-31)16-19-33-28(22-6-10-25(29)11-7-22)23-8-12-26(30)13-9-23/h2-13,21,28H,14-20H2,1H3 | PDB
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| 248 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Affinity at rat serotonin transporter using [125I]-RTI-55 displacement. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Rattus norvegicus (rat)) | BDBM50126819
(1-(4-methoxybenzyl)-4-(2-(bis(4-fluorophenyl)metho...)Show SMILES COc1ccc(CN2CCC(CCOC(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1 Show InChI InChI=1S/C28H31F2NO2/c1-32-27-12-2-22(3-13-27)20-31-17-14-21(15-18-31)16-19-33-28(23-4-8-25(29)9-5-23)24-6-10-26(30)11-7-24/h2-13,21,28H,14-20H2,1H3 | PDB
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| 266 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Affinity at rat serotonin transporter using [125I]-RTI-55 displacement. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Rattus norvegicus (rat)) | BDBM50118602
(4-(2-(bis(4-fluorophenyl)methoxy)ethyl)-1-(naphtha...)Show SMILES Fc1ccc(cc1)C(OCCC1CCN(Cc2cccc3ccccc23)CC1)c1ccc(F)cc1 Show InChI InChI=1S/C31H31F2NO/c32-28-12-8-25(9-13-28)31(26-10-14-29(33)15-11-26)35-21-18-23-16-19-34(20-17-23)22-27-6-3-5-24-4-1-2-7-30(24)27/h1-15,23,31H,16-22H2 | PDB
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| 370 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Affinity at rat serotonin transporter using [125I]-RTI-55 displacement. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Rattus norvegicus (rat)) | BDBM50126820
(1-(4-nitrobenzyl)-4-(2-(bis(4-fluorophenyl)methoxy...)Show SMILES [O-][N+](=O)c1ccc(CN2CCC(CCOC(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1 Show InChI InChI=1S/C27H28F2N2O3/c28-24-7-3-22(4-8-24)27(23-5-9-25(29)10-6-23)34-18-15-20-13-16-30(17-14-20)19-21-1-11-26(12-2-21)31(32)33/h1-12,20,27H,13-19H2 | PDB
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| 387 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Affinity at rat serotonin transporter using [125I]-RTI-55 displacement. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Rattus norvegicus (rat)) | BDBM50126814
(1-(4-(trifluoromethyl)benzyl)-4-(2-(bis(4-fluoroph...)Show SMILES Fc1ccc(cc1)C(OCCC1CCN(Cc2ccc(cc2)C(F)(F)F)CC1)c1ccc(F)cc1 Show InChI InChI=1S/C28H28F5NO/c29-25-9-3-22(4-10-25)27(23-5-11-26(30)12-6-23)35-18-15-20-13-16-34(17-14-20)19-21-1-7-24(8-2-21)28(31,32)33/h1-12,20,27H,13-19H2 | PDB
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| 442 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NIDDK
Curated by ChEMBL
| Assay Description
Affinity at rat serotonin transporter using [125I]-RTI-55 displacement. |
J Med Chem 46: 1465-9 (2003)
Article DOI: 10.1021/jm020419v
BindingDB Entry DOI: 10.7270/Q2WQ035D |
More data for this
Ligand-Target Pair | |
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