Found 187 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
(Homo sapiens (Human)) | BDBM50211035
((1S,2S,3S,5R)-methyl 3-(4-iodophenyl)-8-methyl-8-a...)Show SMILES COC(=O)[C@@H]1[C@@H]2CC[C@H](C[C@@H]1c1ccc(I)cc1)N2C |TLB:19:18:4.10.9:6.7| Show InChI InChI=1S/C16H20INO2/c1-18-12-7-8-14(18)15(16(19)20-2)13(9-12)10-3-5-11(17)6-4-10/h3-6,12-15H,7-9H2,1-2H3/t12-,13-,14+,15+/m1/s1 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211035
((1S,2S,3S,5R)-methyl 3-(4-iodophenyl)-8-methyl-8-a...)Show SMILES COC(=O)[C@@H]1[C@@H]2CC[C@H](C[C@@H]1c1ccc(I)cc1)N2C |TLB:19:18:4.10.9:6.7| Show InChI InChI=1S/C16H20INO2/c1-18-12-7-8-14(18)15(16(19)20-2)13(9-12)10-3-5-11(17)6-4-10/h3-6,12-15H,7-9H2,1-2H3/t12-,13-,14+,15+/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Inhibition of [3H]SER uptake in human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211035
((1S,2S,3S,5R)-methyl 3-(4-iodophenyl)-8-methyl-8-a...)Show SMILES COC(=O)[C@@H]1[C@@H]2CC[C@H](C[C@@H]1c1ccc(I)cc1)N2C |TLB:19:18:4.10.9:6.7| Show InChI InChI=1S/C16H20INO2/c1-18-12-7-8-14(18)15(16(19)20-2)13(9-12)10-3-5-11(17)6-4-10/h3-6,12-15H,7-9H2,1-2H3/t12-,13-,14+,15+/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211035
((1S,2S,3S,5R)-methyl 3-(4-iodophenyl)-8-methyl-8-a...)Show SMILES COC(=O)[C@@H]1[C@@H]2CC[C@H](C[C@@H]1c1ccc(I)cc1)N2C |TLB:19:18:4.10.9:6.7| Show InChI InChI=1S/C16H20INO2/c1-18-12-7-8-14(18)15(16(19)20-2)13(9-12)10-3-5-11(17)6-4-10/h3-6,12-15H,7-9H2,1-2H3/t12-,13-,14+,15+/m1/s1 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 9 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Inhibition of [3H]DA uptake in human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211035
((1S,2S,3S,5R)-methyl 3-(4-iodophenyl)-8-methyl-8-a...)Show SMILES COC(=O)[C@@H]1[C@@H]2CC[C@H](C[C@@H]1c1ccc(I)cc1)N2C |TLB:19:18:4.10.9:6.7| Show InChI InChI=1S/C16H20INO2/c1-18-12-7-8-14(18)15(16(19)20-2)13(9-12)10-3-5-11(17)6-4-10/h3-6,12-15H,7-9H2,1-2H3/t12-,13-,14+,15+/m1/s1 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Inhibition of [3H]DA uptake in human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211035
((1S,2S,3S,5R)-methyl 3-(4-iodophenyl)-8-methyl-8-a...)Show SMILES COC(=O)[C@@H]1[C@@H]2CC[C@H](C[C@@H]1c1ccc(I)cc1)N2C |TLB:19:18:4.10.9:6.7| Show InChI InChI=1S/C16H20INO2/c1-18-12-7-8-14(18)15(16(19)20-2)13(9-12)10-3-5-11(17)6-4-10/h3-6,12-15H,7-9H2,1-2H3/t12-,13-,14+,15+/m1/s1 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 34 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211042
(CHEMBL388257 | ethyl 4-(naphthalen-2-yl)-1,2,5,6-t...)Show InChI InChI=1S/C18H19NO2/c1-2-21-18(20)17-12-19-10-9-16(17)15-8-7-13-5-3-4-6-14(13)11-15/h3-8,11,19H,2,9-10,12H2,1H3 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 79 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50084717
((+)-(1R,2R,3S,5S)-methyl 3-(benzoyloxy)-8-methyl-8...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@@H]1C(=O)Oc1ccccc1)N2C |THB:2:4:20:6.7| Show InChI InChI=1S/C17H21NO4/c1-18-11-8-9-14(18)15(17(20)21-2)13(10-11)16(19)22-12-6-4-3-5-7-12/h3-7,11,13-15H,8-10H2,1-2H3/t11?,13-,14?,15-/m0/s1 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 182 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Inhibition of [3H]DA uptake in human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211003
(CHEMBL243141 | ethyl 4-(3,4-dichlorophenyl)-1,2,5,...)Show InChI InChI=1S/C14H15Cl2NO2/c1-2-19-14(18)11-8-17-6-5-10(11)9-3-4-12(15)13(16)7-9/h3-4,7,17H,2,5-6,8H2,1H3 | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 217 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211042
(CHEMBL388257 | ethyl 4-(naphthalen-2-yl)-1,2,5,6-t...)Show InChI InChI=1S/C18H19NO2/c1-2-21-18(20)17-12-19-10-9-16(17)15-8-7-13-5-3-4-6-14(13)11-15/h3-8,11,19H,2,9-10,12H2,1H3 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 268 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50193220
((3S,4S)-methyl 4-(4-iodophenyl)-1-methylpiperidine...)Show InChI InChI=1S/C14H18INO2/c1-16-8-7-12(13(9-16)14(17)18-2)10-3-5-11(15)6-4-10/h3-6,12-13H,7-9H2,1-2H3/t12-,13-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 287 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50193220
((3S,4S)-methyl 4-(4-iodophenyl)-1-methylpiperidine...)Show InChI InChI=1S/C14H18INO2/c1-16-8-7-12(13(9-16)14(17)18-2)10-3-5-11(15)6-4-10/h3-6,12-13H,7-9H2,1-2H3/t12-,13-/m1/s1 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 323 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50084717
((+)-(1R,2R,3S,5S)-methyl 3-(benzoyloxy)-8-methyl-8...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@@H]1C(=O)Oc1ccccc1)N2C |THB:2:4:20:6.7| Show InChI InChI=1S/C17H21NO4/c1-18-11-8-9-14(18)15(17(20)21-2)13(10-11)16(19)22-12-6-4-3-5-7-12/h3-7,11,13-15H,8-10H2,1-2H3/t11?,13-,14?,15-/m0/s1 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 347 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Inhibition of [3H]DA uptake in human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211042
(CHEMBL388257 | ethyl 4-(naphthalen-2-yl)-1,2,5,6-t...)Show InChI InChI=1S/C18H19NO2/c1-2-21-18(20)17-12-19-10-9-16(17)15-8-7-13-5-3-4-6-14(13)11-15/h3-8,11,19H,2,9-10,12H2,1H3 | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 440 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211019
(CHEMBL233088 | methyl 2-(3,4-dichlorophenyl)cycloh...)Show InChI InChI=1S/C15H16Cl2O2/c1-19-15(18)12-6-4-2-3-5-11(12)10-7-8-13(16)14(17)9-10/h7-9H,2-6H2,1H3 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 515 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Inhibition of [3H]DA uptake in human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50084717
((+)-(1R,2R,3S,5S)-methyl 3-(benzoyloxy)-8-methyl-8...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@@H]1C(=O)Oc1ccccc1)N2C |THB:2:4:20:6.7| Show InChI InChI=1S/C17H21NO4/c1-18-11-8-9-14(18)15(17(20)21-2)13(10-11)16(19)22-12-6-4-3-5-7-12/h3-7,11,13-15H,8-10H2,1-2H3/t11?,13-,14?,15-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 524 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Inhibition of [3H]SER uptake in human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211008
(CHEMBL232870 | methyl 2-(4-chlorophenyl)cyclohex-1...)Show InChI InChI=1S/C14H15ClO2/c1-17-14(16)13-5-3-2-4-12(13)10-6-8-11(15)9-7-10/h6-9H,2-5H2,1H3 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 589 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Inhibition of [3H]DA uptake in human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211029
(CHEMBL395910 | methyl 2-(3,4-dichlorophenyl)cycloh...)Show InChI InChI=1S/C14H14Cl2O2/c1-18-14(17)11-5-3-2-4-10(11)9-6-7-12(15)13(16)8-9/h6-8H,2-5H2,1H3 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 625 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Inhibition of [3H]DA uptake in human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50084717
((+)-(1R,2R,3S,5S)-methyl 3-(benzoyloxy)-8-methyl-8...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@@H]1C(=O)Oc1ccccc1)N2C |THB:2:4:20:6.7| Show InChI InChI=1S/C17H21NO4/c1-18-11-8-9-14(18)15(17(20)21-2)13(10-11)16(19)22-12-6-4-3-5-7-12/h3-7,11,13-15H,8-10H2,1-2H3/t11?,13-,14?,15-/m0/s1 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 630 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211017
(CHEMBL232299 | methyl 2-(biphenyl-4-yl)cyclohept-1...)Show SMILES COC(=O)C1=C(CCCCC1)c1ccc(cc1)-c1ccccc1 |t:4| Show InChI InChI=1S/C21H22O2/c1-23-21(22)20-11-7-3-6-10-19(20)18-14-12-17(13-15-18)16-8-4-2-5-9-16/h2,4-5,8-9,12-15H,3,6-7,10-11H2,1H3 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 810 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Inhibition of [3H]DA uptake in human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50193220
((3S,4S)-methyl 4-(4-iodophenyl)-1-methylpiperidine...)Show InChI InChI=1S/C14H18INO2/c1-16-8-7-12(13(9-16)14(17)18-2)10-3-5-11(15)6-4-10/h3-6,12-13H,7-9H2,1-2H3/t12-,13-/m1/s1 | Reactome pathway
KEGG
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DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 855 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50084717
((+)-(1R,2R,3S,5S)-methyl 3-(benzoyloxy)-8-methyl-8...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@@H]1C(=O)Oc1ccccc1)N2C |THB:2:4:20:6.7| Show InChI InChI=1S/C17H21NO4/c1-18-11-8-9-14(18)15(17(20)21-2)13(10-11)16(19)22-12-6-4-3-5-7-12/h3-7,11,13-15H,8-10H2,1-2H3/t11?,13-,14?,15-/m0/s1 | Reactome pathway
KEGG
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GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 887 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211003
(CHEMBL243141 | ethyl 4-(3,4-dichlorophenyl)-1,2,5,...)Show InChI InChI=1S/C14H15Cl2NO2/c1-2-19-14(18)11-8-17-6-5-10(11)9-3-4-12(15)13(16)7-9/h3-4,7,17H,2,5-6,8H2,1H3 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 922 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50084717
((+)-(1R,2R,3S,5S)-methyl 3-(benzoyloxy)-8-methyl-8...)Show SMILES COC(=O)[C@@H]1C2CCC(C[C@@H]1C(=O)Oc1ccccc1)N2C |THB:2:4:20:6.7| Show InChI InChI=1S/C17H21NO4/c1-18-11-8-9-14(18)15(17(20)21-2)13(10-11)16(19)22-12-6-4-3-5-7-12/h3-7,11,13-15H,8-10H2,1-2H3/t11?,13-,14?,15-/m0/s1 | PDB
KEGG
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| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 965 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211031
(CHEMBL242920 | methyl 3,4-trans-N-methyl-4-(4-iodo...)Show InChI InChI=1S/C14H18INO2/c1-16-8-7-12(13(9-16)14(17)18-2)10-3-5-11(15)6-4-10/h3-6,12-13H,7-9H2,1-2H3/t12-,13+/m0/s1 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.25E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211019
(CHEMBL233088 | methyl 2-(3,4-dichlorophenyl)cycloh...)Show InChI InChI=1S/C15H16Cl2O2/c1-19-15(18)12-6-4-2-3-5-11(12)10-7-8-13(16)14(17)9-10/h7-9H,2-6H2,1H3 | NCI pathway
Reactome pathway
KEGG
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DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.36E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211045
(CHEMBL232068 | methyl 2-(naphthalen-2-yl)cyclohex-...)Show InChI InChI=1S/C18H18O2/c1-20-18(19)17-9-5-4-8-16(17)15-11-10-13-6-2-3-7-14(13)12-15/h2-3,6-7,10-12H,4-5,8-9H2,1H3 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Inhibition of [3H]DA uptake in human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211023
(CHEMBL245061 | methyl 2-(3,4-dichlorophenyl)cyclop...)Show InChI InChI=1S/C13H12Cl2O2/c1-17-13(16)10-4-2-3-9(10)8-5-6-11(14)12(15)7-8/h5-7H,2-4H2,1H3 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211017
(CHEMBL232299 | methyl 2-(biphenyl-4-yl)cyclohept-1...)Show SMILES COC(=O)C1=C(CCCCC1)c1ccc(cc1)-c1ccccc1 |t:4| Show InChI InChI=1S/C21H22O2/c1-23-21(22)20-11-7-3-6-10-19(20)18-14-12-17(13-15-18)16-8-4-2-5-9-16/h2,4-5,8-9,12-15H,3,6-7,10-11H2,1H3 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211029
(CHEMBL395910 | methyl 2-(3,4-dichlorophenyl)cycloh...)Show InChI InChI=1S/C14H14Cl2O2/c1-18-14(17)11-5-3-2-4-10(11)9-6-7-12(15)13(16)8-9/h6-8H,2-5H2,1H3 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211027
(CHEMBL394585 | methyl 2-(4-chlorophenyl)cyclopent-...)Show InChI InChI=1S/C13H13ClO2/c1-16-13(15)12-4-2-3-11(12)9-5-7-10(14)8-6-9/h5-8H,2-4H2,1H3 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Inhibition of [3H]DA uptake in human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211037
(CHEMBL398009 | methyl 2-(4-chlorophenyl)cyclohept-...)Show InChI InChI=1S/C15H17ClO2/c1-18-15(17)14-6-4-2-3-5-13(14)11-7-9-12(16)10-8-11/h7-10H,2-6H2,1H3 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Inhibition of [3H]DA uptake in human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211031
(CHEMBL242920 | methyl 3,4-trans-N-methyl-4-(4-iodo...)Show InChI InChI=1S/C14H18INO2/c1-16-8-7-12(13(9-16)14(17)18-2)10-3-5-11(15)6-4-10/h3-6,12-13H,7-9H2,1-2H3/t12-,13+/m0/s1 | Reactome pathway
KEGG
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antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211003
(CHEMBL243141 | ethyl 4-(3,4-dichlorophenyl)-1,2,5,...)Show InChI InChI=1S/C14H15Cl2NO2/c1-2-19-14(18)11-8-17-6-5-10(11)9-3-4-12(15)13(16)7-9/h3-4,7,17H,2,5-6,8H2,1H3 | Reactome pathway
KEGG
UniProtKB/SwissProt
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antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 2.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211031
(CHEMBL242920 | methyl 3,4-trans-N-methyl-4-(4-iodo...)Show InChI InChI=1S/C14H18INO2/c1-16-8-7-12(13(9-16)14(17)18-2)10-3-5-11(15)6-4-10/h3-6,12-13H,7-9H2,1-2H3/t12-,13+/m0/s1 | PDB
KEGG
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GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.81E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211046
(CHEMBL396754 | ethyl 4-(3-nitrophenyl)-1,2,5,6-tet...)Show SMILES CCOC(=O)C1=C(CCNC1)c1cccc(c1)[N+]([O-])=O |t:5| Show InChI InChI=1S/C14H16N2O4/c1-2-20-14(17)13-9-15-7-6-12(13)10-4-3-5-11(8-10)16(18)19/h3-5,8,15H,2,6-7,9H2,1H3 | PDB
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 3.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211032
(CHEMBL232671 | methyl 2-(3-chlorophenyl)cyclopent-...)Show InChI InChI=1S/C13H13ClO2/c1-16-13(15)12-7-3-6-11(12)9-4-2-5-10(14)8-9/h2,4-5,8H,3,6-7H2,1H3 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 3.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Inhibition of [3H]DA uptake in human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211013
(CHEMBL396318 | methyl 2-(3-chlorophenyl)cyclohept-...)Show InChI InChI=1S/C15H17ClO2/c1-18-15(17)14-9-4-2-3-8-13(14)11-6-5-7-12(16)10-11/h5-7,10H,2-4,8-9H2,1H3 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 3.78E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Inhibition of [3H]DA uptake in human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211017
(CHEMBL232299 | methyl 2-(biphenyl-4-yl)cyclohept-1...)Show SMILES COC(=O)C1=C(CCCCC1)c1ccc(cc1)-c1ccccc1 |t:4| Show InChI InChI=1S/C21H22O2/c1-23-21(22)20-11-7-3-6-10-19(20)18-14-12-17(13-15-18)16-8-4-2-5-9-16/h2,4-5,8-9,12-15H,3,6-7,10-11H2,1H3 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 3.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Inhibition of [3H]DA uptake in human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50090973
(2-Naphthalen-2-yl-benzoic acid methyl ester | CHEM...)Show InChI InChI=1S/C18H14O2/c1-20-18(19)17-9-5-4-8-16(17)15-11-10-13-6-2-3-7-14(13)12-15/h2-12H,1H3 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 4.06E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211006
(CHEMBL396082 | methyl 2-(naphthalen-2-yl)cyclopent...)Show InChI InChI=1S/C17H16O2/c1-19-17(18)16-8-4-7-15(16)14-10-9-12-5-2-3-6-13(12)11-14/h2-3,5-6,9-11H,4,7-8H2,1H3 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 4.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211019
(CHEMBL233088 | methyl 2-(3,4-dichlorophenyl)cycloh...)Show InChI InChI=1S/C15H16Cl2O2/c1-19-15(18)12-6-4-2-3-5-11(12)10-7-8-13(16)14(17)9-10/h7-9H,2-6H2,1H3 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 4.72E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Inhibition of [3H]DA uptake in human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211029
(CHEMBL395910 | methyl 2-(3,4-dichlorophenyl)cycloh...)Show InChI InChI=1S/C14H14Cl2O2/c1-18-14(17)11-5-3-2-4-10(11)9-6-7-12(15)13(16)8-9/h6-8H,2-5H2,1H3 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 4.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Inhibition of [3H]DA uptake in human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211023
(CHEMBL245061 | methyl 2-(3,4-dichlorophenyl)cyclop...)Show InChI InChI=1S/C13H12Cl2O2/c1-17-13(16)10-4-2-3-9(10)8-5-6-11(14)12(15)7-8/h5-7H,2-4H2,1H3 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 5.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Inhibition of [3H]DA uptake in human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211039
(CHEMBL232672 | methyl 2-(4-methoxyphenyl)cyclopent...)Show InChI InChI=1S/C14H16O3/c1-16-11-8-6-10(7-9-11)12-4-3-5-13(12)14(15)17-2/h6-9H,3-5H2,1-2H3 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 6.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Inhibition of [3H]DA uptake in human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211047
(CHEMBL232675 | methyl 2-(4-nitrophenyl)cyclopent-1...)Show SMILES COC(=O)C1=C(CCC1)c1ccc(cc1)[N+]([O-])=O |t:4| Show InChI InChI=1S/C13H13NO4/c1-18-13(15)12-4-2-3-11(12)9-5-7-10(8-6-9)14(16)17/h5-8H,2-4H2,1H3 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 6.54E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211006
(CHEMBL396082 | methyl 2-(naphthalen-2-yl)cyclopent...)Show InChI InChI=1S/C17H16O2/c1-19-17(18)16-8-4-7-15(16)14-10-9-12-5-2-3-6-13(12)11-14/h2-3,5-6,9-11H,4,7-8H2,1H3 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 7.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Inhibition of [3H]DA uptake in human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211026
(CHEMBL243204 | methyl 3,4-cis-N-methyl-4-phenylpip...)Show InChI InChI=1S/C14H19NO2/c1-15-9-8-12(11-6-4-3-5-7-11)13(10-15)14(16)17-2/h3-7,12-13H,8-10H2,1-2H3/t12-,13-/m1/s1 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 8.51E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211046
(CHEMBL396754 | ethyl 4-(3-nitrophenyl)-1,2,5,6-tet...)Show SMILES CCOC(=O)C1=C(CCNC1)c1cccc(c1)[N+]([O-])=O |t:5| Show InChI InChI=1S/C14H16N2O4/c1-2-20-14(17)13-9-15-7-6-12(13)10-4-3-5-11(8-10)16(18)19/h3-5,8,15H,2,6-7,9H2,1H3 | Reactome pathway
KEGG
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GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211045
(CHEMBL232068 | methyl 2-(naphthalen-2-yl)cyclohex-...)Show InChI InChI=1S/C18H18O2/c1-20-18(19)17-9-5-4-8-16(17)15-11-10-13-6-2-3-7-14(13)12-15/h2-3,6-7,10-12H,4-5,8-9H2,1H3 | Reactome pathway
KEGG
UniProtKB/SwissProt
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antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Inhibition of [3H]DA uptake in human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211002
(1,2-dichloro-4-(2-(prop-1-enyl)cyclohex-1-enyl)ben...)Show InChI InChI=1S/C15H16Cl2/c1-2-5-11-6-3-4-7-13(11)12-8-9-14(16)15(17)10-12/h2,5,8-10H,3-4,6-7H2,1H3/b5-2+ | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 1.10E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211023
(CHEMBL245061 | methyl 2-(3,4-dichlorophenyl)cyclop...)Show InChI InChI=1S/C13H12Cl2O2/c1-17-13(16)10-4-2-3-9(10)8-5-6-11(14)12(15)7-8/h5-7H,2-4H2,1H3 | Reactome pathway
KEGG
UniProtKB/SwissProt
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GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.10E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211045
(CHEMBL232068 | methyl 2-(naphthalen-2-yl)cyclohex-...)Show InChI InChI=1S/C18H18O2/c1-20-18(19)17-9-5-4-8-16(17)15-11-10-13-6-2-3-7-14(13)12-15/h2-3,6-7,10-12H,4-5,8-9H2,1H3 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.20E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211017
(CHEMBL232299 | methyl 2-(biphenyl-4-yl)cyclohept-1...)Show SMILES COC(=O)C1=C(CCCCC1)c1ccc(cc1)-c1ccccc1 |t:4| Show InChI InChI=1S/C21H22O2/c1-23-21(22)20-11-7-3-6-10-19(20)18-14-12-17(13-15-18)16-8-4-2-5-9-16/h2,4-5,8-9,12-15H,3,6-7,10-11H2,1H3 | Reactome pathway
KEGG
UniProtKB/SwissProt
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antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.30E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211005
((3S,4S)-methyl 4-(3,4-dichlorophenyl)-1-methylpipe...)Show SMILES COC(=O)[C@@H]1CN(C)CC[C@@H]1c1ccc(Cl)c(Cl)c1 Show InChI InChI=1S/C14H17Cl2NO2/c1-17-6-5-10(11(8-17)14(18)19-2)9-3-4-12(15)13(16)7-9/h3-4,7,10-11H,5-6,8H2,1-2H3/t10-,11-/m1/s1 | PDB
KEGG
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antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.38E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211005
((3S,4S)-methyl 4-(3,4-dichlorophenyl)-1-methylpipe...)Show SMILES COC(=O)[C@@H]1CN(C)CC[C@@H]1c1ccc(Cl)c(Cl)c1 Show InChI InChI=1S/C14H17Cl2NO2/c1-17-6-5-10(11(8-17)14(18)19-2)9-3-4-12(15)13(16)7-9/h3-4,7,10-11H,5-6,8H2,1-2H3/t10-,11-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.38E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211029
(CHEMBL395910 | methyl 2-(3,4-dichlorophenyl)cycloh...)Show InChI InChI=1S/C14H14Cl2O2/c1-18-14(17)11-5-3-2-4-10(11)9-6-7-12(15)13(16)8-9/h6-8H,2-5H2,1H3 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.40E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211037
(CHEMBL398009 | methyl 2-(4-chlorophenyl)cyclohept-...)Show InChI InChI=1S/C15H17ClO2/c1-18-15(17)14-6-4-2-3-5-13(14)11-7-9-12(16)10-8-11/h7-10H,2-6H2,1H3 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.50E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211019
(CHEMBL233088 | methyl 2-(3,4-dichlorophenyl)cycloh...)Show InChI InChI=1S/C15H16Cl2O2/c1-19-15(18)12-6-4-2-3-5-11(12)10-7-8-13(16)14(17)9-10/h7-9H,2-6H2,1H3 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.50E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211041
(CHEMBL388255 | methyl 3,4-trans-N-methyl-4-phenylp...)Show InChI InChI=1S/C14H19NO2/c1-15-9-8-12(11-6-4-3-5-7-11)13(10-15)14(16)17-2/h3-7,12-13H,8-10H2,1-2H3/t12-,13+/m0/s1 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.74E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211027
(CHEMBL394585 | methyl 2-(4-chlorophenyl)cyclopent-...)Show InChI InChI=1S/C13H13ClO2/c1-16-13(15)12-4-2-3-11(12)9-5-7-10(14)8-6-9/h5-8H,2-4H2,1H3 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.80E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211037
(CHEMBL398009 | methyl 2-(4-chlorophenyl)cyclohept-...)Show InChI InChI=1S/C15H17ClO2/c1-18-15(17)14-6-4-2-3-5-13(14)11-7-9-12(16)10-8-11/h7-10H,2-6H2,1H3 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Inhibition of [3H]DA uptake in human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211046
(CHEMBL396754 | ethyl 4-(3-nitrophenyl)-1,2,5,6-tet...)Show SMILES CCOC(=O)C1=C(CCNC1)c1cccc(c1)[N+]([O-])=O |t:5| Show InChI InChI=1S/C14H16N2O4/c1-2-20-14(17)13-9-15-7-6-12(13)10-4-3-5-11(8-10)16(18)19/h3-5,8,15H,2,6-7,9H2,1H3 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.06E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211013
(CHEMBL396318 | methyl 2-(3-chlorophenyl)cyclohept-...)Show InChI InChI=1S/C15H17ClO2/c1-18-15(17)14-9-4-2-3-8-13(14)11-6-5-7-12(16)10-11/h5-7,10H,2-4,8-9H2,1H3 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.20E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211024
(CHEMBL231858 | methyl 2-(3-chlorophenyl)cyclohex-1...)Show InChI InChI=1S/C14H15ClO2/c1-17-14(16)13-8-3-2-7-12(13)10-5-4-6-11(15)9-10/h4-6,9H,2-3,7-8H2,1H3 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.20E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211006
(CHEMBL396082 | methyl 2-(naphthalen-2-yl)cyclopent...)Show InChI InChI=1S/C17H16O2/c1-19-17(18)16-8-4-7-15(16)14-10-9-12-5-2-3-6-13(12)11-14/h2-3,5-6,9-11H,4,7-8H2,1H3 | Reactome pathway
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.60E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Inhibition of [3H]DA uptake in human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211024
(CHEMBL231858 | methyl 2-(3-chlorophenyl)cyclohex-1...)Show InChI InChI=1S/C14H15ClO2/c1-17-14(16)13-8-3-2-7-12(13)10-5-4-6-11(15)9-10/h4-6,9H,2-3,7-8H2,1H3 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.60E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Inhibition of [3H]DA uptake in human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211026
(CHEMBL243204 | methyl 3,4-cis-N-methyl-4-phenylpip...)Show InChI InChI=1S/C14H19NO2/c1-15-9-8-12(11-6-4-3-5-7-11)13(10-15)14(16)17-2/h3-7,12-13H,8-10H2,1-2H3/t12-,13-/m1/s1 | PDB
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| CHEMBL
PC cid
PC sid
UniChem
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Similars
| Article
PubMed
| 2.70E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211023
(CHEMBL245061 | methyl 2-(3,4-dichlorophenyl)cyclop...)Show InChI InChI=1S/C13H12Cl2O2/c1-17-13(16)10-4-2-3-9(10)8-5-6-11(14)12(15)7-8/h5-7H,2-4H2,1H3 | Reactome pathway
KEGG
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.80E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Inhibition of [3H]DA uptake in human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211016
(CHEMBL232879 | methyl 2-phenylcyclohex-1-enecarbox...)Show SMILES COC(=O)C1=C(CCCC1)c1cccc(c1)[N+]([O-])=O |t:4| Show InChI InChI=1S/C14H15NO4/c1-19-14(16)13-8-3-2-7-12(13)10-5-4-6-11(9-10)15(17)18/h4-6,9H,2-3,7-8H2,1H3 | PDB
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| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 2.87E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211017
(CHEMBL232299 | methyl 2-(biphenyl-4-yl)cyclohept-1...)Show SMILES COC(=O)C1=C(CCCCC1)c1ccc(cc1)-c1ccccc1 |t:4| Show InChI InChI=1S/C21H22O2/c1-23-21(22)20-11-7-3-6-10-19(20)18-14-12-17(13-15-18)16-8-4-2-5-9-16/h2,4-5,8-9,12-15H,3,6-7,10-11H2,1H3 | PDB
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 3.20E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211032
(CHEMBL232671 | methyl 2-(3-chlorophenyl)cyclopent-...)Show InChI InChI=1S/C13H13ClO2/c1-16-13(15)12-7-3-6-11(12)9-4-2-5-10(14)8-9/h2,4-5,8H,3,6-7H2,1H3 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 3.40E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211026
(CHEMBL243204 | methyl 3,4-cis-N-methyl-4-phenylpip...)Show InChI InChI=1S/C14H19NO2/c1-15-9-8-12(11-6-4-3-5-7-11)13(10-15)14(16)17-2/h3-7,12-13H,8-10H2,1-2H3/t12-,13-/m1/s1 | Reactome pathway
KEGG
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 3.52E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211041
(CHEMBL388255 | methyl 3,4-trans-N-methyl-4-phenylp...)Show InChI InChI=1S/C14H19NO2/c1-15-9-8-12(11-6-4-3-5-7-11)13(10-15)14(16)17-2/h3-7,12-13H,8-10H2,1-2H3/t12-,13+/m0/s1 | Reactome pathway
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 3.63E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211006
(CHEMBL396082 | methyl 2-(naphthalen-2-yl)cyclopent...)Show InChI InChI=1S/C17H16O2/c1-19-17(18)16-8-4-7-15(16)14-10-9-12-5-2-3-6-13(12)11-14/h2-3,5-6,9-11H,4,7-8H2,1H3 | Reactome pathway
KEGG
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 3.90E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211005
((3S,4S)-methyl 4-(3,4-dichlorophenyl)-1-methylpipe...)Show SMILES COC(=O)[C@@H]1CN(C)CC[C@@H]1c1ccc(Cl)c(Cl)c1 Show InChI InChI=1S/C14H17Cl2NO2/c1-17-6-5-10(11(8-17)14(18)19-2)9-3-4-12(15)13(16)7-9/h3-4,7,10-11H,5-6,8H2,1-2H3/t10-,11-/m1/s1 | Reactome pathway
KEGG
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 4.16E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211005
((3S,4S)-methyl 4-(3,4-dichlorophenyl)-1-methylpipe...)Show SMILES COC(=O)[C@@H]1CN(C)CC[C@@H]1c1ccc(Cl)c(Cl)c1 Show InChI InChI=1S/C14H17Cl2NO2/c1-17-6-5-10(11(8-17)14(18)19-2)9-3-4-12(15)13(16)7-9/h3-4,7,10-11H,5-6,8H2,1-2H3/t10-,11-/m1/s1 | Reactome pathway
KEGG
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GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 4.16E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211002
(1,2-dichloro-4-(2-(prop-1-enyl)cyclohex-1-enyl)ben...)Show InChI InChI=1S/C15H16Cl2/c1-2-5-11-6-3-4-7-13(11)12-8-9-14(16)15(17)10-12/h2,5,8-10H,3-4,6-7H2,1H3/b5-2+ | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 4.20E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Inhibition of [3H]DA uptake in human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211041
(CHEMBL388255 | methyl 3,4-trans-N-methyl-4-phenylp...)Show InChI InChI=1S/C14H19NO2/c1-15-9-8-12(11-6-4-3-5-7-11)13(10-15)14(16)17-2/h3-7,12-13H,8-10H2,1-2H3/t12-,13+/m0/s1 | PDB
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 4.67E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50090973
(2-Naphthalen-2-yl-benzoic acid methyl ester | CHEM...)Show InChI InChI=1S/C18H14O2/c1-20-18(19)17-9-5-4-8-16(17)15-11-10-13-6-2-3-7-14(13)12-15/h2-12H,1H3 | Reactome pathway
KEGG
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 4.67E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211030
(CHEMBL232867 | methyl 2-(4-acetylphenyl)cyclopent-...)Show InChI InChI=1S/C15H16O3/c1-10(16)11-6-8-12(9-7-11)13-4-3-5-14(13)15(17)18-2/h6-9H,3-5H2,1-2H3 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 4.90E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Inhibition of [3H]DA uptake in human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211020
(CHEMBL231684 | methyl 2-(biphenyl-4-yl)cycloheptan...)Show SMILES COC(=O)[C@@H]1CCCCC[C@@H]1c1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C21H24O2/c1-23-21(22)20-11-7-3-6-10-19(20)18-14-12-17(13-15-18)16-8-4-2-5-9-16/h2,4-5,8-9,12-15,19-20H,3,6-7,10-11H2,1H3/t19-,20-/m1/s1 | Reactome pathway
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 5.10E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211005
((3S,4S)-methyl 4-(3,4-dichlorophenyl)-1-methylpipe...)Show SMILES COC(=O)[C@@H]1CN(C)CC[C@@H]1c1ccc(Cl)c(Cl)c1 Show InChI InChI=1S/C14H17Cl2NO2/c1-17-6-5-10(11(8-17)14(18)19-2)9-3-4-12(15)13(16)7-9/h3-4,7,10-11H,5-6,8H2,1-2H3/t10-,11-/m1/s1 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 5.94E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211005
((3S,4S)-methyl 4-(3,4-dichlorophenyl)-1-methylpipe...)Show SMILES COC(=O)[C@@H]1CN(C)CC[C@@H]1c1ccc(Cl)c(Cl)c1 Show InChI InChI=1S/C14H17Cl2NO2/c1-17-6-5-10(11(8-17)14(18)19-2)9-3-4-12(15)13(16)7-9/h3-4,7,10-11H,5-6,8H2,1-2H3/t10-,11-/m1/s1 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 5.94E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211015
(CHEMBL232663 | methyl 2-(4-tert-butylphenyl)cycloh...)Show SMILES COC(=O)C1=C(CCCCC1)c1ccc(cc1)C(C)(C)C |t:4| Show InChI InChI=1S/C19H26O2/c1-19(2,3)15-12-10-14(11-13-15)16-8-6-5-7-9-17(16)18(20)21-4/h10-13H,5-9H2,1-4H3 | Reactome pathway
KEGG
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GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 6.20E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211021
(CHEMBL434959 | methyl 2-(naphthalen-2-yl)cyclohept...)Show InChI InChI=1S/C19H20O2/c1-21-19(20)18-10-4-2-3-9-17(18)16-12-11-14-7-5-6-8-15(14)13-16/h5-8,11-13H,2-4,9-10H2,1H3 | Reactome pathway
KEGG
UniProtKB/SwissProt
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GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 6.80E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211020
(CHEMBL231684 | methyl 2-(biphenyl-4-yl)cycloheptan...)Show SMILES COC(=O)[C@@H]1CCCCC[C@@H]1c1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C21H24O2/c1-23-21(22)20-11-7-3-6-10-19(20)18-14-12-17(13-15-18)16-8-4-2-5-9-16/h2,4-5,8-9,12-15,19-20H,3,6-7,10-11H2,1H3/t19-,20-/m1/s1 | PDB
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| CHEMBL
PC cid
PC sid
UniChem
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| Article
PubMed
| 7.30E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211045
(CHEMBL232068 | methyl 2-(naphthalen-2-yl)cyclohex-...)Show InChI InChI=1S/C18H18O2/c1-20-18(19)17-9-5-4-8-16(17)15-11-10-13-6-2-3-7-14(13)12-15/h2-3,6-7,10-12H,4-5,8-9H2,1H3 | Reactome pathway
KEGG
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 8.10E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211037
(CHEMBL398009 | methyl 2-(4-chlorophenyl)cyclohept-...)Show InChI InChI=1S/C15H17ClO2/c1-18-15(17)14-6-4-2-3-5-13(14)11-7-9-12(16)10-8-11/h7-10H,2-6H2,1H3 | Reactome pathway
KEGG
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 8.40E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211008
(CHEMBL232870 | methyl 2-(4-chlorophenyl)cyclohex-1...)Show InChI InChI=1S/C14H15ClO2/c1-17-14(16)13-5-3-2-4-12(13)10-6-8-11(15)9-7-10/h6-9H,2-5H2,1H3 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 8.50E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211013
(CHEMBL396318 | methyl 2-(3-chlorophenyl)cyclohept-...)Show InChI InChI=1S/C15H17ClO2/c1-18-15(17)14-9-4-2-3-8-13(14)11-6-5-7-12(16)10-11/h5-7,10H,2-4,8-9H2,1H3 | Reactome pathway
KEGG
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 8.50E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211040
(CHEMBL234379 | methyl 2-(4-tert-butylphenyl)cycloh...)Show SMILES COC(=O)[C@@H]1CCCCC[C@@H]1c1ccc(cc1)C(C)(C)C Show InChI InChI=1S/C19H28O2/c1-19(2,3)15-12-10-14(11-13-15)16-8-6-5-7-9-17(16)18(20)21-4/h10-13,16-17H,5-9H2,1-4H3/t16-,17-/m1/s1 | Reactome pathway
KEGG
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 9.40E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211045
(CHEMBL232068 | methyl 2-(naphthalen-2-yl)cyclohex-...)Show InChI InChI=1S/C18H18O2/c1-20-18(19)17-9-5-4-8-16(17)15-11-10-13-6-2-3-7-14(13)12-15/h2-3,6-7,10-12H,4-5,8-9H2,1H3 | PDB
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.09E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211047
(CHEMBL232675 | methyl 2-(4-nitrophenyl)cyclopent-1...)Show SMILES COC(=O)C1=C(CCC1)c1ccc(cc1)[N+]([O-])=O |t:4| Show InChI InChI=1S/C13H13NO4/c1-18-13(15)12-4-2-3-11(12)9-5-7-10(8-6-9)14(16)17/h5-8H,2-4H2,1H3 | Reactome pathway
KEGG
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| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 1.11E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211016
(CHEMBL232879 | methyl 2-phenylcyclohex-1-enecarbox...)Show SMILES COC(=O)C1=C(CCCC1)c1cccc(c1)[N+]([O-])=O |t:4| Show InChI InChI=1S/C14H15NO4/c1-19-14(16)13-8-3-2-7-12(13)10-5-4-6-11(9-10)15(17)18/h4-6,9H,2-3,7-8H2,1H3 | Reactome pathway
KEGG
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| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 1.21E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211010
(CHEMBL232674 | methyl 2-(3-aminophenyl)cyclopent-1...)Show InChI InChI=1S/C13H15NO2/c1-16-13(15)12-7-3-6-11(12)9-4-2-5-10(14)8-9/h2,4-5,8H,3,6-7,14H2,1H3 | NCI pathway
Reactome pathway
KEGG
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| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 1.21E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Inhibition of [3H]DA uptake in human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211039
(CHEMBL232672 | methyl 2-(4-methoxyphenyl)cyclopent...)Show InChI InChI=1S/C14H16O3/c1-16-11-8-6-10(7-9-11)12-4-3-5-13(12)14(15)17-2/h6-9H,3-5H2,1-2H3 | NCI pathway
Reactome pathway
KEGG
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.40E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211019
(CHEMBL233088 | methyl 2-(3,4-dichlorophenyl)cycloh...)Show InChI InChI=1S/C15H16Cl2O2/c1-19-15(18)12-6-4-2-3-5-11(12)10-7-8-13(16)14(17)9-10/h7-9H,2-6H2,1H3 | PDB
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.49E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211027
(CHEMBL394585 | methyl 2-(4-chlorophenyl)cyclopent-...)Show InChI InChI=1S/C13H13ClO2/c1-16-13(15)12-4-2-3-11(12)9-5-7-10(14)8-6-9/h5-8H,2-4H2,1H3 | Reactome pathway
KEGG
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.78E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Inhibition of [3H]DA uptake in human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211012
(CHEMBL394373 | methyl 2-(4-(trifluoromethyl)phenyl...)Show SMILES COC(=O)[C@@H]1CCCC[C@@H]1c1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C15H17F3O2/c1-20-14(19)13-5-3-2-4-12(13)10-6-8-11(9-7-10)15(16,17)18/h6-9,12-13H,2-5H2,1H3/t12-,13-/m1/s1 | PDB
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.85E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211022
(2-biphenyl-4-yl-cyclohex-1-enecarboxylic acid meth...)Show SMILES COC(=O)C1=C(CCCC1)c1ccc(cc1)-c1ccccc1 |t:4| Show InChI InChI=1S/C20H20O2/c1-22-20(21)19-10-6-5-9-18(19)17-13-11-16(12-14-17)15-7-3-2-4-8-15/h2-4,7-8,11-14H,5-6,9-10H2,1H3 | Reactome pathway
KEGG
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.15E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211012
(CHEMBL394373 | methyl 2-(4-(trifluoromethyl)phenyl...)Show SMILES COC(=O)[C@@H]1CCCC[C@@H]1c1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C15H17F3O2/c1-20-14(19)13-5-3-2-4-12(13)10-6-8-11(9-7-10)15(16,17)18/h6-9,12-13H,2-5H2,1H3/t12-,13-/m1/s1 | NCI pathway
Reactome pathway
KEGG
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DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.22E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211029
(CHEMBL395910 | methyl 2-(3,4-dichlorophenyl)cycloh...)Show InChI InChI=1S/C14H14Cl2O2/c1-18-14(17)11-5-3-2-4-10(11)9-6-7-12(15)13(16)8-9/h6-8H,2-5H2,1H3 | PDB
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.28E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211009
(CHEMBL395649 | methyl 2-(4-hydroxyphenyl)cyclohex-...)Show InChI InChI=1S/C14H16O3/c1-17-14(16)13-5-3-2-4-12(13)10-6-8-11(15)9-7-10/h6-9,15H,2-5H2,1H3 | NCI pathway
Reactome pathway
KEGG
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.31E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211016
(CHEMBL232879 | methyl 2-phenylcyclohex-1-enecarbox...)Show SMILES COC(=O)C1=C(CCCC1)c1cccc(c1)[N+]([O-])=O |t:4| Show InChI InChI=1S/C14H15NO4/c1-19-14(16)13-8-3-2-7-12(13)10-5-4-6-11(9-10)15(17)18/h4-6,9H,2-3,7-8H2,1H3 | NCI pathway
Reactome pathway
KEGG
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DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 2.39E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211030
(CHEMBL232867 | methyl 2-(4-acetylphenyl)cyclopent-...)Show InChI InChI=1S/C15H16O3/c1-10(16)11-6-8-12(9-7-11)13-4-3-5-14(13)15(17)18-2/h6-9H,3-5H2,1-2H3 | Reactome pathway
KEGG
UniProtKB/SwissProt
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antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.40E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211010
(CHEMBL232674 | methyl 2-(3-aminophenyl)cyclopent-1...)Show InChI InChI=1S/C13H15NO2/c1-16-13(15)12-7-3-6-11(12)9-4-2-5-10(14)8-9/h2,4-5,8H,3,6-7,14H2,1H3 | Reactome pathway
KEGG
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 2.47E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Inhibition of [3H]DA uptake in human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211002
(1,2-dichloro-4-(2-(prop-1-enyl)cyclohex-1-enyl)ben...)Show InChI InChI=1S/C15H16Cl2/c1-2-5-11-6-3-4-7-13(11)12-8-9-14(16)15(17)10-12/h2,5,8-10H,3-4,6-7H2,1H3/b5-2+ | Reactome pathway
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UniChem
| Article
PubMed
| 2.55E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211022
(2-biphenyl-4-yl-cyclohex-1-enecarboxylic acid meth...)Show SMILES COC(=O)C1=C(CCCC1)c1ccc(cc1)-c1ccccc1 |t:4| Show InChI InChI=1S/C20H20O2/c1-22-20(21)19-10-6-5-9-18(19)17-13-11-16(12-14-17)15-7-3-2-4-8-15/h2-4,7-8,11-14H,5-6,9-10H2,1H3 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.64E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211032
(CHEMBL232671 | methyl 2-(3-chlorophenyl)cyclopent-...)Show InChI InChI=1S/C13H13ClO2/c1-16-13(15)12-7-3-6-11(12)9-4-2-5-10(14)8-9/h2,4-5,8H,3,6-7H2,1H3 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.85E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Inhibition of [3H]DA uptake in human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211030
(CHEMBL232867 | methyl 2-(4-acetylphenyl)cyclopent-...)Show InChI InChI=1S/C15H16O3/c1-10(16)11-6-8-12(9-7-11)13-4-3-5-14(13)15(17)18-2/h6-9H,3-5H2,1-2H3 | PDB
KEGG
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DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.96E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211014
(CHEMBL396083 | methyl 2-(4-tert-butylphenyl)cyclop...)Show InChI InChI=1S/C17H22O2/c1-17(2,3)13-10-8-12(9-11-13)14-6-5-7-15(14)16(18)19-4/h8-11H,5-7H2,1-4H3 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 3.02E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211020
(CHEMBL231684 | methyl 2-(biphenyl-4-yl)cycloheptan...)Show SMILES COC(=O)[C@@H]1CCCCC[C@@H]1c1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C21H24O2/c1-23-21(22)20-11-7-3-6-10-19(20)18-14-12-17(13-15-18)16-8-4-2-5-9-16/h2,4-5,8-9,12-15,19-20H,3,6-7,10-11H2,1H3/t19-,20-/m1/s1 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 3.13E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211008
(CHEMBL232870 | methyl 2-(4-chlorophenyl)cyclohex-1...)Show InChI InChI=1S/C14H15ClO2/c1-17-14(16)13-5-3-2-4-12(13)10-6-8-11(15)9-7-10/h6-9H,2-5H2,1H3 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 3.14E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Inhibition of [3H]DA uptake in human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211030
(CHEMBL232867 | methyl 2-(4-acetylphenyl)cyclopent-...)Show InChI InChI=1S/C15H16O3/c1-10(16)11-6-8-12(9-7-11)13-4-3-5-14(13)15(17)18-2/h6-9H,3-5H2,1-2H3 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 3.35E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211024
(CHEMBL231858 | methyl 2-(3-chlorophenyl)cyclohex-1...)Show InChI InChI=1S/C14H15ClO2/c1-17-14(16)13-8-3-2-7-12(13)10-5-4-6-11(15)9-10/h4-6,9H,2-3,7-8H2,1H3 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 3.39E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211002
(1,2-dichloro-4-(2-(prop-1-enyl)cyclohex-1-enyl)ben...)Show InChI InChI=1S/C15H16Cl2/c1-2-5-11-6-3-4-7-13(11)12-8-9-14(16)15(17)10-12/h2,5,8-10H,3-4,6-7H2,1H3/b5-2+ | PDB
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 3.81E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211028
(CHEMBL233532 | methyl 2-(biphenyl-4-yl)cyclohexane...)Show SMILES COC(=O)[C@@H]1CCCC[C@@H]1c1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C20H22O2/c1-22-20(21)19-10-6-5-9-18(19)17-13-11-16(12-14-17)15-7-3-2-4-8-15/h2-4,7-8,11-14,18-19H,5-6,9-10H2,1H3/t18-,19-/m1/s1 | PDB
KEGG
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GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 3.90E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211021
(CHEMBL434959 | methyl 2-(naphthalen-2-yl)cyclohept...)Show InChI InChI=1S/C19H20O2/c1-21-19(20)18-10-4-2-3-9-17(18)16-12-11-14-7-5-6-8-15(14)13-16/h5-8,11-13H,2-4,9-10H2,1H3 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 3.92E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211006
(CHEMBL396082 | methyl 2-(naphthalen-2-yl)cyclopent...)Show InChI InChI=1S/C17H16O2/c1-19-17(18)16-8-4-7-15(16)14-10-9-12-5-2-3-6-13(12)11-14/h2-3,5-6,9-11H,4,7-8H2,1H3 | PDB
KEGG
UniProtKB/SwissProt
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antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 4.17E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211027
(CHEMBL394585 | methyl 2-(4-chlorophenyl)cyclopent-...)Show InChI InChI=1S/C13H13ClO2/c1-16-13(15)12-4-2-3-11(12)9-5-7-10(14)8-6-9/h5-8H,2-4H2,1H3 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 4.20E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211012
(CHEMBL394373 | methyl 2-(4-(trifluoromethyl)phenyl...)Show SMILES COC(=O)[C@@H]1CCCC[C@@H]1c1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C15H17F3O2/c1-20-14(19)13-5-3-2-4-12(13)10-6-8-11(9-7-10)15(16,17)18/h6-9,12-13H,2-5H2,1H3/t12-,13-/m1/s1 | Reactome pathway
KEGG
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 4.39E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211013
(CHEMBL396318 | methyl 2-(3-chlorophenyl)cyclohept-...)Show InChI InChI=1S/C15H17ClO2/c1-18-15(17)14-9-4-2-3-8-13(14)11-6-5-7-12(16)10-11/h5-7,10H,2-4,8-9H2,1H3 | PDB
KEGG
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GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 4.63E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211032
(CHEMBL232671 | methyl 2-(3-chlorophenyl)cyclopent-...)Show InChI InChI=1S/C13H13ClO2/c1-16-13(15)12-7-3-6-11(12)9-4-2-5-10(14)8-9/h2,4-5,8H,3,6-7H2,1H3 | Reactome pathway
KEGG
UniProtKB/SwissProt
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GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 4.70E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211009
(CHEMBL395649 | methyl 2-(4-hydroxyphenyl)cyclohex-...)Show InChI InChI=1S/C14H16O3/c1-17-14(16)13-5-3-2-4-12(13)10-6-8-11(15)9-7-10/h6-9,15H,2-5H2,1H3 | Reactome pathway
KEGG
UniProtKB/SwissProt
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antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 4.99E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Inhibition of [3H]DA uptake in human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211021
(CHEMBL434959 | methyl 2-(naphthalen-2-yl)cyclohept...)Show InChI InChI=1S/C19H20O2/c1-21-19(20)18-10-4-2-3-9-17(18)16-12-11-14-7-5-6-8-15(14)13-16/h5-8,11-13H,2-4,9-10H2,1H3 | PDB
KEGG
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GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 5.32E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211039
(CHEMBL232672 | methyl 2-(4-methoxyphenyl)cyclopent...)Show InChI InChI=1S/C14H16O3/c1-16-11-8-6-10(7-9-11)12-4-3-5-13(12)14(15)17-2/h6-9H,3-5H2,1-2H3 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 5.50E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211018
(CHEMBL393701 | methyl 2-(3-(trifluoromethyl)phenyl...)Show SMILES COC(=O)[C@@H]1CCCC[C@@H]1c1cccc(c1)C(F)(F)F Show InChI InChI=1S/C15H17F3O2/c1-20-14(19)13-8-3-2-7-12(13)10-5-4-6-11(9-10)15(16,17)18/h4-6,9,12-13H,2-3,7-8H2,1H3/t12-,13-/m1/s1 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 5.69E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211009
(CHEMBL395649 | methyl 2-(4-hydroxyphenyl)cyclohex-...)Show InChI InChI=1S/C14H16O3/c1-17-14(16)13-5-3-2-4-12(13)10-6-8-11(15)9-7-10/h6-9,15H,2-5H2,1H3 | PDB
KEGG
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GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 5.73E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211004
(CHEMBL438321 | methyl 2-(4-(trifluoromethyl)phenyl...)Show InChI InChI=1S/C15H15F3O2/c1-20-14(19)13-5-3-2-4-12(13)10-6-8-11(9-7-10)15(16,17)18/h6-9H,2-5H2,1H3 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 5.90E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211033
(CHEMBL442234 | methyl 2-(4-(trifluoromethoxy)pheny...)Show SMILES COC(=O)[C@@H]1CCCC[C@@H]1c1ccc(OC(F)(F)F)cc1 Show InChI InChI=1S/C15H17F3O3/c1-20-14(19)13-5-3-2-4-12(13)10-6-8-11(9-7-10)21-15(16,17)18/h6-9,12-13H,2-5H2,1H3/t12-,13-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 6.05E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211036
(CHEMBL232070 | methyl 2-(4-tert-butylphenyl)cycloh...)Show InChI InChI=1S/C18H24O2/c1-18(2,3)14-11-9-13(10-12-14)15-7-5-6-8-16(15)17(19)20-4/h9-12H,5-8H2,1-4H3 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 6.05E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50090973
(2-Naphthalen-2-yl-benzoic acid methyl ester | CHEM...)Show InChI InChI=1S/C18H14O2/c1-20-18(19)17-9-5-4-8-16(17)15-11-10-13-6-2-3-7-14(13)12-15/h2-12H,1H3 | PDB
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antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 6.20E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211034
(CHEMBL234127 | methyl 2-phenylcyclohex-1-enecarbox...)Show InChI InChI=1S/C14H16O2/c1-16-14(15)13-10-6-5-9-12(13)11-7-3-2-4-8-11/h2-4,7-8H,5-6,9-10H2,1H3 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 6.30E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211030
(CHEMBL232867 | methyl 2-(4-acetylphenyl)cyclopent-...)Show InChI InChI=1S/C15H16O3/c1-10(16)11-6-8-12(9-7-11)13-4-3-5-14(13)15(17)18-2/h6-9H,3-5H2,1-2H3 | Reactome pathway
KEGG
UniProtKB/SwissProt
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antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 6.46E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Inhibition of [3H]DA uptake in human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211028
(CHEMBL233532 | methyl 2-(biphenyl-4-yl)cyclohexane...)Show SMILES COC(=O)[C@@H]1CCCC[C@@H]1c1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C20H22O2/c1-22-20(21)19-10-6-5-9-18(19)17-13-11-16(12-14-17)15-7-3-2-4-8-15/h2-4,7-8,11-14,18-19H,5-6,9-10H2,1H3/t18-,19-/m1/s1 | Reactome pathway
KEGG
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antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 6.58E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211034
(CHEMBL234127 | methyl 2-phenylcyclohex-1-enecarbox...)Show InChI InChI=1S/C14H16O2/c1-16-14(15)13-10-6-5-9-12(13)11-7-3-2-4-8-11/h2-4,7-8H,5-6,9-10H2,1H3 | PDB
KEGG
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GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 6.68E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211007
(CHEMBL394089 | methyl 2-(4-tert-butylphenyl)cycloh...)Show SMILES COC(=O)[C@@H]1CCCC[C@@H]1c1ccc(cc1)C(C)(C)C Show InChI InChI=1S/C18H26O2/c1-18(2,3)14-11-9-13(10-12-14)15-7-5-6-8-16(15)17(19)20-4/h9-12,15-16H,5-8H2,1-4H3/t15-,16-/m1/s1 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 6.75E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211009
(CHEMBL395649 | methyl 2-(4-hydroxyphenyl)cyclohex-...)Show InChI InChI=1S/C14H16O3/c1-17-14(16)13-5-3-2-4-12(13)10-6-8-11(15)9-7-10/h6-9,15H,2-5H2,1H3 | Reactome pathway
KEGG
UniProtKB/SwissProt
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antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 6.75E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211037
(CHEMBL398009 | methyl 2-(4-chlorophenyl)cyclohept-...)Show InChI InChI=1S/C15H17ClO2/c1-18-15(17)14-6-4-2-3-5-13(14)11-7-9-12(16)10-8-11/h7-10H,2-6H2,1H3 | PDB
KEGG
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GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 7.06E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211033
(CHEMBL442234 | methyl 2-(4-(trifluoromethoxy)pheny...)Show SMILES COC(=O)[C@@H]1CCCC[C@@H]1c1ccc(OC(F)(F)F)cc1 Show InChI InChI=1S/C15H17F3O3/c1-20-14(19)13-5-3-2-4-12(13)10-6-8-11(9-7-10)21-15(16,17)18/h6-9,12-13H,2-5H2,1H3/t12-,13-/m1/s1 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 7.19E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211007
(CHEMBL394089 | methyl 2-(4-tert-butylphenyl)cycloh...)Show SMILES COC(=O)[C@@H]1CCCC[C@@H]1c1ccc(cc1)C(C)(C)C Show InChI InChI=1S/C18H26O2/c1-18(2,3)14-11-9-13(10-12-14)15-7-5-6-8-16(15)17(19)20-4/h9-12,15-16H,5-8H2,1-4H3/t15-,16-/m1/s1 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 7.66E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211023
(CHEMBL245061 | methyl 2-(3,4-dichlorophenyl)cyclop...)Show InChI InChI=1S/C13H12Cl2O2/c1-17-13(16)10-4-2-3-9(10)8-5-6-11(14)12(15)7-8/h5-7H,2-4H2,1H3 | PDB
KEGG
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 7.85E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211014
(CHEMBL396083 | methyl 2-(4-tert-butylphenyl)cyclop...)Show InChI InChI=1S/C17H22O2/c1-17(2,3)13-10-8-12(9-11-13)14-6-5-7-15(14)16(18)19-4/h8-11H,5-7H2,1-4H3 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 7.89E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211028
(CHEMBL233532 | methyl 2-(biphenyl-4-yl)cyclohexane...)Show SMILES COC(=O)[C@@H]1CCCC[C@@H]1c1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C20H22O2/c1-22-20(21)19-10-6-5-9-18(19)17-13-11-16(12-14-17)15-7-3-2-4-8-15/h2-4,7-8,11-14,18-19H,5-6,9-10H2,1H3/t18-,19-/m1/s1 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 8.30E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211022
(2-biphenyl-4-yl-cyclohex-1-enecarboxylic acid meth...)Show SMILES COC(=O)C1=C(CCCC1)c1ccc(cc1)-c1ccccc1 |t:4| Show InChI InChI=1S/C20H20O2/c1-22-20(21)19-10-6-5-9-18(19)17-13-11-16(12-14-17)15-7-3-2-4-8-15/h2-4,7-8,11-14H,5-6,9-10H2,1H3 | PDB
KEGG
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antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 8.41E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211024
(CHEMBL231858 | methyl 2-(3-chlorophenyl)cyclohex-1...)Show InChI InChI=1S/C14H15ClO2/c1-17-14(16)13-8-3-2-7-12(13)10-5-4-6-11(15)9-10/h4-6,9H,2-3,7-8H2,1H3 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 8.71E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Inhibition of [3H]DA uptake in human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211010
(CHEMBL232674 | methyl 2-(3-aminophenyl)cyclopent-1...)Show InChI InChI=1S/C13H15NO2/c1-16-13(15)12-7-3-6-11(12)9-4-2-5-10(14)8-9/h2,4-5,8H,3,6-7,14H2,1H3 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 8.75E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211015
(CHEMBL232663 | methyl 2-(4-tert-butylphenyl)cycloh...)Show SMILES COC(=O)C1=C(CCCCC1)c1ccc(cc1)C(C)(C)C |t:4| Show InChI InChI=1S/C19H26O2/c1-19(2,3)15-12-10-14(11-13-15)16-8-6-5-7-9-17(16)18(20)21-4/h10-13H,5-9H2,1-4H3 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 8.84E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211043
(CHEMBL233530 | methyl 2-phenylcyclohexanecarboxyla...)Show InChI InChI=1S/C14H18O2/c1-16-14(15)13-10-6-5-9-12(13)11-7-3-2-4-8-11/h2-4,7-8,12-13H,5-6,9-10H2,1H3/t12-,13-/m1/s1 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 9.75E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211018
(CHEMBL393701 | methyl 2-(3-(trifluoromethyl)phenyl...)Show SMILES COC(=O)[C@@H]1CCCC[C@@H]1c1cccc(c1)C(F)(F)F Show InChI InChI=1S/C15H17F3O2/c1-20-14(19)13-8-3-2-7-12(13)10-5-4-6-11(9-10)15(16,17)18/h4-6,9,12-13H,2-3,7-8H2,1H3/t12-,13-/m1/s1 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 9.91E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211008
(CHEMBL232870 | methyl 2-(4-chlorophenyl)cyclohex-1...)Show InChI InChI=1S/C14H15ClO2/c1-17-14(16)13-5-3-2-4-12(13)10-6-8-11(15)9-7-10/h6-9H,2-5H2,1H3 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 9.93E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211015
(CHEMBL232663 | methyl 2-(4-tert-butylphenyl)cycloh...)Show SMILES COC(=O)C1=C(CCCCC1)c1ccc(cc1)C(C)(C)C |t:4| Show InChI InChI=1S/C19H26O2/c1-19(2,3)15-12-10-14(11-13-15)16-8-6-5-7-9-17(16)18(20)21-4/h10-13H,5-9H2,1-4H3 | PDB
KEGG
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antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.04E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211025
(CHEMBL234128 | methyl 2-(3-(trifluoromethyl)phenyl...)Show InChI InChI=1S/C15H15F3O2/c1-20-14(19)13-8-3-2-7-12(13)10-5-4-6-11(9-10)15(16,17)18/h4-6,9H,2-3,7-8H2,1H3 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.05E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211036
(CHEMBL232070 | methyl 2-(4-tert-butylphenyl)cycloh...)Show InChI InChI=1S/C18H24O2/c1-18(2,3)14-11-9-13(10-12-14)15-7-5-6-8-16(15)17(19)20-4/h9-12H,5-8H2,1-4H3 | Reactome pathway
KEGG
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antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.10E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211040
(CHEMBL234379 | methyl 2-(4-tert-butylphenyl)cycloh...)Show SMILES COC(=O)[C@@H]1CCCCC[C@@H]1c1ccc(cc1)C(C)(C)C Show InChI InChI=1S/C19H28O2/c1-19(2,3)15-12-10-14(11-13-15)16-8-6-5-7-9-17(16)18(20)21-4/h10-13,16-17H,5-9H2,1-4H3/t16-,17-/m1/s1 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.14E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211047
(CHEMBL232675 | methyl 2-(4-nitrophenyl)cyclopent-1...)Show SMILES COC(=O)C1=C(CCC1)c1ccc(cc1)[N+]([O-])=O |t:4| Show InChI InChI=1S/C13H13NO4/c1-18-13(15)12-4-2-3-11(12)9-5-7-10(8-6-9)14(16)17/h5-8H,2-4H2,1H3 | PDB
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| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 1.14E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211030
(CHEMBL232867 | methyl 2-(4-acetylphenyl)cyclopent-...)Show InChI InChI=1S/C15H16O3/c1-10(16)11-6-8-12(9-7-11)13-4-3-5-14(13)15(17)18-2/h6-9H,3-5H2,1-2H3 | PDB
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.16E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Inhibition of [3H]SER uptake in human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211024
(CHEMBL231858 | methyl 2-(3-chlorophenyl)cyclohex-1...)Show InChI InChI=1S/C14H15ClO2/c1-17-14(16)13-8-3-2-7-12(13)10-5-4-6-11(15)9-10/h4-6,9H,2-3,7-8H2,1H3 | PDB
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.18E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211033
(CHEMBL442234 | methyl 2-(4-(trifluoromethoxy)pheny...)Show SMILES COC(=O)[C@@H]1CCCC[C@@H]1c1ccc(OC(F)(F)F)cc1 Show InChI InChI=1S/C15H17F3O3/c1-20-14(19)13-5-3-2-4-12(13)10-6-8-11(9-7-10)21-15(16,17)18/h6-9,12-13H,2-5H2,1H3/t12-,13-/m1/s1 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 1.18E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211010
(CHEMBL232674 | methyl 2-(3-aminophenyl)cyclopent-1...)Show InChI InChI=1S/C13H15NO2/c1-16-13(15)12-7-3-6-11(12)9-4-2-5-10(14)8-9/h2,4-5,8H,3,6-7,14H2,1H3 | Reactome pathway
KEGG
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 1.32E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211043
(CHEMBL233530 | methyl 2-phenylcyclohexanecarboxyla...)Show InChI InChI=1S/C14H18O2/c1-16-14(15)13-10-6-5-9-12(13)11-7-3-2-4-8-11/h2-4,7-8,12-13H,5-6,9-10H2,1H3/t12-,13-/m1/s1 | Reactome pathway
KEGG
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.36E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211039
(CHEMBL232672 | methyl 2-(4-methoxyphenyl)cyclopent...)Show InChI InChI=1S/C14H16O3/c1-16-11-8-6-10(7-9-11)12-4-3-5-13(12)14(15)17-2/h6-9H,3-5H2,1-2H3 | Reactome pathway
KEGG
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.39E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Inhibition of [3H]DA uptake in human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211014
(CHEMBL396083 | methyl 2-(4-tert-butylphenyl)cyclop...)Show InChI InChI=1S/C17H22O2/c1-17(2,3)13-10-8-12(9-11-13)14-6-5-7-15(14)16(18)19-4/h8-11H,5-7H2,1-4H3 | PDB
KEGG
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GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.46E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211043
(CHEMBL233530 | methyl 2-phenylcyclohexanecarboxyla...)Show InChI InChI=1S/C14H18O2/c1-16-14(15)13-10-6-5-9-12(13)11-7-3-2-4-8-11/h2-4,7-8,12-13H,5-6,9-10H2,1H3/t12-,13-/m1/s1 | PDB
KEGG
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GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.51E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211044
(CHEMBL397520 | methyl 2-(4-(trifluoromethoxy)pheny...)Show SMILES COC(=O)C1=C(CCCC1)c1ccc(OC(F)(F)F)cc1 |t:4| Show InChI InChI=1S/C15H15F3O3/c1-20-14(19)13-5-3-2-4-12(13)10-6-8-11(9-7-10)21-15(16,17)18/h6-9H,2-5H2,1H3 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.66E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211040
(CHEMBL234379 | methyl 2-(4-tert-butylphenyl)cycloh...)Show SMILES COC(=O)[C@@H]1CCCCC[C@@H]1c1ccc(cc1)C(C)(C)C Show InChI InChI=1S/C19H28O2/c1-19(2,3)15-12-10-14(11-13-15)16-8-6-5-7-9-17(16)18(20)21-4/h10-13,16-17H,5-9H2,1-4H3/t16-,17-/m1/s1 | PDB
KEGG
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GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.80E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211008
(CHEMBL232870 | methyl 2-(4-chlorophenyl)cyclohex-1...)Show InChI InChI=1S/C14H15ClO2/c1-17-14(16)13-5-3-2-4-12(13)10-6-8-11(15)9-7-10/h6-9H,2-5H2,1H3 | PDB
KEGG
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.86E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211018
(CHEMBL393701 | methyl 2-(3-(trifluoromethyl)phenyl...)Show SMILES COC(=O)[C@@H]1CCCC[C@@H]1c1cccc(c1)C(F)(F)F Show InChI InChI=1S/C15H17F3O2/c1-20-14(19)13-8-3-2-7-12(13)10-5-4-6-11(9-10)15(16,17)18/h4-6,9,12-13H,2-3,7-8H2,1H3/t12-,13-/m1/s1 | PDB
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.91E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211010
(CHEMBL232674 | methyl 2-(3-aminophenyl)cyclopent-1...)Show InChI InChI=1S/C13H15NO2/c1-16-13(15)12-7-3-6-11(12)9-4-2-5-10(14)8-9/h2,4-5,8H,3,6-7,14H2,1H3 | PDB
KEGG
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 1.95E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211004
(CHEMBL438321 | methyl 2-(4-(trifluoromethyl)phenyl...)Show InChI InChI=1S/C15H15F3O2/c1-20-14(19)13-5-3-2-4-12(13)10-6-8-11(9-7-10)15(16,17)18/h6-9H,2-5H2,1H3 | Reactome pathway
KEGG
UniProtKB/SwissProt
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GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.02E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211025
(CHEMBL234128 | methyl 2-(3-(trifluoromethyl)phenyl...)Show InChI InChI=1S/C15H15F3O2/c1-20-14(19)13-8-3-2-7-12(13)10-5-4-6-11(9-10)15(16,17)18/h4-6,9H,2-3,7-8H2,1H3 | Reactome pathway
KEGG
UniProtKB/SwissProt
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GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.11E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211032
(CHEMBL232671 | methyl 2-(3-chlorophenyl)cyclopent-...)Show InChI InChI=1S/C13H13ClO2/c1-16-13(15)12-7-3-6-11(12)9-4-2-5-10(14)8-9/h2,4-5,8H,3,6-7H2,1H3 | PDB
KEGG
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.24E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211036
(CHEMBL232070 | methyl 2-(4-tert-butylphenyl)cycloh...)Show InChI InChI=1S/C18H24O2/c1-18(2,3)14-11-9-13(10-12-14)15-7-5-6-8-16(15)17(19)20-4/h9-12H,5-8H2,1-4H3 | PDB
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.25E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211034
(CHEMBL234127 | methyl 2-phenylcyclohex-1-enecarbox...)Show InChI InChI=1S/C14H16O2/c1-16-14(15)13-10-6-5-9-12(13)11-7-3-2-4-8-11/h2-4,7-8H,5-6,9-10H2,1H3 | Reactome pathway
KEGG
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GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.50E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211044
(CHEMBL397520 | methyl 2-(4-(trifluoromethoxy)pheny...)Show SMILES COC(=O)C1=C(CCCC1)c1ccc(OC(F)(F)F)cc1 |t:4| Show InChI InChI=1S/C15H15F3O3/c1-20-14(19)13-5-3-2-4-12(13)10-6-8-11(9-7-10)21-15(16,17)18/h6-9H,2-5H2,1H3 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
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GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.54E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50211038
(CHEMBL232866 | methyl 2-(4-(trifluoromethoxy)pheny...)Show InChI InChI=1S/C14H13F3O3/c1-19-13(18)12-4-2-3-11(12)9-5-7-10(8-6-9)20-14(15,16)17/h5-8H,2-4H2,1H3 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.65E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211039
(CHEMBL232672 | methyl 2-(4-methoxyphenyl)cyclopent...)Show InChI InChI=1S/C14H16O3/c1-16-11-8-6-10(7-9-11)12-4-3-5-13(12)14(15)17-2/h6-9H,3-5H2,1-2H3 | PDB
KEGG
UniProtKB/SwissProt
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antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.69E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211027
(CHEMBL394585 | methyl 2-(4-chlorophenyl)cyclopent-...)Show InChI InChI=1S/C13H13ClO2/c1-16-13(15)12-4-2-3-11(12)9-5-7-10(14)8-6-9/h5-8H,2-4H2,1H3 | PDB
KEGG
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GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.84E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50211038
(CHEMBL232866 | methyl 2-(4-(trifluoromethoxy)pheny...)Show InChI InChI=1S/C14H13F3O3/c1-19-13(18)12-4-2-3-11(12)9-5-7-10(8-6-9)20-14(15,16)17/h5-8H,2-4H2,1H3 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.88E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211010
(CHEMBL232674 | methyl 2-(3-aminophenyl)cyclopent-1...)Show InChI InChI=1S/C13H15NO2/c1-16-13(15)12-7-3-6-11(12)9-4-2-5-10(14)8-9/h2,4-5,8H,3,6-7,14H2,1H3 | PDB
KEGG
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 2.90E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Inhibition of [3H]SER uptake in human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211048
(CHEMBL397787 | methyl 2-(4-(methylsulfonyl)phenyl)...)Show SMILES COC(=O)C1=C(CCC1)c1ccc(cc1)S(C)(=O)=O |t:4| Show InChI InChI=1S/C14H16O4S/c1-18-14(15)13-5-3-4-12(13)10-6-8-11(9-7-10)19(2,16)17/h6-9H,3-5H2,1-2H3 | PDB
KEGG
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 3.39E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211038
(CHEMBL232866 | methyl 2-(4-(trifluoromethoxy)pheny...)Show InChI InChI=1S/C14H13F3O3/c1-19-13(18)12-4-2-3-11(12)9-5-7-10(8-6-9)20-14(15,16)17/h5-8H,2-4H2,1H3 | PDB
KEGG
UniProtKB/SwissProt
DrugBank
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GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 3.80E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211044
(CHEMBL397520 | methyl 2-(4-(trifluoromethoxy)pheny...)Show SMILES COC(=O)C1=C(CCCC1)c1ccc(OC(F)(F)F)cc1 |t:4| Show InChI InChI=1S/C15H15F3O3/c1-20-14(19)13-5-3-2-4-12(13)10-6-8-11(9-7-10)21-15(16,17)18/h6-9H,2-5H2,1H3 | PDB
KEGG
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GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 4.68E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211004
(CHEMBL438321 | methyl 2-(4-(trifluoromethyl)phenyl...)Show InChI InChI=1S/C15H15F3O2/c1-20-14(19)13-5-3-2-4-12(13)10-6-8-11(9-7-10)15(16,17)18/h6-9H,2-5H2,1H3 | PDB
KEGG
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GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 4.71E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211025
(CHEMBL234128 | methyl 2-(3-(trifluoromethyl)phenyl...)Show InChI InChI=1S/C15H15F3O2/c1-20-14(19)13-8-3-2-7-12(13)10-5-4-6-11(9-10)15(16,17)18/h4-6,9H,2-3,7-8H2,1H3 | PDB
KEGG
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GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 5.02E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50211007
(CHEMBL394089 | methyl 2-(4-tert-butylphenyl)cycloh...)Show SMILES COC(=O)[C@@H]1CCCC[C@@H]1c1ccc(cc1)C(C)(C)C Show InChI InChI=1S/C18H26O2/c1-18(2,3)14-11-9-13(10-12-14)15-7-5-6-8-16(15)17(19)20-4/h9-12,15-16H,5-8H2,1-4H3/t15-,16-/m1/s1 | PDB
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 9.12E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus
Curated by ChEMBL
| Assay Description
Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane |
Bioorg Med Chem 15: 4159-74 (2007)
Article DOI: 10.1016/j.bmc.2007.03.069
BindingDB Entry DOI: 10.7270/Q2ZC83PB |
More data for this
Ligand-Target Pair | |
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