Found 134 hits of Enzyme Inhibition Constant Data 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
(Macaca fascicularis) | BDBM50197470
((1S,2S,3S,7R)-methyl 3-(3,4-dichlorophenyl)-7-hydr...)Show SMILES COC(=O)[C@@H]1[C@H]2[C@H](O)CC(C[C@@H]1c1ccc(Cl)c(Cl)c1)N2C |TLB:12:11:20:6.8,THB:7:6:20:4.11.10,2:4:20:6.8| Show InChI InChI=1S/C16H19Cl2NO3/c1-19-9-6-10(8-3-4-11(17)12(18)5-8)14(16(21)22-2)15(19)13(20)7-9/h3-5,9-10,13-15,20H,6-7H2,1-2H3/t9?,10-,13-,14+,15-/m1/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 0.300 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197437
((1R,2S,3R)-methyl 3-(3,4-dichlorophenyl)-8-methyl-...)Show SMILES COC(=O)[C@@H]1[C@H]2CCC(C[C@H]1c1ccc(Cl)c(Cl)c1)N2C |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C16H19Cl2NO2/c1-19-10-4-6-14(19)15(16(20)21-2)11(8-10)9-3-5-12(17)13(18)7-9/h3,5,7,10-11,14-15H,4,6,8H2,1-2H3/t10?,11-,14+,15-/m0/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 0.400 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197441
((1S,2S,3R,7R)-methyl 3-(3,4-dichlorophenyl)-7-hydr...)Show SMILES COC(=O)[C@@H]1[C@H]2[C@H](O)CC(C[C@H]1c1ccc(Cl)c(Cl)c1)N2C |TLB:12:11:20:6.8,THB:7:6:20:4.11.10,2:4:20:6.8| Show InChI InChI=1S/C16H19Cl2NO3/c1-19-9-6-10(8-3-4-11(17)12(18)5-8)14(16(21)22-2)15(19)13(20)7-9/h3-5,9-10,13-15,20H,6-7H2,1-2H3/t9?,10-,13+,14-,15+/m0/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 0.760 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197469
((1R,2S,3S)-methyl 3-(3,4-dichlorophenyl)-8-methyl-...)Show SMILES COC(=O)[C@@H]1[C@H]2CCC(C[C@@H]1c1ccc(Cl)c(Cl)c1)N2C |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C16H19Cl2NO2/c1-19-10-4-6-14(19)15(16(20)21-2)11(8-10)9-3-5-12(17)13(18)7-9/h3,5,7,10-11,14-15H,4,6,8H2,1-2H3/t10?,11-,14-,15+/m1/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| Purchase
CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1.10 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197452
((1R)-methyl 3-(3,4-dichlorophenyl)-8-methyl-8-aza-...)Show SMILES COC(=O)C1=C(CC2CC[C@H]1N2C)c1ccc(Cl)c(Cl)c1 |t:4,TLB:13:5:11:9.8,THB:2:4:11:9.8| Show InChI InChI=1S/C16H17Cl2NO2/c1-19-10-4-6-14(19)15(16(20)21-2)11(8-10)9-3-5-12(17)13(18)7-9/h3,5,7,10,14H,4,6,8H2,1-2H3/t10?,14-/m1/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.20 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197477
((1R)-2-beta-carbomethoxy-3-beta-(3,4-dichloropheny...)Show SMILES COC(=O)[C@@H]1[C@H]2CCC(C[C@@H]1c1ccc(Cl)c(Cl)c1)S2 |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C15H16Cl2O2S/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-11(16)12(17)6-8/h2,4,6,9-10,13-14H,3,5,7H2,1H3/t9?,10-,13-,14+/m1/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197456
((1R,2S,3R)-methyl 3-(3,4-dichlorophenyl)-8-oxa-bic...)Show SMILES COC(=O)[C@@H]1[C@H]2CCC(C[C@H]1c1ccc(Cl)c(Cl)c1)O2 |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C15H16Cl2O3/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-11(16)12(17)6-8/h2,4,6,9-10,13-14H,3,5,7H2,1H3/t9?,10-,13+,14-/m0/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.30 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197453
((1R)-2-carbomethoxy-3-(3,4-dichlorophenyl)-8-thiab...)Show SMILES COC(=O)C1=C(CC2CC[C@H]1S2)c1ccc(Cl)c(Cl)c1 |t:4,TLB:12:5:11:9.8,THB:2:4:11:9.8| Show InChI InChI=1S/C15H14Cl2O2S/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-11(16)12(17)6-8/h2,4,6,9,13H,3,5,7H2,1H3/t9?,13-/m1/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.5 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197469
((1R,2S,3S)-methyl 3-(3,4-dichlorophenyl)-8-methyl-...)Show SMILES COC(=O)[C@@H]1[C@H]2CCC(C[C@@H]1c1ccc(Cl)c(Cl)c1)N2C |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C16H19Cl2NO2/c1-19-10-4-6-14(19)15(16(20)21-2)11(8-10)9-3-5-12(17)13(18)7-9/h3,5,7,10-11,14-15H,4,6,8H2,1-2H3/t10?,11-,14-,15+/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| Purchase
CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 2.5 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197477
((1R)-2-beta-carbomethoxy-3-beta-(3,4-dichloropheny...)Show SMILES COC(=O)[C@@H]1[C@H]2CCC(C[C@@H]1c1ccc(Cl)c(Cl)c1)S2 |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C15H16Cl2O2S/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-11(16)12(17)6-8/h2,4,6,9-10,13-14H,3,5,7H2,1H3/t9?,10-,13-,14+/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197457
((2S,3R)-methyl 3-(3,4-dichlorophenyl)-8-oxa-bicycl...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@H]1c1ccc(Cl)c(Cl)c1)O2 |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C15H16Cl2O3/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-11(16)12(17)6-8/h2,4,6,9-10,13-14H,3,5,7H2,1H3/t9?,10-,13?,14-/m0/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.10 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197443
((1R,2S,3S)-methyl 3-(3,4-dichlorophenyl)-8-oxa-bic...)Show SMILES COC(=O)[C@@H]1[C@H]2CCC(C[C@@H]1c1ccc(Cl)c(Cl)c1)O2 |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C15H16Cl2O3/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-11(16)12(17)6-8/h2,4,6,9-10,13-14H,3,5,7H2,1H3/t9?,10-,13-,14+/m1/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.30 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197486
((2S,3S)-methyl 3-(3,4-dichlorophenyl)-8-oxa-bicycl...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(Cl)c(Cl)c1)O2 |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C15H16Cl2O3/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-11(16)12(17)6-8/h2,4,6,9-10,13-14H,3,5,7H2,1H3/t9?,10-,13?,14+/m1/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.30 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50156398
(2-carbomethoxy-3-(3,4-dichlorophenyl)-8-thiabicycl...)Show SMILES COC(=O)C1=C(CC2CCC1S2)c1ccc(Cl)c(Cl)c1 |t:4,THB:12:5:11:9.8,2:4:11:9.8| Show InChI InChI=1S/C15H14Cl2O2S/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-11(16)12(17)6-8/h2,4,6,9,13H,3,5,7H2,1H3 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.5 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197458
((1R)-methyl 3-(3,4-dichlorophenyl)-8-oxa-bicyclo[3...)Show SMILES COC(=O)C1=C(CC2CC[C@H]1O2)c1ccc(Cl)c(Cl)c1 |t:4,TLB:12:5:11:9.8,THB:2:4:11:9.8| Show InChI InChI=1S/C15H14Cl2O3/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-11(16)12(17)6-8/h2,4,6,9,13H,3,5,7H2,1H3/t9?,13-/m1/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.60 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197443
((1R,2S,3S)-methyl 3-(3,4-dichlorophenyl)-8-oxa-bic...)Show SMILES COC(=O)[C@@H]1[C@H]2CCC(C[C@@H]1c1ccc(Cl)c(Cl)c1)O2 |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C15H16Cl2O3/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-11(16)12(17)6-8/h2,4,6,9-10,13-14H,3,5,7H2,1H3/t9?,10-,13-,14+/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.70 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197460
((1R)-2-beta-carbomethoxy-3-alpha-(3,4-dichlorophen...)Show SMILES COC(=O)[C@@H]1[C@H]2CCC(C[C@H]1c1ccc(Cl)c(Cl)c1)S2 |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C15H16Cl2O2S/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-11(16)12(17)6-8/h2,4,6,9-10,13-14H,3,5,7H2,1H3/t9?,10-,13+,14-/m0/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.90 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197448
((1S)-2-carbomethoxy-3-(3,4-dichlorophenyl)-8-thiab...)Show SMILES COC(=O)C1=C(CC2CC[C@@H]1S2)c1ccc(Cl)c(Cl)c1 |t:4,TLB:12:5:11:9.8,THB:2:4:11:9.8| Show InChI InChI=1S/C15H14Cl2O2S/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-11(16)12(17)6-8/h2,4,6,9,13H,3,5,7H2,1H3/t9?,13-/m0/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 5 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197438
(2-beta-carbomethoxy-3-beta-(3,4-dichlorophenyl)-8-...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(Cl)c(Cl)c1)S2=O |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C15H16Cl2O3S/c1-20-15(18)14-10(7-9-3-5-13(14)21(9)19)8-2-4-11(16)12(17)6-8/h2,4,6,9-10,13-14H,3,5,7H2,1H3/t9?,10-,13?,14+,21?/m1/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 5.30 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197471
((2R,3S)-methyl 3-(3,4-dichlorophenyl)-8-thia-bicyc...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(Cl)c(Cl)c1)S2 |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C15H16Cl2O2S/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-11(16)12(17)6-8/h2,4,6,9-10,13-14H,3,5,7H2,1H3/t9?,10-,13?,14+/m1/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 5.70 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197462
(2-beta-carbomethoxy-3-beta-(4-bromophenyl)-8-thiab...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(Br)cc1)S2 |TLB:11:10:18:6.7,THB:2:4:18:6.7| Show InChI InChI=1S/C15H17BrO2S/c1-18-15(17)14-12(8-11-6-7-13(14)19-11)9-2-4-10(16)5-3-9/h2-5,11-14H,6-8H2,1H3/t11?,12-,13?,14+/m1/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197491
(2-beta-carbomethoxy-3-beta-(4-chloro-3-fluoropheny...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(Cl)c(F)c1)S2 |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C15H16ClFO2S/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-11(16)12(17)6-8/h2,4,6,9-10,13-14H,3,5,7H2,1H3/t9?,10-,13?,14+/m1/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197474
(2-beta-carbomethoxy-3-alpha-(4-bromophenyl)-8-thia...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@H]1c1ccc(Br)cc1)S2 |TLB:11:10:18:6.7,THB:2:4:18:6.7| Show InChI InChI=1S/C15H17BrO2S/c1-18-15(17)14-12(8-11-6-7-13(14)19-11)9-2-4-10(16)5-3-9/h2-5,11-14H,6-8H2,1H3/t11?,12-,13?,14-/m0/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197486
((2S,3S)-methyl 3-(3,4-dichlorophenyl)-8-oxa-bicycl...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(Cl)c(Cl)c1)O2 |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C15H16Cl2O3/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-11(16)12(17)6-8/h2,4,6,9-10,13-14H,3,5,7H2,1H3/t9?,10-,13?,14+/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6.5 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197449
(2-beta-carbomethoxy-3-beta-(3-chloro-4-fluoropheny...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(F)c(Cl)c1)S2 |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C15H16ClFO2S/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-12(17)11(16)6-8/h2,4,6,9-10,13-14H,3,5,7H2,1H3/t9?,10-,13?,14+/m1/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6.70 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50156395
(2-carbomethoxy-3-(4-iodophenyl)-8-thiabicyclo-[3.2...)Show SMILES COC(=O)C1=C(CC2CCC1S2)c1ccc(I)cc1 |t:4,THB:2:4:11:9.8,12:5:11:9.8| Show InChI InChI=1S/C15H15IO2S/c1-18-15(17)14-12(8-11-6-7-13(14)19-11)9-2-4-10(16)5-3-9/h2-5,11,13H,6-8H2,1H3 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6.70 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197440
(2-beta-carbomethoxy-3-alpha-(3,4-dichlorophenyl)-8...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@H]1c1ccc(Cl)c(Cl)c1)S2 |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C15H16Cl2O2S/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-11(16)12(17)6-8/h2,4,6,9-10,13-14H,3,5,7H2,1H3/t9?,10-,13?,14-/m0/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6.90 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197447
(2-beta-carbomethoxy-3-alpha-(4-chloro-3-fluorophen...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@H]1c1ccc(Cl)c(F)c1)S2 |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C15H16ClFO2S/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-11(16)12(17)6-8/h2,4,6,9-10,13-14H,3,5,7H2,1H3/t9?,10-,13?,14-/m0/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 7 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197450
(2-beta-carbomethoxy-3-alpha-(3-chloro-4-fluorophen...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@H]1c1ccc(F)c(Cl)c1)S2 |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C15H16ClFO2S/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-12(17)11(16)6-8/h2,4,6,9-10,13-14H,3,5,7H2,1H3/t9?,10-,13?,14-/m0/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 7.10 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50076048
((1R/1S)-methyl 3-(3,4-dichlorophenyl)bicyclo[3.2.1...)Show SMILES COC(=O)C1=C(CC2CCC1C2)c1ccc(Cl)c(Cl)c1 |t:4,TLB:12:5:11:9.8,THB:2:4:11:9.8| Show InChI InChI=1S/C16H16Cl2O2/c1-20-16(19)15-11-3-2-9(6-11)7-12(15)10-4-5-13(17)14(18)8-10/h4-5,8-9,11H,2-3,6-7H2,1H3 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 7.10 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197476
((1S,7R)-methyl 3-(3,4-dichlorophenyl)-7-hydroxy-8-...)Show SMILES COC(=O)C1=C(CC2C[C@@H](O)[C@H]1N2C)c1ccc(Cl)c(Cl)c1 |t:4,TLB:14:5:12:9.8,THB:10:9:12:4.5.6,2:4:12:9.8| Show InChI InChI=1S/C16H17Cl2NO3/c1-19-9-6-10(8-3-4-11(17)12(18)5-8)14(16(21)22-2)15(19)13(20)7-9/h3-5,9,13,15,20H,6-7H2,1-2H3/t9?,13-,15-/m1/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 7.40 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197490
(2-carbomethoxy-3-(3-chloro-4-fluorophenyl)-8-thiab...)Show SMILES COC(=O)C1=C(CC2CCC1S2)c1ccc(F)c(Cl)c1 |t:4,TLB:12:5:11:9.8,THB:2:4:11:9.8| Show InChI InChI=1S/C15H14ClFO2S/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-12(17)11(16)6-8/h2,4,6,9,13H,3,5,7H2,1H3 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 7.60 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197446
(2-beta-carbomethoxy-3-alpha-(3,4-dichlorophenyl)-8...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@H]1c1ccc(Cl)c(Cl)c1)S2=O |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C15H16Cl2O3S/c1-20-15(18)14-10(7-9-3-5-13(14)21(9)19)8-2-4-11(16)12(17)6-8/h2,4,6,9-10,13-14H,3,5,7H2,1H3/t9?,10-,13?,14-,21?/m0/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 7.80 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197492
(2-beta-carbomethoxy-3-alpha-(2-naphthyl)-8-thiabic...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@H]1c1ccc3ccccc3c1)S2 |TLB:11:10:21:6.7,THB:2:4:21:6.7| Show InChI InChI=1S/C19H20O2S/c1-21-19(20)18-16(11-15-8-9-17(18)22-15)14-7-6-12-4-2-3-5-13(12)10-14/h2-7,10,15-18H,8-9,11H2,1H3/t15?,16-,17?,18-/m0/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 8 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197471
((2R,3S)-methyl 3-(3,4-dichlorophenyl)-8-thia-bicyc...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(Cl)c(Cl)c1)S2 |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C15H16Cl2O2S/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-11(16)12(17)6-8/h2,4,6,9-10,13-14H,3,5,7H2,1H3/t9?,10-,13?,14+/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 8 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50156401
(2-carbomethoxy-3-(2-naphthyl)-8-thiabicyclo-[3.2.1...)Show SMILES COC(=O)C1=C(CC2CCC1S2)c1ccc2ccccc2c1 |t:4,THB:12:5:11:9.8,2:4:11:9.8| Show InChI InChI=1S/C19H18O2S/c1-21-19(20)18-16(11-15-8-9-17(18)22-15)14-7-6-12-4-2-3-5-13(12)10-14/h2-7,10,15,17H,8-9,11H2,1H3 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 8 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197451
(2-beta-carbomethoxy-3-alpha-(4-iodophenyl)-8-thiab...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@H]1c1ccc(I)cc1)S2 |TLB:11:10:18:6.7,THB:2:4:18:6.7| Show InChI InChI=1S/C15H17IO2S/c1-18-15(17)14-12(8-11-6-7-13(14)19-11)9-2-4-10(16)5-3-9/h2-5,11-14H,6-8H2,1H3/t11?,12-,13?,14-/m0/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 9 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50156391
(2-carbomethoxy-3-(4-bromophenyl)-8-thiabicyclo-[3....)Show SMILES COC(=O)C1=C(CC2CCC1S2)c1ccc(Br)cc1 |t:4,THB:2:4:11:9.8,12:5:11:9.8| Show InChI InChI=1S/C15H15BrO2S/c1-18-15(17)14-12(8-11-6-7-13(14)19-11)9-2-4-10(16)5-3-9/h2-5,11,13H,6-8H2,1H3 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 9.10 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197445
(2-beta-carbomethoxy-3-beta-(4-chlorophenyl)-8-thia...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(Cl)cc1)S2 |TLB:11:10:18:6.7,THB:2:4:18:6.7| Show InChI InChI=1S/C15H17ClO2S/c1-18-15(17)14-12(8-11-6-7-13(14)19-11)9-2-4-10(16)5-3-9/h2-5,11-14H,6-8H2,1H3/t11?,12-,13?,14+/m1/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 9.60 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197436
((2R,3S)-methyl 3-(3,4-dichlorophenyl)bicyclo[3.2.1...)Show SMILES COC(=O)[C@@H]1C2CCC(C2)C[C@@H]1c1ccc(Cl)c(Cl)c1 |TLB:12:11:9:6.7,THB:2:4:9:6.7| Show InChI InChI=1S/C16H18Cl2O2/c1-20-16(19)15-11-3-2-9(6-11)7-12(15)10-4-5-13(17)14(18)8-10/h4-5,8-9,11-12,15H,2-3,6-7H2,1H3/t9?,11?,12-,15-/m1/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 9.60 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197466
(2-carbomethoxy-3-(4-chloro-3-fluorophenyl)-8-thiab...)Show SMILES COC(=O)C1=C(CC2CCC1S2)c1ccc(Cl)c(F)c1 |t:4,TLB:12:5:11:9.8,THB:2:4:11:9.8| Show InChI InChI=1S/C15H14ClFO2S/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-11(16)12(17)6-8/h2,4,6,9,13H,3,5,7H2,1H3 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197444
((1S)-2-beta-carbomethoxy-3-alpha-(3,4-dichlorophen...)Show SMILES COC(=O)[C@@H]1[C@@H]2CCC(C[C@H]1c1ccc(Cl)c(Cl)c1)S2 |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C15H16Cl2O2S/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-11(16)12(17)6-8/h2,4,6,9-10,13-14H,3,5,7H2,1H3/t9?,10-,13-,14-/m0/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50076047
((1R/1S)-methyl 3-(3,4-dichlorophenyl)-8-oxa-bicycl...)Show SMILES COC(=O)C1=C(CC2CCC1O2)c1ccc(Cl)c(Cl)c1 |t:4,THB:12:5:11:9.8,2:4:11:9.8| Show InChI InChI=1S/C15H14Cl2O3/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-11(16)12(17)6-8/h2,4,6,9,13H,3,5,7H2,1H3 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197481
(2-beta-carbomethoxy-3-beta-(4-iodophenyl)-8-thiabi...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(I)cc1)S2 |TLB:11:10:18:6.7,THB:2:4:18:6.7| Show InChI InChI=1S/C15H17IO2S/c1-18-15(17)14-12(8-11-6-7-13(14)19-11)9-2-4-10(16)5-3-9/h2-5,11-14H,6-8H2,1H3/t11?,12-,13?,14+/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197465
(2-beta-carbomethoxy-3alpha-(4-chlorophenyl)-8-thia...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@H]1c1ccc(Cl)cc1)S2 |TLB:11:10:18:6.7,THB:2:4:18:6.7| Show InChI InChI=1S/C15H17ClO2S/c1-18-15(17)14-12(8-11-6-7-13(14)19-11)9-2-4-10(16)5-3-9/h2-5,11-14H,6-8H2,1H3/t11?,12-,13?,14-/m0/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 11 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197488
(2-beta-carbomethoxy-3-alpha-(3,4-difluorophenyl)-8...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@H]1c1ccc(F)c(F)c1)S2 |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C15H16F2O2S/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-11(16)12(17)6-8/h2,4,6,9-10,13-14H,3,5,7H2,1H3/t9?,10-,13?,14-/m0/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 11.3 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50156390
(2-carbomethoxy-3-(4-chlorophenyl)-8-thiabicyclo-[3...)Show SMILES COC(=O)C1=C(CC2CCC1S2)c1ccc(Cl)cc1 |t:4,THB:2:4:11:9.8,12:5:11:9.8| Show InChI InChI=1S/C15H15ClO2S/c1-18-15(17)14-12(8-11-6-7-13(14)19-11)9-2-4-10(16)5-3-9/h2-5,11,13H,6-8H2,1H3 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 13 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197439
(2-beta-carbomethoxy-3-beta-(2-naphthyl)-8-thiabicy...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc3ccccc3c1)S2 |TLB:11:10:21:6.7,THB:2:4:21:6.7| Show InChI InChI=1S/C19H20O2S/c1-21-19(20)18-16(11-15-8-9-17(18)22-15)14-7-6-12-4-2-3-5-13(12)10-14/h2-7,10,15-18H,8-9,11H2,1H3/t15?,16-,17?,18+/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 13 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197472
((2R,3R)-methyl 3-(3,4-dichlorophenyl)bicyclo[3.2.1...)Show SMILES COC(=O)[C@@H]1C2CCC(C2)C[C@H]1c1ccc(Cl)c(Cl)c1 |TLB:12:11:9:6.7,THB:2:4:9:6.7| Show InChI InChI=1S/C16H18Cl2O2/c1-20-16(19)15-11-3-2-9(6-11)7-12(15)10-4-5-13(17)14(18)8-10/h4-5,8-9,11-12,15H,2-3,6-7H2,1H3/t9?,11?,12-,15+/m0/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 13 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197455
(2-beta-carbomethoxy-3-alpha-(4-bromophenyl)-8-oxo-...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@H]1c1ccc(Br)cc1)S2=O |TLB:11:10:18:6.7,THB:2:4:18:6.7| Show InChI InChI=1S/C15H17BrO3S/c1-19-15(17)14-12(9-2-4-10(16)5-3-9)8-11-6-7-13(14)20(11)18/h2-5,11-14H,6-8H2,1H3/t11?,12-,13?,14-,20?/m0/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 14 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197468
(2-beta-carbomethoxy-3-beta-(4-chloro-3-fluoropheny...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(Cl)c(F)c1)S2=O |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C15H16ClFO3S/c1-20-15(18)14-10(7-9-3-5-13(14)21(9)19)8-2-4-11(16)12(17)6-8/h2,4,6,9-10,13-14H,3,5,7H2,1H3/t9?,10-,13?,14+,21?/m1/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 14 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197481
(2-beta-carbomethoxy-3-beta-(4-iodophenyl)-8-thiabi...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(I)cc1)S2 |TLB:11:10:18:6.7,THB:2:4:18:6.7| Show InChI InChI=1S/C15H17IO2S/c1-18-15(17)14-12(8-11-6-7-13(14)19-11)9-2-4-10(16)5-3-9/h2-5,11-14H,6-8H2,1H3/t11?,12-,13?,14+/m1/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 14 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197462
(2-beta-carbomethoxy-3-beta-(4-bromophenyl)-8-thiab...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(Br)cc1)S2 |TLB:11:10:18:6.7,THB:2:4:18:6.7| Show InChI InChI=1S/C15H17BrO2S/c1-18-15(17)14-12(8-11-6-7-13(14)19-11)9-2-4-10(16)5-3-9/h2-5,11-14H,6-8H2,1H3/t11?,12-,13?,14+/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 14 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197470
((1S,2S,3S,7R)-methyl 3-(3,4-dichlorophenyl)-7-hydr...)Show SMILES COC(=O)[C@@H]1[C@H]2[C@H](O)CC(C[C@@H]1c1ccc(Cl)c(Cl)c1)N2C |TLB:12:11:20:6.8,THB:7:6:20:4.11.10,2:4:20:6.8| Show InChI InChI=1S/C16H19Cl2NO3/c1-19-9-6-10(8-3-4-11(17)12(18)5-8)14(16(21)22-2)15(19)13(20)7-9/h3-5,9-10,13-15,20H,6-7H2,1-2H3/t9?,10-,13-,14+,15-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 15 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197439
(2-beta-carbomethoxy-3-beta-(2-naphthyl)-8-thiabicy...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc3ccccc3c1)S2 |TLB:11:10:21:6.7,THB:2:4:21:6.7| Show InChI InChI=1S/C19H20O2S/c1-21-19(20)18-16(11-15-8-9-17(18)22-15)14-7-6-12-4-2-3-5-13(12)10-14/h2-7,10,15-18H,8-9,11H2,1H3/t15?,16-,17?,18+/m1/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 16 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197491
(2-beta-carbomethoxy-3-beta-(4-chloro-3-fluoropheny...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(Cl)c(F)c1)S2 |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C15H16ClFO2S/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-11(16)12(17)6-8/h2,4,6,9-10,13-14H,3,5,7H2,1H3/t9?,10-,13?,14+/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 17 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197442
(2-beta-carbomethoxy-3-alpha-(4-chloro-3-fluorophen...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@H]1c1ccc(Cl)c(F)c1)S2=O |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C15H16ClFO3S/c1-20-15(18)14-10(7-9-3-5-13(14)21(9)19)8-2-4-11(16)12(17)6-8/h2,4,6,9-10,13-14H,3,5,7H2,1H3/t9?,10-,13?,14-,21?/m0/s1 | KEGG
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UniChem
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| n/a | n/a | 17 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197464
((1R)-2-beta-carbomethoxy-3-beta-(3,4-dichloropheny...)Show SMILES COC(=O)[C@@H]1[C@@H]2CCC(C[C@@H]1c1ccc(Cl)c(Cl)c1)S2 |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C15H16Cl2O2S/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-11(16)12(17)6-8/h2,4,6,9-10,13-14H,3,5,7H2,1H3/t9?,10-,13+,14+/m1/s1 | KEGG
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UniChem
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| Article
PubMed
| n/a | n/a | 22 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197475
(2-beta-carbomethoxy-3-alpha-(3-chloro-4-fluorophen...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@H]1c1ccc(F)c(Cl)c1)S2=O |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C15H16ClFO3S/c1-20-15(18)14-10(7-9-3-5-13(14)21(9)19)8-2-4-12(17)11(16)6-8/h2,4,6,9-10,13-14H,3,5,7H2,1H3/t9?,10-,13?,14-,21?/m0/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 23 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197437
((1R,2S,3R)-methyl 3-(3,4-dichlorophenyl)-8-methyl-...)Show SMILES COC(=O)[C@@H]1[C@H]2CCC(C[C@H]1c1ccc(Cl)c(Cl)c1)N2C |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C16H19Cl2NO2/c1-19-10-4-6-14(19)15(16(20)21-2)11(8-10)9-3-5-12(17)13(18)7-9/h3,5,7,10-11,14-15H,4,6,8H2,1-2H3/t10?,11-,14+,15-/m0/s1 | PDB
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UniChem
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PubMed
| n/a | n/a | 27 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197456
((1R,2S,3R)-methyl 3-(3,4-dichlorophenyl)-8-oxa-bic...)Show SMILES COC(=O)[C@@H]1[C@H]2CCC(C[C@H]1c1ccc(Cl)c(Cl)c1)O2 |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C15H16Cl2O3/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-11(16)12(17)6-8/h2,4,6,9-10,13-14H,3,5,7H2,1H3/t9?,10-,13+,14-/m0/s1 | PDB
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UniChem
Similars
| Article
PubMed
| n/a | n/a | 31 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197484
(2-beta-carbomethoxy-3-beta-(3,4-difluorophenyl)-8-...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(F)c(F)c1)S2 |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C15H16F2O2S/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-11(16)12(17)6-8/h2,4,6,9-10,13-14H,3,5,7H2,1H3/t9?,10-,13?,14+/m1/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 32 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197445
(2-beta-carbomethoxy-3-beta-(4-chlorophenyl)-8-thia...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(Cl)cc1)S2 |TLB:11:10:18:6.7,THB:2:4:18:6.7| Show InChI InChI=1S/C15H17ClO2S/c1-18-15(17)14-12(8-11-6-7-13(14)19-11)9-2-4-10(16)5-3-9/h2-5,11-14H,6-8H2,1H3/t11?,12-,13?,14+/m1/s1 | PDB
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UniChem
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| Article
PubMed
| n/a | n/a | 33 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197436
((2R,3S)-methyl 3-(3,4-dichlorophenyl)bicyclo[3.2.1...)Show SMILES COC(=O)[C@@H]1C2CCC(C2)C[C@@H]1c1ccc(Cl)c(Cl)c1 |TLB:12:11:9:6.7,THB:2:4:9:6.7| Show InChI InChI=1S/C16H18Cl2O2/c1-20-16(19)15-11-3-2-9(6-11)7-12(15)10-4-5-13(17)14(18)8-10/h4-5,8-9,11-12,15H,2-3,6-7H2,1H3/t9?,11?,12-,15-/m1/s1 | PDB
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UniChem
Similars
| Article
PubMed
| n/a | n/a | 33 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197492
(2-beta-carbomethoxy-3-alpha-(2-naphthyl)-8-thiabic...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@H]1c1ccc3ccccc3c1)S2 |TLB:11:10:21:6.7,THB:2:4:21:6.7| Show InChI InChI=1S/C19H20O2S/c1-21-19(20)18-16(11-15-8-9-17(18)22-15)14-7-6-12-4-2-3-5-13(12)10-14/h2-7,10,15-18H,8-9,11H2,1H3/t15?,16-,17?,18-/m0/s1 | PDB
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UniChem
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| Article
PubMed
| n/a | n/a | 36 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197483
(2-beta-carbomethoxy-3-beta-(4-fluorophenyl)-8-thia...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(F)cc1)S2 |TLB:11:10:18:6.7,THB:2:4:18:6.7| Show InChI InChI=1S/C15H17FO2S/c1-18-15(17)14-12(8-11-6-7-13(14)19-11)9-2-4-10(16)5-3-9/h2-5,11-14H,6-8H2,1H3/t11?,12-,13?,14+/m1/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 38 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197460
((1R)-2-beta-carbomethoxy-3-alpha-(3,4-dichlorophen...)Show SMILES COC(=O)[C@@H]1[C@H]2CCC(C[C@H]1c1ccc(Cl)c(Cl)c1)S2 |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C15H16Cl2O2S/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-11(16)12(17)6-8/h2,4,6,9-10,13-14H,3,5,7H2,1H3/t9?,10-,13+,14-/m0/s1 | PDB
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UniChem
Similars
| Article
PubMed
| n/a | n/a | 39 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197463
((1S,2S,3S)-methyl 3-(3,4-dichlorophenyl)-8-oxa-bic...)Show SMILES COC(=O)[C@@H]1[C@@H]2CCC(C[C@@H]1c1ccc(Cl)c(Cl)c1)O2 |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C15H16Cl2O3/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-11(16)12(17)6-8/h2,4,6,9-10,13-14H,3,5,7H2,1H3/t9?,10-,13+,14+/m1/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 47 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197485
((1S,2S,3R)-methyl 3-(3,4-dichlorophenyl)-8-oxa-bic...)Show SMILES COC(=O)[C@@H]1[C@@H]2CCC(C[C@H]1c1ccc(Cl)c(Cl)c1)O2 |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C15H16Cl2O3/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-11(16)12(17)6-8/h2,4,6,9-10,13-14H,3,5,7H2,1H3/t9?,10-,13-,14-/m0/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 56 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197463
((1S,2S,3S)-methyl 3-(3,4-dichlorophenyl)-8-oxa-bic...)Show SMILES COC(=O)[C@@H]1[C@@H]2CCC(C[C@@H]1c1ccc(Cl)c(Cl)c1)O2 |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C15H16Cl2O3/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-11(16)12(17)6-8/h2,4,6,9-10,13-14H,3,5,7H2,1H3/t9?,10-,13+,14+/m1/s1 | PDB
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| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 58 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197487
((1S)-methyl 3-(3,4-dichlorophenyl)-8-oxa-bicyclo[3...)Show SMILES COC(=O)C1=C(CC2CC[C@@H]1O2)c1ccc(Cl)c(Cl)c1 |t:4,TLB:12:5:11:9.8,THB:2:4:11:9.8| Show InChI InChI=1S/C15H14Cl2O3/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-11(16)12(17)6-8/h2,4,6,9,13H,3,5,7H2,1H3/t9?,13-/m0/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 58 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197479
(2-beta-carbomethoxy-3-alpha-(4-fluorophenyl)-8-thi...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@H]1c1ccc(F)cc1)S2 |TLB:11:10:18:6.7,THB:2:4:18:6.7| Show InChI InChI=1S/C15H17FO2S/c1-18-15(17)14-12(8-11-6-7-13(14)19-11)9-2-4-10(16)5-3-9/h2-5,11-14H,6-8H2,1H3/t11?,12-,13?,14-/m0/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 59 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197457
((2S,3R)-methyl 3-(3,4-dichlorophenyl)-8-oxa-bicycl...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@H]1c1ccc(Cl)c(Cl)c1)O2 |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C15H16Cl2O3/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-11(16)12(17)6-8/h2,4,6,9-10,13-14H,3,5,7H2,1H3/t9?,10-,13?,14-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 64.5 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197451
(2-beta-carbomethoxy-3-alpha-(4-iodophenyl)-8-thiab...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@H]1c1ccc(I)cc1)S2 |TLB:11:10:18:6.7,THB:2:4:18:6.7| Show InChI InChI=1S/C15H17IO2S/c1-18-15(17)14-12(8-11-6-7-13(14)19-11)9-2-4-10(16)5-3-9/h2-5,11-14H,6-8H2,1H3/t11?,12-,13?,14-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 70 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197489
(2-carbomethoxy-3-(3,4-difluorophenyl)-8-thiabicycl...)Show SMILES COC(=O)C1=C(CC2CCC1S2)c1ccc(F)c(F)c1 |t:4,TLB:12:5:11:9.8,THB:2:4:11:9.8| Show InChI InChI=1S/C15H14F2O2S/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-11(16)12(17)6-8/h2,4,6,9,13H,3,5,7H2,1H3 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 75 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197482
(2-beta-carbomethoxy-3-alpha-(3,4-difluorophenyl)-8...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@H]1c1ccc(F)c(F)c1)S2=O |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C15H16F2O3S/c1-20-15(18)14-10(7-9-3-5-13(14)21(9)19)8-2-4-11(16)12(17)6-8/h2,4,6,9-10,13-14H,3,5,7H2,1H3/t9?,10-,13?,14-,21?/m0/s1 | KEGG
UniProtKB/SwissProt
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PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 89 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197464
((1R)-2-beta-carbomethoxy-3-beta-(3,4-dichloropheny...)Show SMILES COC(=O)[C@@H]1[C@@H]2CCC(C[C@@H]1c1ccc(Cl)c(Cl)c1)S2 |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C15H16Cl2O2S/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-11(16)12(17)6-8/h2,4,6,9-10,13-14H,3,5,7H2,1H3/t9?,10-,13+,14+/m1/s1 | PDB
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UniChem
Similars
| Article
PubMed
| n/a | n/a | 90 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197440
(2-beta-carbomethoxy-3-alpha-(3,4-dichlorophenyl)-8...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@H]1c1ccc(Cl)c(Cl)c1)S2 |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C15H16Cl2O2S/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-11(16)12(17)6-8/h2,4,6,9-10,13-14H,3,5,7H2,1H3/t9?,10-,13?,14-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
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PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 99 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197493
(2-beta-carbomethoxy-3-beta-phenyl-8-thiabicyclo[3....)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccccc1)S2 |TLB:11:10:17:6.7,THB:2:4:17:6.7| Show InChI InChI=1S/C15H18O2S/c1-17-15(16)14-12(10-5-3-2-4-6-10)9-11-7-8-13(14)18-11/h2-6,11-14H,7-9H2,1H3/t11?,12-,13?,14+/m1/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 117 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197438
(2-beta-carbomethoxy-3-beta-(3,4-dichlorophenyl)-8-...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(Cl)c(Cl)c1)S2=O |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C15H16Cl2O3S/c1-20-15(18)14-10(7-9-3-5-13(14)21(9)19)8-2-4-11(16)12(17)6-8/h2,4,6,9-10,13-14H,3,5,7H2,1H3/t9?,10-,13?,14+,21?/m1/s1 | PDB
KEGG
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PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 120 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197459
((1R,2S,3S,7R)-methyl 3-(3,4-dichlorophenyl)-7-hydr...)Show SMILES COC(=O)[C@@H]1[C@@H]2[C@H](O)CC(C[C@@H]1c1ccc(Cl)c(Cl)c1)N2C |TLB:12:11:20:6.8,THB:7:6:20:4.11.10,2:4:20:6.8| Show InChI InChI=1S/C16H19Cl2NO3/c1-19-9-6-10(8-3-4-11(17)12(18)5-8)14(16(21)22-2)15(19)13(20)7-9/h3-5,9-10,13-15,20H,6-7H2,1-2H3/t9?,10-,13-,14+,15+/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
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PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 139 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197444
((1S)-2-beta-carbomethoxy-3-alpha-(3,4-dichlorophen...)Show SMILES COC(=O)[C@@H]1[C@@H]2CCC(C[C@H]1c1ccc(Cl)c(Cl)c1)S2 |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C15H16Cl2O2S/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-11(16)12(17)6-8/h2,4,6,9-10,13-14H,3,5,7H2,1H3/t9?,10-,13-,14-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
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PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 139 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197454
(2-beta-carbomethoxy-3-alpha-phenyl-8-thiabicyclo[3...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@H]1c1ccccc1)S2 |TLB:11:10:17:6.7,THB:2:4:17:6.7| Show InChI InChI=1S/C15H18O2S/c1-17-15(16)14-12(10-5-3-2-4-6-10)9-11-7-8-13(14)18-11/h2-6,11-14H,7-9H2,1H3/t11?,12-,13?,14-/m0/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 140 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197472
((2R,3R)-methyl 3-(3,4-dichlorophenyl)bicyclo[3.2.1...)Show SMILES COC(=O)[C@@H]1C2CCC(C2)C[C@H]1c1ccc(Cl)c(Cl)c1 |TLB:12:11:9:6.7,THB:2:4:9:6.7| Show InChI InChI=1S/C16H18Cl2O2/c1-20-16(19)15-11-3-2-9(6-11)7-12(15)10-4-5-13(17)14(18)8-10/h4-5,8-9,11-12,15H,2-3,6-7H2,1H3/t9?,11?,12-,15+/m0/s1 | PDB
KEGG
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PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 166 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50156393
(2-carbomethoxy-3-(4-fluorophenyl)-8-thiabicyclo-[3...)Show SMILES COC(=O)C1=C(CC2CCC1S2)c1ccc(F)cc1 |t:4,THB:2:4:11:9.8,12:5:11:9.8| Show InChI InChI=1S/C15H15FO2S/c1-18-15(17)14-12(8-11-6-7-13(14)19-11)9-2-4-10(16)5-3-9/h2-5,11,13H,6-8H2,1H3 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 220 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197484
(2-beta-carbomethoxy-3-beta-(3,4-difluorophenyl)-8-...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(F)c(F)c1)S2 |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C15H16F2O2S/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-11(16)12(17)6-8/h2,4,6,9-10,13-14H,3,5,7H2,1H3/t9?,10-,13?,14+/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 235 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197478
((1R,7R)-methyl 3-(3,4-dichlorophenyl)-7-hydroxy-8-...)Show SMILES COC(=O)C1=C(CC2C[C@@H](O)[C@@H]1N2C)c1ccc(Cl)c(Cl)c1 |t:4,TLB:14:5:12:9.8,THB:10:9:12:4.5.6,2:4:12:9.8| Show InChI InChI=1S/C16H17Cl2NO3/c1-19-9-6-10(8-3-4-11(17)12(18)5-8)14(16(21)22-2)15(19)13(20)7-9/h3-5,9,13,15,20H,6-7H2,1-2H3/t9?,13-,15+/m1/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 265 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197474
(2-beta-carbomethoxy-3-alpha-(4-bromophenyl)-8-thia...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@H]1c1ccc(Br)cc1)S2 |TLB:11:10:18:6.7,THB:2:4:18:6.7| Show InChI InChI=1S/C15H17BrO2S/c1-18-15(17)14-12(8-11-6-7-13(14)19-11)9-2-4-10(16)5-3-9/h2-5,11-14H,6-8H2,1H3/t11?,12-,13?,14-/m0/s1 | PDB
KEGG
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 342 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197449
(2-beta-carbomethoxy-3-beta-(3-chloro-4-fluoropheny...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(F)c(Cl)c1)S2 |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C15H16ClFO2S/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-12(17)11(16)6-8/h2,4,6,9-10,13-14H,3,5,7H2,1H3/t9?,10-,13?,14+/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 370 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197450
(2-beta-carbomethoxy-3-alpha-(3-chloro-4-fluorophen...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@H]1c1ccc(F)c(Cl)c1)S2 |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C15H16ClFO2S/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-12(17)11(16)6-8/h2,4,6,9-10,13-14H,3,5,7H2,1H3/t9?,10-,13?,14-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 480 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197473
((1R,2S,3R,7R)-methyl 3-(3,4-dichlorophenyl)-7-hydr...)Show SMILES COC(=O)[C@@H]1[C@@H]2[C@H](O)CC(C[C@H]1c1ccc(Cl)c(Cl)c1)N2C |TLB:12:11:20:6.8,THB:7:6:20:4.11.10,2:4:20:6.8| Show InChI InChI=1S/C16H19Cl2NO3/c1-19-9-6-10(8-3-4-11(17)12(18)5-8)14(16(21)22-2)15(19)13(20)7-9/h3-5,9-10,13-15,20H,6-7H2,1-2H3/t9?,10-,13+,14-,15-/m0/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 482 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197480
((1S)-methyl 3-(3,4-dichlorophenyl)-8-methyl-8-aza-...)Show SMILES COC(=O)C1=C(CC2CC[C@@H]1N2C)c1ccc(Cl)c(Cl)c1 |t:4,TLB:13:5:11:9.8,THB:2:4:11:9.8| Show InChI InChI=1S/C16H17Cl2NO2/c1-19-10-4-6-14(19)15(16(20)21-2)11(8-10)9-3-5-12(17)13(18)7-9/h3,5,7,10,14H,4,6,8H2,1-2H3/t10?,14-/m0/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 490 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197483
(2-beta-carbomethoxy-3-beta-(4-fluorophenyl)-8-thia...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(F)cc1)S2 |TLB:11:10:18:6.7,THB:2:4:18:6.7| Show InChI InChI=1S/C15H17FO2S/c1-18-15(17)14-12(8-11-6-7-13(14)19-11)9-2-4-10(16)5-3-9/h2-5,11-14H,6-8H2,1H3/t11?,12-,13?,14+/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 494 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197447
(2-beta-carbomethoxy-3-alpha-(4-chloro-3-fluorophen...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@H]1c1ccc(Cl)c(F)c1)S2 |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C15H16ClFO2S/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-11(16)12(17)6-8/h2,4,6,9-10,13-14H,3,5,7H2,1H3/t9?,10-,13?,14-/m0/s1 | PDB
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| n/a | n/a | 702 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197452
((1R)-methyl 3-(3,4-dichlorophenyl)-8-methyl-8-aza-...)Show SMILES COC(=O)C1=C(CC2CC[C@H]1N2C)c1ccc(Cl)c(Cl)c1 |t:4,TLB:13:5:11:9.8,THB:2:4:11:9.8| Show InChI InChI=1S/C16H17Cl2NO2/c1-19-10-4-6-14(19)15(16(20)21-2)11(8-10)9-3-5-12(17)13(18)7-9/h3,5,7,10,14H,4,6,8H2,1-2H3/t10?,14-/m1/s1 | PDB
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PubMed
| n/a | n/a | 867 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50156400
(2-carbomethoxy-3-phenyl-8-thiabicyclo[3.2.1]-2-oct...)Show SMILES COC(=O)C1=C(CC2CCC1S2)c1ccccc1 |t:4,THB:2:4:11:9.8,12:5:11:9.8| Show InChI InChI=1S/C15H16O2S/c1-17-15(16)14-12(10-5-3-2-4-6-10)9-11-7-8-13(14)18-11/h2-6,11,13H,7-9H2,1H3 | KEGG
UniProtKB/SwissProt
GoogleScholar
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UniChem
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| Article
PubMed
| n/a | n/a | 910 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197488
(2-beta-carbomethoxy-3-alpha-(3,4-difluorophenyl)-8...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@H]1c1ccc(F)c(F)c1)S2 |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C15H16F2O2S/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-11(16)12(17)6-8/h2,4,6,9-10,13-14H,3,5,7H2,1H3/t9?,10-,13?,14-/m0/s1 | PDB
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PubMed
| n/a | n/a | 1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50156401
(2-carbomethoxy-3-(2-naphthyl)-8-thiabicyclo-[3.2.1...)Show SMILES COC(=O)C1=C(CC2CCC1S2)c1ccc2ccccc2c1 |t:4,THB:12:5:11:9.8,2:4:11:9.8| Show InChI InChI=1S/C19H18O2S/c1-21-19(20)18-16(11-15-8-9-17(18)22-15)14-7-6-12-4-2-3-5-13(12)10-14/h2-7,10,15,17H,8-9,11H2,1H3 | PDB
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PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197461
(2-beta-carbomethoxy-3-alpha-phenyl-8-oxo-8-thiabic...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@H]1c1ccccc1)S2=O |TLB:11:10:17:6.7,THB:2:4:17:6.7| Show InChI InChI=1S/C15H18O3S/c1-18-15(16)14-12(10-5-3-2-4-6-10)9-11-7-8-13(14)19(11)17/h2-6,11-14H,7-9H2,1H3/t11?,12-,13?,14-,19?/m0/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
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PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197465
(2-beta-carbomethoxy-3alpha-(4-chlorophenyl)-8-thia...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@H]1c1ccc(Cl)cc1)S2 |TLB:11:10:18:6.7,THB:2:4:18:6.7| Show InChI InChI=1S/C15H17ClO2S/c1-18-15(17)14-12(8-11-6-7-13(14)19-11)9-2-4-10(16)5-3-9/h2-5,11-14H,6-8H2,1H3/t11?,12-,13?,14-/m0/s1 | PDB
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PubMed
| n/a | n/a | 1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197441
((1S,2S,3R,7R)-methyl 3-(3,4-dichlorophenyl)-7-hydr...)Show SMILES COC(=O)[C@@H]1[C@H]2[C@H](O)CC(C[C@H]1c1ccc(Cl)c(Cl)c1)N2C |TLB:12:11:20:6.8,THB:7:6:20:4.11.10,2:4:20:6.8| Show InChI InChI=1S/C16H19Cl2NO3/c1-19-9-6-10(8-3-4-11(17)12(18)5-8)14(16(21)22-2)15(19)13(20)7-9/h3-5,9-10,13-15,20H,6-7H2,1-2H3/t9?,10-,13+,14-,15+/m0/s1 | PDB
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PubMed
| n/a | n/a | 1.22E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197478
((1R,7R)-methyl 3-(3,4-dichlorophenyl)-7-hydroxy-8-...)Show SMILES COC(=O)C1=C(CC2C[C@@H](O)[C@@H]1N2C)c1ccc(Cl)c(Cl)c1 |t:4,TLB:14:5:12:9.8,THB:10:9:12:4.5.6,2:4:12:9.8| Show InChI InChI=1S/C16H17Cl2NO3/c1-19-9-6-10(8-3-4-11(17)12(18)5-8)14(16(21)22-2)15(19)13(20)7-9/h3-5,9,13,15,20H,6-7H2,1-2H3/t9?,13-,15+/m1/s1 | PDB
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Similars
| Article
PubMed
| n/a | n/a | 1.59E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197480
((1S)-methyl 3-(3,4-dichlorophenyl)-8-methyl-8-aza-...)Show SMILES COC(=O)C1=C(CC2CC[C@@H]1N2C)c1ccc(Cl)c(Cl)c1 |t:4,TLB:13:5:11:9.8,THB:2:4:11:9.8| Show InChI InChI=1S/C16H17Cl2NO2/c1-19-10-4-6-14(19)15(16(20)21-2)11(8-10)9-3-5-12(17)13(18)7-9/h3,5,7,10,14H,4,6,8H2,1-2H3/t10?,14-/m0/s1 | PDB
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UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197458
((1R)-methyl 3-(3,4-dichlorophenyl)-8-oxa-bicyclo[3...)Show SMILES COC(=O)C1=C(CC2CC[C@H]1O2)c1ccc(Cl)c(Cl)c1 |t:4,TLB:12:5:11:9.8,THB:2:4:11:9.8| Show InChI InChI=1S/C15H14Cl2O3/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-11(16)12(17)6-8/h2,4,6,9,13H,3,5,7H2,1H3/t9?,13-/m1/s1 | PDB
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| Article
PubMed
| n/a | n/a | 2.12E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197453
((1R)-2-carbomethoxy-3-(3,4-dichlorophenyl)-8-thiab...)Show SMILES COC(=O)C1=C(CC2CC[C@H]1S2)c1ccc(Cl)c(Cl)c1 |t:4,TLB:12:5:11:9.8,THB:2:4:11:9.8| Show InChI InChI=1S/C15H14Cl2O2S/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-11(16)12(17)6-8/h2,4,6,9,13H,3,5,7H2,1H3/t9?,13-/m1/s1 | PDB
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Similars
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PubMed
| n/a | n/a | 2.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197459
((1R,2S,3S,7R)-methyl 3-(3,4-dichlorophenyl)-7-hydr...)Show SMILES COC(=O)[C@@H]1[C@@H]2[C@H](O)CC(C[C@@H]1c1ccc(Cl)c(Cl)c1)N2C |TLB:12:11:20:6.8,THB:7:6:20:4.11.10,2:4:20:6.8| Show InChI InChI=1S/C16H19Cl2NO3/c1-19-9-6-10(8-3-4-11(17)12(18)5-8)14(16(21)22-2)15(19)13(20)7-9/h3-5,9-10,13-15,20H,6-7H2,1-2H3/t9?,10-,13-,14+,15+/m1/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.69E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197485
((1S,2S,3R)-methyl 3-(3,4-dichlorophenyl)-8-oxa-bic...)Show SMILES COC(=O)[C@@H]1[C@@H]2CCC(C[C@H]1c1ccc(Cl)c(Cl)c1)O2 |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C15H16Cl2O3/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-11(16)12(17)6-8/h2,4,6,9-10,13-14H,3,5,7H2,1H3/t9?,10-,13-,14-/m0/s1 | PDB
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UniChem
Patents
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| Article
PubMed
| n/a | n/a | 2.86E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50156398
(2-carbomethoxy-3-(3,4-dichlorophenyl)-8-thiabicycl...)Show SMILES COC(=O)C1=C(CC2CCC1S2)c1ccc(Cl)c(Cl)c1 |t:4,THB:12:5:11:9.8,2:4:11:9.8| Show InChI InChI=1S/C15H14Cl2O2S/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-11(16)12(17)6-8/h2,4,6,9,13H,3,5,7H2,1H3 | PDB
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PC sid
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Similars
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PubMed
| n/a | n/a | >3.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197493
(2-beta-carbomethoxy-3-beta-phenyl-8-thiabicyclo[3....)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccccc1)S2 |TLB:11:10:17:6.7,THB:2:4:17:6.7| Show InChI InChI=1S/C15H18O2S/c1-17-15(16)14-12(10-5-3-2-4-6-10)9-11-7-8-13(14)18-11/h2-6,11-14H,7-9H2,1H3/t11?,12-,13?,14+/m1/s1 | PDB
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PC sid
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Similars
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PubMed
| n/a | n/a | >3.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197446
(2-beta-carbomethoxy-3-alpha-(3,4-dichlorophenyl)-8...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@H]1c1ccc(Cl)c(Cl)c1)S2=O |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C15H16Cl2O3S/c1-20-15(18)14-10(7-9-3-5-13(14)21(9)19)8-2-4-11(16)12(17)6-8/h2,4,6,9-10,13-14H,3,5,7H2,1H3/t9?,10-,13?,14-,21?/m0/s1 | PDB
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PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >3.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197448
((1S)-2-carbomethoxy-3-(3,4-dichlorophenyl)-8-thiab...)Show SMILES COC(=O)C1=C(CC2CC[C@@H]1S2)c1ccc(Cl)c(Cl)c1 |t:4,TLB:12:5:11:9.8,THB:2:4:11:9.8| Show InChI InChI=1S/C15H14Cl2O2S/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-11(16)12(17)6-8/h2,4,6,9,13H,3,5,7H2,1H3/t9?,13-/m0/s1 | PDB
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UniChem
Similars
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PubMed
| n/a | n/a | 4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197468
(2-beta-carbomethoxy-3-beta-(4-chloro-3-fluoropheny...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(Cl)c(F)c1)S2=O |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C15H16ClFO3S/c1-20-15(18)14-10(7-9-3-5-13(14)21(9)19)8-2-4-11(16)12(17)6-8/h2,4,6,9-10,13-14H,3,5,7H2,1H3/t9?,10-,13?,14+,21?/m1/s1 | PDB
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PubMed
| n/a | n/a | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50076048
((1R/1S)-methyl 3-(3,4-dichlorophenyl)bicyclo[3.2.1...)Show SMILES COC(=O)C1=C(CC2CCC1C2)c1ccc(Cl)c(Cl)c1 |t:4,TLB:12:5:11:9.8,THB:2:4:11:9.8| Show InChI InChI=1S/C16H16Cl2O2/c1-20-16(19)15-11-3-2-9(6-11)7-12(15)10-4-5-13(17)14(18)8-10/h4-5,8-9,11H,2-3,6-7H2,1H3 | PDB
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| n/a | n/a | 5.16E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197473
((1R,2S,3R,7R)-methyl 3-(3,4-dichlorophenyl)-7-hydr...)Show SMILES COC(=O)[C@@H]1[C@@H]2[C@H](O)CC(C[C@H]1c1ccc(Cl)c(Cl)c1)N2C |TLB:12:11:20:6.8,THB:7:6:20:4.11.10,2:4:20:6.8| Show InChI InChI=1S/C16H19Cl2NO3/c1-19-9-6-10(8-3-4-11(17)12(18)5-8)14(16(21)22-2)15(19)13(20)7-9/h3-5,9-10,13-15,20H,6-7H2,1-2H3/t9?,10-,13+,14-,15-/m0/s1 | PDB
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PubMed
| n/a | n/a | 5.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197476
((1S,7R)-methyl 3-(3,4-dichlorophenyl)-7-hydroxy-8-...)Show SMILES COC(=O)C1=C(CC2C[C@@H](O)[C@H]1N2C)c1ccc(Cl)c(Cl)c1 |t:4,TLB:14:5:12:9.8,THB:10:9:12:4.5.6,2:4:12:9.8| Show InChI InChI=1S/C16H17Cl2NO3/c1-19-9-6-10(8-3-4-11(17)12(18)5-8)14(16(21)22-2)15(19)13(20)7-9/h3-5,9,13,15,20H,6-7H2,1-2H3/t9?,13-,15-/m1/s1 | PDB
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PubMed
| n/a | n/a | 5.37E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197490
(2-carbomethoxy-3-(3-chloro-4-fluorophenyl)-8-thiab...)Show SMILES COC(=O)C1=C(CC2CCC1S2)c1ccc(F)c(Cl)c1 |t:4,TLB:12:5:11:9.8,THB:2:4:11:9.8| Show InChI InChI=1S/C15H14ClFO2S/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-12(17)11(16)6-8/h2,4,6,9,13H,3,5,7H2,1H3 | PDB
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| n/a | n/a | >6.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Macaca fascicularis) | BDBM50197467
(2-carbomethoxy-3-phenyl-8-oxo-8-thiabicyclo-[3.2.1...)Show SMILES COC(=O)C1=C(CC2CCC1S2=O)c1ccccc1 |t:4,TLB:13:5:11:9.8,THB:2:4:11:9.8| Show InChI InChI=1S/C15H16O3S/c1-18-15(16)14-12(10-5-3-2-4-6-10)9-11-7-8-13(14)19(11)17/h2-6,11,13H,7-9H2,1H3 | KEGG
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PubMed
| n/a | n/a | 6.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN 35428 from DAT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50076047
((1R/1S)-methyl 3-(3,4-dichlorophenyl)-8-oxa-bicycl...)Show SMILES COC(=O)C1=C(CC2CCC1O2)c1ccc(Cl)c(Cl)c1 |t:4,THB:12:5:11:9.8,2:4:11:9.8| Show InChI InChI=1S/C15H14Cl2O3/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-11(16)12(17)6-8/h2,4,6,9,13H,3,5,7H2,1H3 | PDB
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| n/a | n/a | 6.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197454
(2-beta-carbomethoxy-3-alpha-phenyl-8-thiabicyclo[3...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@H]1c1ccccc1)S2 |TLB:11:10:17:6.7,THB:2:4:17:6.7| Show InChI InChI=1S/C15H18O2S/c1-17-15(16)14-12(10-5-3-2-4-6-10)9-11-7-8-13(14)18-11/h2-6,11-14H,7-9H2,1H3/t11?,12-,13?,14-/m0/s1 | PDB
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| n/a | n/a | >8.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50156395
(2-carbomethoxy-3-(4-iodophenyl)-8-thiabicyclo-[3.2...)Show SMILES COC(=O)C1=C(CC2CCC1S2)c1ccc(I)cc1 |t:4,THB:2:4:11:9.8,12:5:11:9.8| Show InChI InChI=1S/C15H15IO2S/c1-18-15(17)14-12(8-11-6-7-13(14)19-11)9-2-4-10(16)5-3-9/h2-5,11,13H,6-8H2,1H3 | PDB
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| n/a | n/a | >8.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50156390
(2-carbomethoxy-3-(4-chlorophenyl)-8-thiabicyclo-[3...)Show SMILES COC(=O)C1=C(CC2CCC1S2)c1ccc(Cl)cc1 |t:4,THB:2:4:11:9.8,12:5:11:9.8| Show InChI InChI=1S/C15H15ClO2S/c1-18-15(17)14-12(8-11-6-7-13(14)19-11)9-2-4-10(16)5-3-9/h2-5,11,13H,6-8H2,1H3 | PDB
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| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197467
(2-carbomethoxy-3-phenyl-8-oxo-8-thiabicyclo-[3.2.1...)Show SMILES COC(=O)C1=C(CC2CCC1S2=O)c1ccccc1 |t:4,TLB:13:5:11:9.8,THB:2:4:11:9.8| Show InChI InChI=1S/C15H16O3S/c1-18-15(16)14-12(10-5-3-2-4-6-10)9-11-7-8-13(14)19(11)17/h2-6,11,13H,7-9H2,1H3 | PDB
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| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50156400
(2-carbomethoxy-3-phenyl-8-thiabicyclo[3.2.1]-2-oct...)Show SMILES COC(=O)C1=C(CC2CCC1S2)c1ccccc1 |t:4,THB:2:4:11:9.8,12:5:11:9.8| Show InChI InChI=1S/C15H16O2S/c1-17-15(16)14-12(10-5-3-2-4-6-10)9-11-7-8-13(14)18-11/h2-6,11,13H,7-9H2,1H3 | PDB
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| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197489
(2-carbomethoxy-3-(3,4-difluorophenyl)-8-thiabicycl...)Show SMILES COC(=O)C1=C(CC2CCC1S2)c1ccc(F)c(F)c1 |t:4,TLB:12:5:11:9.8,THB:2:4:11:9.8| Show InChI InChI=1S/C15H14F2O2S/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-11(16)12(17)6-8/h2,4,6,9,13H,3,5,7H2,1H3 | PDB
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| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197479
(2-beta-carbomethoxy-3-alpha-(4-fluorophenyl)-8-thi...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@H]1c1ccc(F)cc1)S2 |TLB:11:10:18:6.7,THB:2:4:18:6.7| Show InChI InChI=1S/C15H17FO2S/c1-18-15(17)14-12(8-11-6-7-13(14)19-11)9-2-4-10(16)5-3-9/h2-5,11-14H,6-8H2,1H3/t11?,12-,13?,14-/m0/s1 | PDB
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| n/a | n/a | >1.10E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197442
(2-beta-carbomethoxy-3-alpha-(4-chloro-3-fluorophen...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@H]1c1ccc(Cl)c(F)c1)S2=O |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C15H16ClFO3S/c1-20-15(18)14-10(7-9-3-5-13(14)21(9)19)8-2-4-11(16)12(17)6-8/h2,4,6,9-10,13-14H,3,5,7H2,1H3/t9?,10-,13?,14-,21?/m0/s1 | PDB
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| n/a | n/a | >1.40E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197455
(2-beta-carbomethoxy-3-alpha-(4-bromophenyl)-8-oxo-...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@H]1c1ccc(Br)cc1)S2=O |TLB:11:10:18:6.7,THB:2:4:18:6.7| Show InChI InChI=1S/C15H17BrO3S/c1-19-15(17)14-12(9-2-4-10(16)5-3-9)8-11-6-7-13(14)20(11)18/h2-5,11-14H,6-8H2,1H3/t11?,12-,13?,14-,20?/m0/s1 | PDB
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PubMed
| n/a | n/a | >2.40E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50156391
(2-carbomethoxy-3-(4-bromophenyl)-8-thiabicyclo-[3....)Show SMILES COC(=O)C1=C(CC2CCC1S2)c1ccc(Br)cc1 |t:4,THB:2:4:11:9.8,12:5:11:9.8| Show InChI InChI=1S/C15H15BrO2S/c1-18-15(17)14-12(8-11-6-7-13(14)19-11)9-2-4-10(16)5-3-9/h2-5,11,13H,6-8H2,1H3 | PDB
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| n/a | n/a | >2.50E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50156393
(2-carbomethoxy-3-(4-fluorophenyl)-8-thiabicyclo-[3...)Show SMILES COC(=O)C1=C(CC2CCC1S2)c1ccc(F)cc1 |t:4,THB:2:4:11:9.8,12:5:11:9.8| Show InChI InChI=1S/C15H15FO2S/c1-18-15(17)14-12(8-11-6-7-13(14)19-11)9-2-4-10(16)5-3-9/h2-5,11,13H,6-8H2,1H3 | PDB
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| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197475
(2-beta-carbomethoxy-3-alpha-(3-chloro-4-fluorophen...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@H]1c1ccc(F)c(Cl)c1)S2=O |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C15H16ClFO3S/c1-20-15(18)14-10(7-9-3-5-13(14)21(9)19)8-2-4-12(17)11(16)6-8/h2,4,6,9-10,13-14H,3,5,7H2,1H3/t9?,10-,13?,14-,21?/m0/s1 | PDB
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PubMed
| n/a | n/a | >3.10E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197487
((1S)-methyl 3-(3,4-dichlorophenyl)-8-oxa-bicyclo[3...)Show SMILES COC(=O)C1=C(CC2CC[C@@H]1O2)c1ccc(Cl)c(Cl)c1 |t:4,TLB:12:5:11:9.8,THB:2:4:11:9.8| Show InChI InChI=1S/C15H14Cl2O3/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-11(16)12(17)6-8/h2,4,6,9,13H,3,5,7H2,1H3/t9?,13-/m0/s1 | PDB
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| Article
PubMed
| n/a | n/a | 4.67E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197466
(2-carbomethoxy-3-(4-chloro-3-fluorophenyl)-8-thiab...)Show SMILES COC(=O)C1=C(CC2CCC1S2)c1ccc(Cl)c(F)c1 |t:4,TLB:12:5:11:9.8,THB:2:4:11:9.8| Show InChI InChI=1S/C15H14ClFO2S/c1-19-15(18)14-10(7-9-3-5-13(14)20-9)8-2-4-11(16)12(17)6-8/h2,4,6,9,13H,3,5,7H2,1H3 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197482
(2-beta-carbomethoxy-3-alpha-(3,4-difluorophenyl)-8...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@H]1c1ccc(F)c(F)c1)S2=O |TLB:11:10:19:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C15H16F2O3S/c1-20-15(18)14-10(7-9-3-5-13(14)21(9)19)8-2-4-11(16)12(17)6-8/h2,4,6,9-10,13-14H,3,5,7H2,1H3/t9?,10-,13?,14-,21?/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >6.90E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Macaca mulatta) | BDBM50197461
(2-beta-carbomethoxy-3-alpha-phenyl-8-oxo-8-thiabic...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@H]1c1ccccc1)S2=O |TLB:11:10:17:6.7,THB:2:4:17:6.7| Show InChI InChI=1S/C15H18O3S/c1-18-15(16)14-12(10-5-3-2-4-6-10)9-11-7-8-13(14)19(11)17/h2-6,11-14H,7-9H2,1H3/t11?,12-,13?,14-,19?/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Organix Inc.
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from SERT in rhesus monkey caudate-putamen |
Bioorg Med Chem 15: 1067-82 (2006)
Article DOI: 10.1016/j.bmc.2006.10.016
BindingDB Entry DOI: 10.7270/Q2765DZ8 |
More data for this
Ligand-Target Pair | |
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