Found 657 hits with Last Name = 'gille' and Initial = 'a' 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 serotonin transporter
(Homo sapiens (Human)) | BDBM84745
(CAS_136434-34-9 | DULOXETINE | LY-248686 | LY24868...)Show InChI InChI=1S/C18H19NOS/c1-19-12-11-17(18-10-5-13-21-18)20-16-9-4-7-14-6-2-3-8-15(14)16/h2-10,13,17,19H,11-12H2,1H3/t17-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
DrugBank MCE PC cid PC sid PDB UniChem
Patents
Similars
| DrugBank Article PubMed
| 0.790 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description Ability to inhibit [3H]-paroxetine binding to cloned human serotonin (5-HT) transporter |
Bioorg Med Chem Lett 14: 3481-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.04.066 BindingDB Entry DOI: 10.7270/Q24Q7TFH |
More data for this Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50148370
(5-((S)-3-Methylamino-1-thiophen-2-yl-propoxy)-naph...)Show InChI InChI=1S/C18H19NO2S/c1-19-10-9-17(18-6-3-11-22-18)21-16-5-2-4-13-12-14(20)7-8-15(13)16/h2-8,11-12,17,19-20H,9-10H2,1H3/t17-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 1.06 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description Ability to inhibit [3H]-paroxetine binding to cloned human serototnin (5-HT) transporter; Average of two experiments |
Bioorg Med Chem Lett 14: 3481-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.04.066 BindingDB Entry DOI: 10.7270/Q24Q7TFH |
More data for this Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50148369
(1-Methoxy-5-((S)-3-methylamino-1-thiophen-2-yl-pro...)Show InChI InChI=1S/C19H21NO3S/c1-20-11-10-17(18-7-4-12-24-18)23-16-6-3-5-14-13(16)8-9-15(21)19(14)22-2/h3-9,12,17,20-21H,10-11H2,1-2H3/t17-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 3.66 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description Ability to inhibit [3H]-paroxetine binding to cloned human serototnin (5-HT) transporter; Average of two experiments |
Bioorg Med Chem Lett 14: 3481-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.04.066 BindingDB Entry DOI: 10.7270/Q24Q7TFH |
More data for this Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50148370
(5-((S)-3-Methylamino-1-thiophen-2-yl-propoxy)-naph...)Show InChI InChI=1S/C18H19NO2S/c1-19-10-9-17(18-6-3-11-22-18)21-16-5-2-4-13-12-14(20)7-8-15(13)16/h2-8,11-12,17,19-20H,9-10H2,1H3/t17-/m0/s1 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 4.72 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description Ability to inhibit [3H]-nisoxatine binding to cloned human norepinephrine (NE) transporter; Average of two experiments |
Bioorg Med Chem Lett 14: 3481-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.04.066 BindingDB Entry DOI: 10.7270/Q24Q7TFH |
More data for this Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM84745
(CAS_136434-34-9 | DULOXETINE | LY-248686 | LY24868...)Show InChI InChI=1S/C18H19NOS/c1-19-12-11-17(18-10-5-13-21-18)20-16-9-4-7-14-6-2-3-8-15(14)16/h2-10,13,17,19H,11-12H2,1H3/t17-/m0/s1 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
DrugBank MCE PC cid PC sid PDB UniChem
Patents
Similars
| DrugBank Article PubMed
| 7.45 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description Ability to inhibit [3H]-nisoxatine binding to cloned human norepinephrine (NE) transporter |
Bioorg Med Chem Lett 14: 3481-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.04.066 BindingDB Entry DOI: 10.7270/Q24Q7TFH |
More data for this Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50148377
(5-((S)-3-Methylamino-1-thiophen-2-yl-propoxy)-naph...)Show InChI InChI=1S/C18H19NO2S/c1-19-11-10-17(18-9-4-12-22-18)21-16-8-3-5-13-14(16)6-2-7-15(13)20/h2-9,12,17,19-20H,10-11H2,1H3/t17-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 9.60 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description Ability to inhibit [3H]-paroxetine binding to cloned human serototnin (5-HT) transporter; Average of two experiments |
Bioorg Med Chem Lett 14: 3481-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.04.066 BindingDB Entry DOI: 10.7270/Q24Q7TFH |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-2
(Homo sapiens (Human)) | BDBM50049757
(()-2-(6-Chloro-pyridin-3-yl)-7-aza-bicyclo[2.2.1]h...)Show InChI InChI=1S/C11H13ClN2/c12-11-4-1-7(6-13-11)9-5-8-2-3-10(9)14-8/h1,4,6,8-10,14H,2-3,5H2 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid PDB UniChem
Patents
Similars
| PDB PubMed
| 10.2 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
SIBIA Neurosciences, Inc.
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 284: 777-89 (1998)
BindingDB Entry DOI: 10.7270/Q28G8J7Q |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50148377
(5-((S)-3-Methylamino-1-thiophen-2-yl-propoxy)-naph...)Show InChI InChI=1S/C18H19NO2S/c1-19-11-10-17(18-9-4-12-22-18)21-16-8-3-5-13-14(16)6-2-7-15(13)20/h2-9,12,17,19-20H,10-11H2,1H3/t17-/m0/s1 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 18.4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description Ability to inhibit [3H]-nisoxatine binding to cloned human norepinephrine (NE) transporter; Average of two experiments |
Bioorg Med Chem Lett 14: 3481-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.04.066 BindingDB Entry DOI: 10.7270/Q24Q7TFH |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-4
(Homo sapiens (Human)) | BDBM50049757
(()-2-(6-Chloro-pyridin-3-yl)-7-aza-bicyclo[2.2.1]h...)Show InChI InChI=1S/C11H13ClN2/c12-11-4-1-7(6-13-11)9-5-8-2-3-10(9)14-8/h1,4,6,8-10,14H,2-3,5H2 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid PDB UniChem
Patents
Similars
| PubMed
| 38.3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
SIBIA Neurosciences, Inc.
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 284: 777-89 (1998)
BindingDB Entry DOI: 10.7270/Q28G8J7Q |
More data for this Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50148379
(4-((S)-3-Methylamino-1-thiophen-2-yl-propoxy)-naph...)Show InChI InChI=1S/C18H19NO2S/c1-19-11-10-17(18-7-4-12-22-18)21-16-9-8-15(20)13-5-2-3-6-14(13)16/h2-9,12,17,19-20H,10-11H2,1H3/t17-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL MCE PC cid PC sid UniChem
Similars
| Article PubMed
| 63.9 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description Ability to inhibit [3H]-paroxetine binding to cloned human serototnin (5-HT) transporter; Average of two experiments |
Bioorg Med Chem Lett 14: 3481-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.04.066 BindingDB Entry DOI: 10.7270/Q24Q7TFH |
More data for this Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50148379
(4-((S)-3-Methylamino-1-thiophen-2-yl-propoxy)-naph...)Show InChI InChI=1S/C18H19NO2S/c1-19-11-10-17(18-7-4-12-22-18)21-16-9-8-15(20)13-5-2-3-6-14(13)16/h2-9,12,17,19-20H,10-11H2,1H3/t17-/m0/s1 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL MCE PC cid PC sid UniChem
Similars
| Article PubMed
| 97.1 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description Ability to inhibit [3H]-nisoxatine binding to cloned human norepinephrine (NE) transporter; Average of two experiments |
Bioorg Med Chem Lett 14: 3481-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.04.066 BindingDB Entry DOI: 10.7270/Q24Q7TFH |
More data for this Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50148373
(5-((S)-3-Methylamino-1-thiophen-2-yl-propoxy)-naph...)Show InChI InChI=1S/C18H19NO3S/c1-19-10-9-16(17-6-3-11-23-17)22-15-5-2-4-13-12(15)7-8-14(20)18(13)21/h2-8,11,16,19-21H,9-10H2,1H3/t16-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 120 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description Ability to inhibit [3H]-mazindol binding to cloned human dopamine (DA) transporter |
Bioorg Med Chem Lett 14: 3481-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.04.066 BindingDB Entry DOI: 10.7270/Q24Q7TFH |
More data for this Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50148373
(5-((S)-3-Methylamino-1-thiophen-2-yl-propoxy)-naph...)Show InChI InChI=1S/C18H19NO3S/c1-19-10-9-16(17-6-3-11-23-17)22-15-5-2-4-13-12(15)7-8-14(20)18(13)21/h2-8,11,16,19-21H,9-10H2,1H3/t16-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 120 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description Ability to inhibit [3H]-paroxetine binding to cloned human serotonin (5-HT) transporter |
Bioorg Med Chem Lett 14: 3481-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.04.066 BindingDB Entry DOI: 10.7270/Q24Q7TFH |
More data for this Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50148379
(4-((S)-3-Methylamino-1-thiophen-2-yl-propoxy)-naph...)Show InChI InChI=1S/C18H19NO2S/c1-19-11-10-17(18-7-4-12-22-18)21-16-9-8-15(20)13-5-2-3-6-14(13)16/h2-9,12,17,19-20H,10-11H2,1H3/t17-/m0/s1 | NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank GoogleScholar AffyNet
| Purchase
CHEMBL MCE PC cid PC sid UniChem
Similars
| Article PubMed
| 130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description Ability to inhibit [3H]-mazindol binding to cloned human dopamine (DA) transporter; Average of two experiments |
Bioorg Med Chem Lett 14: 3481-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.04.066 BindingDB Entry DOI: 10.7270/Q24Q7TFH |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-3
(Homo sapiens (Human)) | BDBM50049757
(()-2-(6-Chloro-pyridin-3-yl)-7-aza-bicyclo[2.2.1]h...)Show InChI InChI=1S/C11H13ClN2/c12-11-4-1-7(6-13-11)9-5-8-2-3-10(9)14-8/h1,4,6,8-10,14H,2-3,5H2 | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid PDB UniChem
Patents
Similars
| PubMed
| 151 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
SIBIA Neurosciences, Inc.
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 284: 777-89 (1998)
BindingDB Entry DOI: 10.7270/Q28G8J7Q |
More data for this Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50148370
(5-((S)-3-Methylamino-1-thiophen-2-yl-propoxy)-naph...)Show InChI InChI=1S/C18H19NO2S/c1-19-10-9-17(18-6-3-11-22-18)21-16-5-2-4-13-12-14(20)7-8-15(13)16/h2-8,11-12,17,19-20H,9-10H2,1H3/t17-/m0/s1 | NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 163 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description Ability to inhibit [3H]-mazindol binding to cloned human dopamine (DA) transporter; Average of two experiments |
Bioorg Med Chem Lett 14: 3481-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.04.066 BindingDB Entry DOI: 10.7270/Q24Q7TFH |
More data for this Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50148369
(1-Methoxy-5-((S)-3-methylamino-1-thiophen-2-yl-pro...)Show InChI InChI=1S/C19H21NO3S/c1-20-11-10-17(18-7-4-12-24-18)23-16-6-3-5-14-13(16)8-9-15(21)19(14)22-2/h3-9,12,17,20-21H,10-11H2,1-2H3/t17-/m0/s1 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 235 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description Ability to inhibit [3H]-nisoxatine binding to cloned human norepinephrine (NE) transporter; Average of two experiments |
Bioorg Med Chem Lett 14: 3481-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.04.066 BindingDB Entry DOI: 10.7270/Q24Q7TFH |
More data for this Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM84745
(CAS_136434-34-9 | DULOXETINE | LY-248686 | LY24868...)Show InChI InChI=1S/C18H19NOS/c1-19-12-11-17(18-10-5-13-21-18)20-16-9-4-7-14-6-2-3-8-15(14)16/h2-10,13,17,19H,11-12H2,1H3/t17-/m0/s1 | NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank GoogleScholar AffyNet
| Purchase
DrugBank MCE PC cid PC sid PDB UniChem
Patents
Similars
| DrugBank Article PubMed
| 240 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description Ability to inhibit [3H]-WIN-35,428 binding to cloned human dopamine (DA) transporter |
Bioorg Med Chem Lett 14: 3481-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.04.066 BindingDB Entry DOI: 10.7270/Q24Q7TFH |
More data for this Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50148377
(5-((S)-3-Methylamino-1-thiophen-2-yl-propoxy)-naph...)Show InChI InChI=1S/C18H19NO2S/c1-19-11-10-17(18-9-4-12-22-18)21-16-8-3-5-13-14(16)6-2-7-15(13)20/h2-9,12,17,19-20H,10-11H2,1H3/t17-/m0/s1 | NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 240 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description Ability to inhibit [3H]-mazindol binding to cloned human dopamine (DA) transporter; Average of two experiments |
Bioorg Med Chem Lett 14: 3481-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.04.066 BindingDB Entry DOI: 10.7270/Q24Q7TFH |
More data for this Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50148378
(2-Methoxy-5-((S)-3-methylamino-1-thiophen-2-yl-pro...)Show InChI InChI=1S/C19H21NO3S/c1-20-11-10-16(18-7-4-12-24-18)23-15-6-3-5-14-13(15)8-9-17(22-2)19(14)21/h3-9,12,16,20-21H,10-11H2,1-2H3/t16-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 266 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description Ability to inhibit [3H]-paroxetine binding to cloned human serotonin (5-HT) transporter |
Bioorg Med Chem Lett 14: 3481-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.04.066 BindingDB Entry DOI: 10.7270/Q24Q7TFH |
More data for this Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50148369
(1-Methoxy-5-((S)-3-methylamino-1-thiophen-2-yl-pro...)Show InChI InChI=1S/C19H21NO3S/c1-20-11-10-17(18-7-4-12-24-18)23-16-6-3-5-14-13(16)8-9-15(21)19(14)22-2/h3-9,12,17,20-21H,10-11H2,1-2H3/t17-/m0/s1 | NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 353 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description Ability to inhibit [3H]-mazindol binding to cloned human dopamine (DA) transporter; Average of two experiments |
Bioorg Med Chem Lett 14: 3481-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.04.066 BindingDB Entry DOI: 10.7270/Q24Q7TFH |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-4
(Homo sapiens (Human)) | BDBM50107863
((-)-cytisine | (1R,9R)-7,11-diazatricyclo[7.3.1.0~...)Show InChI InChI=1S/C11H14N2O/c14-11-3-1-2-10-9-4-8(5-12-6-9)7-13(10)11/h1-3,8-9,12H,4-7H2 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL MCE PC cid PC sid UniChem
Similars
| PubMed
| 515 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
SIBIA Neurosciences, Inc.
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 284: 777-89 (1998)
BindingDB Entry DOI: 10.7270/Q28G8J7Q |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-4
(Homo sapiens (Human)) | BDBM50061565
((+)Methyl-(2,3,3-trimethyl-bicyclo[2.2.1]hept-2-yl...)Show SMILES CNC1(C)C2CCC(C2)C1(C)C |TLB:3:2:8:5.6,THB:1:2:8:5.6| Show InChI InChI=1S/C11H21N/c1-10(2)8-5-6-9(7-8)11(10,3)12-4/h8-9,12H,5-7H2,1-4H3 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL DrugBank MCE KEGG PC cid PC sid UniChem
Patents
Similars
| PubMed
| 560 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
SIBIA Neurosciences, Inc.
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 284: 777-89 (1998)
BindingDB Entry DOI: 10.7270/Q28G8J7Q |
More data for this Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50148373
(5-((S)-3-Methylamino-1-thiophen-2-yl-propoxy)-naph...)Show InChI InChI=1S/C18H19NO3S/c1-19-10-9-16(17-6-3-11-23-17)22-15-5-2-4-13-12(15)7-8-14(20)18(13)21/h2-8,11,16,19-21H,9-10H2,1H3/t16-/m0/s1 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 695 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description Ability to inhibit [3H]-paroxetine binding to cloned human serotonin (5-HT) transporter |
Bioorg Med Chem Lett 14: 3481-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.04.066 BindingDB Entry DOI: 10.7270/Q24Q7TFH |
More data for this Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50148373
(5-((S)-3-Methylamino-1-thiophen-2-yl-propoxy)-naph...)Show InChI InChI=1S/C18H19NO3S/c1-19-10-9-16(17-6-3-11-23-17)22-15-5-2-4-13-12(15)7-8-14(20)18(13)21/h2-8,11,16,19-21H,9-10H2,1H3/t16-/m0/s1 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 695 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description Ability to inhibit [3H]-nisoxatine binding to cloned human norepinephrine (NE) transporter |
Bioorg Med Chem Lett 14: 3481-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.04.066 BindingDB Entry DOI: 10.7270/Q24Q7TFH |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-3
(Homo sapiens (Human)) | BDBM81458
(CAS_57-94-3 | NSC_6000 | d-Tubocurarine)Show SMILES COc1cc2CC[N+](C)(C)C3Cc4ccc(O)c(Oc5cc6C(Cc7ccc(Oc(c1O)c23)cc7)N(C)CCc6cc5OC)c4 Show InChI InChI=1S/C37H40N2O6/c1-38-14-12-24-19-32(42-4)33-21-27(24)28(38)16-22-6-9-26(10-7-22)44-37-35-25(20-34(43-5)36(37)41)13-15-39(2,3)29(35)17-23-8-11-30(40)31(18-23)45-33/h6-11,18-21,28-29H,12-17H2,1-5H3,(H-,40,41)/p+1 | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| Purchase
PC cid PC sid PDB UniChem
Similars
| PubMed
| 730 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
SIBIA Neurosciences, Inc.
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 284: 777-89 (1998)
BindingDB Entry DOI: 10.7270/Q28G8J7Q |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-4
(Homo sapiens (Human)) | BDBM81458
(CAS_57-94-3 | NSC_6000 | d-Tubocurarine)Show SMILES COc1cc2CC[N+](C)(C)C3Cc4ccc(O)c(Oc5cc6C(Cc7ccc(Oc(c1O)c23)cc7)N(C)CCc6cc5OC)c4 Show InChI InChI=1S/C37H40N2O6/c1-38-14-12-24-19-32(42-4)33-21-27(24)28(38)16-22-6-9-26(10-7-22)44-37-35-25(20-34(43-5)36(37)41)13-15-39(2,3)29(35)17-23-8-11-30(40)31(18-23)45-33/h6-11,18-21,28-29H,12-17H2,1-5H3,(H-,40,41)/p+1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
PC cid PC sid PDB UniChem
Similars
| PubMed
| 860 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
SIBIA Neurosciences, Inc.
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 284: 777-89 (1998)
BindingDB Entry DOI: 10.7270/Q28G8J7Q |
More data for this Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50148378
(2-Methoxy-5-((S)-3-methylamino-1-thiophen-2-yl-pro...)Show InChI InChI=1S/C19H21NO3S/c1-20-11-10-16(18-7-4-12-24-18)23-15-6-3-5-14-13(15)8-9-17(22-2)19(14)21/h3-9,12,16,20-21H,10-11H2,1-2H3/t16-/m0/s1 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 920 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description Ability to inhibit [3H]-nisoxatine binding to cloned human norepinephrine (NE) transporter |
Bioorg Med Chem Lett 14: 3481-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.04.066 BindingDB Entry DOI: 10.7270/Q24Q7TFH |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-4
(Homo sapiens (Human)) | BDBM85207
(CAS_123990 | NSC_123990 | Suberyldicholine)Show SMILES C[N+](C)(C)CCOC(=O)CCCCCCC(=O)OCC[N+](C)(C)C Show InChI InChI=1S/C18H38N2O4/c1-19(2,3)13-15-23-17(21)11-9-7-8-10-12-18(22)24-16-14-20(4,5)6/h7-16H2,1-6H3/q+2 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
KEGG PC cid PC sid UniChem
Patents
Similars
| PubMed
| 1.12E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
SIBIA Neurosciences, Inc.
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 284: 777-89 (1998)
BindingDB Entry DOI: 10.7270/Q28G8J7Q |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-3
(Homo sapiens (Human)) | BDBM50061565
((+)Methyl-(2,3,3-trimethyl-bicyclo[2.2.1]hept-2-yl...)Show SMILES CNC1(C)C2CCC(C2)C1(C)C |TLB:3:2:8:5.6,THB:1:2:8:5.6| Show InChI InChI=1S/C11H21N/c1-10(2)8-5-6-9(7-8)11(10,3)12-4/h8-9,12H,5-7H2,1-4H3 | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL DrugBank MCE KEGG PC cid PC sid UniChem
Patents
Similars
| PubMed
| 1.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
SIBIA Neurosciences, Inc.
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 284: 777-89 (1998)
BindingDB Entry DOI: 10.7270/Q28G8J7Q |
More data for this Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50451958
(CHEMBL2029052)Show SMILES [H][C@@](CCNC)(Oc1cccc2cc(O[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)C(O)=O)ccc12)c1cccs1 Show InChI InChI=1S/C24H27NO8S/c1-25-10-9-17(18-6-3-11-34-18)32-16-5-2-4-13-12-14(7-8-15(13)16)31-24-21(28)19(26)20(27)22(33-24)23(29)30/h2-8,11-12,17,19-22,24-28H,9-10H2,1H3,(H,29,30)/t17-,19-,20-,21+,22-,24+/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL KEGG PC cid PC sid UniChem
Similars
| Article PubMed
| 1.45E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description Ability to inhibit [3H]-paroxetine binding to cloned human serotonin (5-HT) transporter |
Bioorg Med Chem Lett 14: 3481-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.04.066 BindingDB Entry DOI: 10.7270/Q24Q7TFH |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-2
(Homo sapiens (Human)) | BDBM81458
(CAS_57-94-3 | NSC_6000 | d-Tubocurarine)Show SMILES COc1cc2CC[N+](C)(C)C3Cc4ccc(O)c(Oc5cc6C(Cc7ccc(Oc(c1O)c23)cc7)N(C)CCc6cc5OC)c4 Show InChI InChI=1S/C37H40N2O6/c1-38-14-12-24-19-32(42-4)33-21-27(24)28(38)16-22-6-9-26(10-7-22)44-37-35-25(20-34(43-5)36(37)41)13-15-39(2,3)29(35)17-23-8-11-30(40)31(18-23)45-33/h6-11,18-21,28-29H,12-17H2,1-5H3,(H-,40,41)/p+1 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
PC cid PC sid PDB UniChem
Similars
| PubMed
| 2.26E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
SIBIA Neurosciences, Inc.
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 284: 777-89 (1998)
BindingDB Entry DOI: 10.7270/Q28G8J7Q |
More data for this Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50148378
(2-Methoxy-5-((S)-3-methylamino-1-thiophen-2-yl-pro...)Show InChI InChI=1S/C19H21NO3S/c1-20-11-10-16(18-7-4-12-24-18)23-15-6-3-5-14-13(15)8-9-17(22-2)19(14)21/h3-9,12,16,20-21H,10-11H2,1-2H3/t16-/m0/s1 | NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank GoogleScholar AffyNet
| Purchase
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 |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description Ability to inhibit [3H]-mazindol binding to cloned human dopamine (DA) transporter |
Bioorg Med Chem Lett 14: 3481-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.04.066 BindingDB Entry DOI: 10.7270/Q24Q7TFH |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-2
(Homo sapiens (Human)) | BDBM50061565
((+)Methyl-(2,3,3-trimethyl-bicyclo[2.2.1]hept-2-yl...)Show SMILES CNC1(C)C2CCC(C2)C1(C)C |TLB:3:2:8:5.6,THB:1:2:8:5.6| Show InChI InChI=1S/C11H21N/c1-10(2)8-5-6-9(7-8)11(10,3)12-4/h8-9,12H,5-7H2,1-4H3 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL DrugBank MCE KEGG PC cid PC sid UniChem
Patents
Similars
| DrugBank PubMed
| 3.06E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
SIBIA Neurosciences, Inc.
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 284: 777-89 (1998)
BindingDB Entry DOI: 10.7270/Q28G8J7Q |
More data for this Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50148376
(CHEMBL420142 | sodium 2-methoxy-5-{[(1S)-3-(methyl...)Show SMILES CNCC[C@H](Oc1cccc2c(OS([O-])(=O)=O)c(OC)ccc12)c1cccs1 Show InChI InChI=1S/C19H21NO6S2/c1-20-11-10-16(18-7-4-12-27-18)25-15-6-3-5-14-13(15)8-9-17(24-2)19(14)26-28(21,22)23/h3-9,12,16,20H,10-11H2,1-2H3,(H,21,22,23)/p-1/t16-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL KEGG PC cid PC sid UniChem
| Article PubMed
| 3.11E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description Ability to inhibit [3H]-paroxetine binding to cloned human serotonin (5-HT) transporter |
Bioorg Med Chem Lett 14: 3481-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.04.066 BindingDB Entry DOI: 10.7270/Q24Q7TFH |
More data for this Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50451957
(CHEMBL2029053)Show SMILES [H][C@@](CCNC)(Oc1ccc(O[C@@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)C(O)=O)c2ccccc12)c1cccs1 Show InChI InChI=1S/C24H27NO8S/c1-25-11-10-17(18-7-4-12-34-18)31-15-8-9-16(14-6-3-2-5-13(14)15)32-24-21(28)19(26)20(27)22(33-24)23(29)30/h2-9,12,17,19-22,24-28H,10-11H2,1H3,(H,29,30)/t17-,19-,20-,21+,22-,24+/m0/s1 | NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank GoogleScholar AffyNet
| Purchase
CHEMBL MCE KEGG PC cid PC sid UniChem
Similars
| Article PubMed
| 3.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description Ability to inhibit [3H]-mazindol binding to cloned human dopamine (DA) transporter |
Bioorg Med Chem Lett 14: 3481-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.04.066 BindingDB Entry DOI: 10.7270/Q24Q7TFH |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-2
(Homo sapiens (Human)) | BDBM50061562
((12R,13aR)-12-Methoxy-1,4,5,6,9,11,12,13-octahydro...)Show SMILES CO[C@@H]1CC=C2CCN3CCC4=C(CC(=O)OC4)[C@@]23C1 |t:4,11| Show InChI InChI=1S/C16H21NO3/c1-19-13-3-2-12-5-7-17-6-4-11-10-20-15(18)8-14(11)16(12,17)9-13/h2,13H,3-10H2,1H3/t13-,16-/m1/s1 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid UniChem
Similars
| PubMed
| 5.09E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
SIBIA Neurosciences, Inc.
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 284: 777-89 (1998)
BindingDB Entry DOI: 10.7270/Q28G8J7Q |
More data for this Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50451958
(CHEMBL2029052)Show SMILES [H][C@@](CCNC)(Oc1cccc2cc(O[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)C(O)=O)ccc12)c1cccs1 Show InChI InChI=1S/C24H27NO8S/c1-25-10-9-17(18-6-3-11-34-18)32-16-5-2-4-13-12-14(7-8-15(13)16)31-24-21(28)19(26)20(27)22(33-24)23(29)30/h2-8,11-12,17,19-22,24-28H,9-10H2,1H3,(H,29,30)/t17-,19-,20-,21+,22-,24+/m0/s1 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL KEGG PC cid PC sid UniChem
Similars
| Article PubMed
| 5.45E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description Ability to inhibit [3H]-nisoxatine binding to cloned human norepinephrine (NE) transporter |
Bioorg Med Chem Lett 14: 3481-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.04.066 BindingDB Entry DOI: 10.7270/Q24Q7TFH |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-4
(Homo sapiens (Human)) | BDBM50004108
((+-)-nicotine | (R,S)-nicotine | (RS)-nicotine | 3...)Show InChI InChI=1S/C10H14N2/c1-12-7-3-5-10(12)9-4-2-6-11-8-9/h2,4,6,8,10H,3,5,7H2,1H3 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL DrugBank KEGG PC cid PC sid PDB UniChem
Patents
Similars
| DrugBank PDB PubMed
| 6.69E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
SIBIA Neurosciences, Inc.
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 284: 777-89 (1998)
BindingDB Entry DOI: 10.7270/Q28G8J7Q |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50148373
(5-((S)-3-Methylamino-1-thiophen-2-yl-propoxy)-naph...)Show InChI InChI=1S/C18H19NO3S/c1-19-10-9-16(17-6-3-11-23-17)22-15-5-2-4-13-12(15)7-8-14(20)18(13)21/h2-8,11,16,19-21H,9-10H2,1H3/t16-/m0/s1 | NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 7.27E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description Ability to inhibit [3H]-mazindol binding to cloned human dopamine (DA) transporter |
Bioorg Med Chem Lett 14: 3481-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.04.066 BindingDB Entry DOI: 10.7270/Q24Q7TFH |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-2
(Homo sapiens (Human)) | BDBM85207
(CAS_123990 | NSC_123990 | Suberyldicholine)Show SMILES C[N+](C)(C)CCOC(=O)CCCCCCC(=O)OCC[N+](C)(C)C Show InChI InChI=1S/C18H38N2O4/c1-19(2,3)13-15-23-17(21)11-9-7-8-10-12-18(22)24-16-14-20(4,5)6/h7-16H2,1-6H3/q+2 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
KEGG PC cid PC sid UniChem
Patents
Similars
| PubMed
| 8.75E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
SIBIA Neurosciences, Inc.
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 284: 777-89 (1998)
BindingDB Entry DOI: 10.7270/Q28G8J7Q |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-2
(Homo sapiens (Human)) | BDBM50004108
((+-)-nicotine | (R,S)-nicotine | (RS)-nicotine | 3...)Show InChI InChI=1S/C10H14N2/c1-12-7-3-5-10(12)9-4-2-6-11-8-9/h2,4,6,8,10H,3,5,7H2,1H3 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL DrugBank KEGG PC cid PC sid PDB UniChem
Patents
Similars
| DrugBank PubMed
| 9.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
SIBIA Neurosciences, Inc.
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 284: 777-89 (1998)
BindingDB Entry DOI: 10.7270/Q28G8J7Q |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-3
(Homo sapiens (Human)) | BDBM50061562
((12R,13aR)-12-Methoxy-1,4,5,6,9,11,12,13-octahydro...)Show SMILES CO[C@@H]1CC=C2CCN3CCC4=C(CC(=O)OC4)[C@@]23C1 |t:4,11| Show InChI InChI=1S/C16H21NO3/c1-19-13-3-2-12-5-7-17-6-4-11-10-20-15(18)8-14(11)16(12,17)9-13/h2,13H,3-10H2,1H3/t13-,16-/m1/s1 | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid UniChem
Similars
| PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
SIBIA Neurosciences, Inc.
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 284: 777-89 (1998)
BindingDB Entry DOI: 10.7270/Q28G8J7Q |
More data for this Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50451957
(CHEMBL2029053)Show SMILES [H][C@@](CCNC)(Oc1ccc(O[C@@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)C(O)=O)c2ccccc12)c1cccs1 Show InChI InChI=1S/C24H27NO8S/c1-25-11-10-17(18-7-4-12-34-18)31-15-8-9-16(14-6-3-2-5-13(14)15)32-24-21(28)19(26)20(27)22(33-24)23(29)30/h2-9,12,17,19-22,24-28H,10-11H2,1H3,(H,29,30)/t17-,19-,20-,21+,22-,24+/m0/s1 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL MCE KEGG 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 |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description Ability to inhibit [3H]-nisoxatine binding to cloned human norepinephrine (NE) transporter |
Bioorg Med Chem Lett 14: 3481-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.04.066 BindingDB Entry DOI: 10.7270/Q24Q7TFH |
More data for this Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50451956
(CHEMBL2029054)Show SMILES [H][C@@](CCNC)(Oc1cccc2c(O[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)C(O)=O)c(O[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)C(O)=O)ccc12)c1cccs1 Show InChI InChI=1S/C30H35NO15S/c1-31-10-9-15(17-6-3-11-47-17)42-14-5-2-4-13-12(14)7-8-16(43-29-22(36)18(32)20(34)25(45-29)27(38)39)24(13)44-30-23(37)19(33)21(35)26(46-30)28(40)41/h2-8,11,15,18-23,25-26,29-37H,9-10H2,1H3,(H,38,39)(H,40,41)/t15-,18-,19-,20-,21-,22+,23+,25-,26-,29+,30+/m0/s1 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL KEGG 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 |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description Ability to inhibit [3H]-nisoxatine binding to cloned human norepinephrine (NE) transporter |
Bioorg Med Chem Lett 14: 3481-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.04.066 BindingDB Entry DOI: 10.7270/Q24Q7TFH |
More data for this Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50451955
(CHEMBL2029055)Show SMILES [H][C@@](CCNC)(Oc1cccc2c(O[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)C(O)=O)c(OC)ccc12)c1cccs1 Show InChI InChI=1S/C25H29NO9S/c1-26-11-10-16(18-7-4-12-36-18)33-15-6-3-5-14-13(15)8-9-17(32-2)22(14)34-25-21(29)19(27)20(28)23(35-25)24(30)31/h3-9,12,16,19-21,23,25-29H,10-11H2,1-2H3,(H,30,31)/t16-,19-,20-,21+,23-,25+/m0/s1 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL KEGG 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 |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description Ability to inhibit [3H]-nisoxatine binding to cloned human norepinephrine (NE) transporter |
Bioorg Med Chem Lett 14: 3481-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.04.066 BindingDB Entry DOI: 10.7270/Q24Q7TFH |
More data for this Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50451958
(CHEMBL2029052)Show SMILES [H][C@@](CCNC)(Oc1cccc2cc(O[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)C(O)=O)ccc12)c1cccs1 Show InChI InChI=1S/C24H27NO8S/c1-25-10-9-17(18-6-3-11-34-18)32-16-5-2-4-13-12-14(7-8-15(13)16)31-24-21(28)19(26)20(27)22(33-24)23(29)30/h2-8,11-12,17,19-22,24-28H,9-10H2,1H3,(H,29,30)/t17-,19-,20-,21+,22-,24+/m0/s1 | NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank GoogleScholar AffyNet
| CHEMBL KEGG 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 |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description Ability to inhibit [3H]-mazindol binding to cloned human dopamine (DA) transporter |
Bioorg Med Chem Lett 14: 3481-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.04.066 BindingDB Entry DOI: 10.7270/Q24Q7TFH |
More data for this Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50451956
(CHEMBL2029054)Show SMILES [H][C@@](CCNC)(Oc1cccc2c(O[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)C(O)=O)c(O[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)C(O)=O)ccc12)c1cccs1 Show InChI InChI=1S/C30H35NO15S/c1-31-10-9-15(17-6-3-11-47-17)42-14-5-2-4-13-12(14)7-8-16(43-29-22(36)18(32)20(34)25(45-29)27(38)39)24(13)44-30-23(37)19(33)21(35)26(46-30)28(40)41/h2-8,11,15,18-23,25-26,29-37H,9-10H2,1H3,(H,38,39)(H,40,41)/t15-,18-,19-,20-,21-,22+,23+,25-,26-,29+,30+/m0/s1 | NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank GoogleScholar AffyNet
| CHEMBL KEGG 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 |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description Ability to inhibit [3H]-mazindol binding to cloned human dopamine (DA) transporter |
Bioorg Med Chem Lett 14: 3481-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.04.066 BindingDB Entry DOI: 10.7270/Q24Q7TFH |
More data for this Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50451955
(CHEMBL2029055)Show SMILES [H][C@@](CCNC)(Oc1cccc2c(O[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)C(O)=O)c(OC)ccc12)c1cccs1 Show InChI InChI=1S/C25H29NO9S/c1-26-11-10-16(18-7-4-12-36-18)33-15-6-3-5-14-13(15)8-9-17(32-2)22(14)34-25-21(29)19(27)20(28)23(35-25)24(30)31/h3-9,12,16,19-21,23,25-29H,10-11H2,1-2H3,(H,30,31)/t16-,19-,20-,21+,23-,25+/m0/s1 | NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank GoogleScholar AffyNet
| CHEMBL KEGG 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 |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description Ability to inhibit [3H]-mazindol binding to cloned human dopamine (DA) transporter |
Bioorg Med Chem Lett 14: 3481-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.04.066 BindingDB Entry DOI: 10.7270/Q24Q7TFH |
More data for this Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50451957
(CHEMBL2029053)Show SMILES [H][C@@](CCNC)(Oc1ccc(O[C@@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)C(O)=O)c2ccccc12)c1cccs1 Show InChI InChI=1S/C24H27NO8S/c1-25-11-10-17(18-7-4-12-34-18)31-15-8-9-16(14-6-3-2-5-13(14)15)32-24-21(28)19(26)20(27)22(33-24)23(29)30/h2-9,12,17,19-22,24-28H,10-11H2,1H3,(H,29,30)/t17-,19-,20-,21+,22-,24+/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL MCE KEGG 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 |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description Ability to inhibit [3H]-paroxetine binding to cloned human serotonin (5-HT) transporter |
Bioorg Med Chem Lett 14: 3481-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.04.066 BindingDB Entry DOI: 10.7270/Q24Q7TFH |
More data for this Ligand-Target Pair | |