Found 26 hits Enz. Inhib. hit(s) with all data for assayid = 3 entry = 50031120 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 noradrenaline transporter
(Homo sapiens (Human)) | BDBM50307469
((1S,2R)-1-(3-Fluorophenyl)-3-(methylamino)-1-(5-me...)Show SMILES CNC[C@@H](O)[C@@H](N1CCc2cc(C)ccc12)c1cccc(F)c1 |r| Show InChI InChI=1S/C19H23FN2O/c1-13-6-7-17-14(10-13)8-9-22(17)19(18(23)12-21-2)15-4-3-5-16(20)11-15/h3-7,10-11,18-19,21,23H,8-9,12H2,1-2H3/t18-,19+/m1/s1 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.30 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibition of norepinephrine uptake at human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 2051-62 (2010)
Article DOI: 10.1021/jm901559e
BindingDB Entry DOI: 10.7270/Q21J99VS |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50307459
((1S,2R)-1-(7-Fluoro-3,3-dimethyl-2,3-dihydro-1H-in...)Show SMILES CNC[C@@H](O)[C@@H](N1CC(C)(C)c2cccc(F)c12)c1ccccc1 |r| Show InChI InChI=1S/C20H25FN2O/c1-20(2)13-23(19-15(20)10-7-11-16(19)21)18(17(24)12-22-3)14-8-5-4-6-9-14/h4-11,17-18,22,24H,12-13H2,1-3H3/t17-,18+/m1/s1 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.70 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibition of norepinephrine uptake at human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 2051-62 (2010)
Article DOI: 10.1021/jm901559e
BindingDB Entry DOI: 10.7270/Q21J99VS |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50124566
((R)-2-((R)-(2-ethoxyphenoxy)(phenyl)methyl)morphol...)Show InChI InChI=1S/C19H23NO3/c1-2-21-16-10-6-7-11-17(16)23-19(15-8-4-3-5-9-15)18-14-20-12-13-22-18/h3-11,18-20H,2,12-14H2,1H3 | Reactome pathway
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PC cid
PC sid
PDB
UniChem
Patents
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| Article
PubMed
| n/a | n/a | 3.20 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibition of norepinephrine uptake at human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 2051-62 (2010)
Article DOI: 10.1021/jm901559e
BindingDB Entry DOI: 10.7270/Q21J99VS |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM35229
(3-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-N-met...)Show InChI InChI=1S/C18H22N2/c1-19-13-6-14-20-17-9-4-2-7-15(17)11-12-16-8-3-5-10-18(16)20/h2-5,7-10,19H,6,11-14H2,1H3 | Reactome pathway
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MCE
KEGG
MMDB
PC cid
PC sid
PDB
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Patents
Similars
| DrugBank
Article
PubMed
| n/a | n/a | 3.40 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibition of norepinephrine uptake at human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 2051-62 (2010)
Article DOI: 10.1021/jm901559e
BindingDB Entry DOI: 10.7270/Q21J99VS |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50307466
((1S,2R)-1-(3-Fluorophenyl)-3-(methylamino)-1-[(3R)...)Show SMILES CNC[C@@H](O)[C@@H](N1C[C@H](C)c2ccccc12)c1cccc(F)c1 |r| Show InChI InChI=1S/C19H23FN2O/c1-13-12-22(17-9-4-3-8-16(13)17)19(18(23)11-21-2)14-6-5-7-15(20)10-14/h3-10,13,18-19,21,23H,11-12H2,1-2H3/t13-,18+,19-/m0/s1 | Reactome pathway
KEGG
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.70 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibition of norepinephrine uptake at human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 2051-62 (2010)
Article DOI: 10.1021/jm901559e
BindingDB Entry DOI: 10.7270/Q21J99VS |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50307462
((1S,2R)-1-(2,3-Dihydro-1H-indol-1-yl)-1-(3-fluorop...)Show SMILES CNC[C@@H](O)[C@@H](N1CCc2ccccc12)c1cccc(F)c1 |r| Show InChI InChI=1S/C18H21FN2O/c1-20-12-17(22)18(14-6-4-7-15(19)11-14)21-10-9-13-5-2-3-8-16(13)21/h2-8,11,17-18,20,22H,9-10,12H2,1H3/t17-,18+/m1/s1 | Reactome pathway
KEGG
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.60 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibition of norepinephrine uptake at human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 2051-62 (2010)
Article DOI: 10.1021/jm901559e
BindingDB Entry DOI: 10.7270/Q21J99VS |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50307460
((1S,2R)-1-(7-Fluoro-3,3-dimethyl-2,3-dihydro-1H-in...)Show SMILES CNC[C@@H](O)[C@@H](N1CC(C)(C)c2cccc(F)c12)c1cccc(F)c1 |r| Show InChI InChI=1S/C20H24F2N2O/c1-20(2)12-24(19-15(20)8-5-9-16(19)22)18(17(25)11-23-3)13-6-4-7-14(21)10-13/h4-10,17-18,23,25H,11-12H2,1-3H3/t17-,18+/m1/s1 | Reactome pathway
KEGG
UniProtKB/SwissProt
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GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 5.5 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibition of norepinephrine uptake at human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 2051-62 (2010)
Article DOI: 10.1021/jm901559e
BindingDB Entry DOI: 10.7270/Q21J99VS |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50307476
((1S,2R)-1-(3,3-Dimethyl-2,3-dihydro-1H-indol-1-yl)...)Show SMILES CNC[C@@H](O)[C@@H](N1CC(C)(C)c2ccccc12)c1ccccc1 |r| Show InChI InChI=1S/C20H26N2O/c1-20(2)14-22(17-12-8-7-11-16(17)20)19(18(23)13-21-3)15-9-5-4-6-10-15/h4-12,18-19,21,23H,13-14H2,1-3H3/t18-,19+/m1/s1 | Reactome pathway
KEGG
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| CHEMBL
PC cid
PC sid
UniChem
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| Article
PubMed
| n/a | n/a | 5.70 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibition of norepinephrine uptake at human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 2051-62 (2010)
Article DOI: 10.1021/jm901559e
BindingDB Entry DOI: 10.7270/Q21J99VS |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50307464
((1S,2R)-1-(3-Fluorophenyl)-3-(methylamino)-1-(3-me...)Show SMILES CNC[C@@H](O)[C@@H](N1CC(C)c2ccccc12)c1cccc(F)c1 |r| Show InChI InChI=1S/C19H23FN2O/c1-13-12-22(17-9-4-3-8-16(13)17)19(18(23)11-21-2)14-6-5-7-15(20)10-14/h3-10,13,18-19,21,23H,11-12H2,1-2H3/t13?,18-,19+/m1/s1 | Reactome pathway
KEGG
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6.20 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibition of norepinephrine uptake at human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 2051-62 (2010)
Article DOI: 10.1021/jm901559e
BindingDB Entry DOI: 10.7270/Q21J99VS |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50307457
((1S,2R)-1-(3,3-Dimethyl-2,3-dihydro-1H-indol-1-yl)...)Show SMILES CNC[C@@H](O)[C@@H](N1CC(C)(C)c2ccccc12)c1cccc(F)c1 |r| Show InChI InChI=1S/C20H25FN2O/c1-20(2)13-23(17-10-5-4-9-16(17)20)19(18(24)12-22-3)14-7-6-8-15(21)11-14/h4-11,18-19,22,24H,12-13H2,1-3H3/t18-,19+/m1/s1 | Reactome pathway
KEGG
UniProtKB/SwissProt
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antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6.30 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibition of norepinephrine uptake at human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 2051-62 (2010)
Article DOI: 10.1021/jm901559e
BindingDB Entry DOI: 10.7270/Q21J99VS |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50307458
((1S,2R)-1-(3,5-Difluorophenyl)-1-(3,3-dimethyl-2,3...)Show SMILES CNC[C@@H](O)[C@@H](N1CC(C)(C)c2ccccc12)c1cc(F)cc(F)c1 |r| Show InChI InChI=1S/C20H24F2N2O/c1-20(2)12-24(17-7-5-4-6-16(17)20)19(18(25)11-23-3)13-8-14(21)10-15(22)9-13/h4-10,18-19,23,25H,11-12H2,1-3H3/t18-,19+/m1/s1 | Reactome pathway
KEGG
UniProtKB/SwissProt
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antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6.5 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibition of norepinephrine uptake at human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 2051-62 (2010)
Article DOI: 10.1021/jm901559e
BindingDB Entry DOI: 10.7270/Q21J99VS |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50307470
((1S,2R)-1-(5-Chloro-2,3-dihydro-1H-indol-1-yl)-1-(...)Show SMILES CNC[C@@H](O)[C@@H](N1CCc2cc(Cl)ccc12)c1cccc(F)c1 |r| Show InChI InChI=1S/C18H20ClFN2O/c1-21-11-17(23)18(13-3-2-4-15(20)10-13)22-8-7-12-9-14(19)5-6-16(12)22/h2-6,9-10,17-18,21,23H,7-8,11H2,1H3/t17-,18+/m1/s1 | Reactome pathway
KEGG
UniProtKB/SwissProt
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antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 7.60 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibition of norepinephrine uptake at human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 2051-62 (2010)
Article DOI: 10.1021/jm901559e
BindingDB Entry DOI: 10.7270/Q21J99VS |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50307465
((1S,2R)-1-(3-Fluorophenyl)-3-(methylamino)-1-[(3S)...)Show SMILES CNC[C@@H](O)[C@@H](N1C[C@@H](C)c2ccccc12)c1cccc(F)c1 |r| Show InChI InChI=1S/C19H23FN2O/c1-13-12-22(17-9-4-3-8-16(13)17)19(18(23)11-21-2)14-6-5-7-15(20)10-14/h3-10,13,18-19,21,23H,11-12H2,1-2H3/t13-,18-,19+/m1/s1 | Reactome pathway
KEGG
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GoogleScholar
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 8.5 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibition of norepinephrine uptake at human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 2051-62 (2010)
Article DOI: 10.1021/jm901559e
BindingDB Entry DOI: 10.7270/Q21J99VS |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50307461
((1S,2R)-1-(2,3-Dihydro-1H-indol-1-yl)-3-(methylami...)Show SMILES CNC[C@@H](O)[C@@H](N1CCc2ccccc12)c1ccccc1 |r| Show InChI InChI=1S/C18H22N2O/c1-19-13-17(21)18(15-8-3-2-4-9-15)20-12-11-14-7-5-6-10-16(14)20/h2-10,17-19,21H,11-13H2,1H3/t17-,18+/m1/s1 | Reactome pathway
KEGG
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 9.70 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibition of norepinephrine uptake at human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 2051-62 (2010)
Article DOI: 10.1021/jm901559e
BindingDB Entry DOI: 10.7270/Q21J99VS |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50259340
((1S,2R)-1-(3-fluorophenyl)-1-(methyl(phenyl)amino)...)Show SMILES CNC[C@@H](O)[C@@H](N(C)c1ccccc1)c1cccc(F)c1 |r| Show InChI InChI=1S/C17H21FN2O/c1-19-12-16(21)17(13-7-6-8-14(18)11-13)20(2)15-9-4-3-5-10-15/h3-11,16-17,19,21H,12H2,1-2H3/t16-,17+/m1/s1 | Reactome pathway
KEGG
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| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 12 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibition of norepinephrine uptake at human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 2051-62 (2010)
Article DOI: 10.1021/jm901559e
BindingDB Entry DOI: 10.7270/Q21J99VS |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50307467
((1S,2R)-1-(3-Ethyl-2,3-dihydro-1H-indol-1-yl)-1-(3...)Show SMILES CCC1CN([C@H]([C@H](O)CNC)c2cccc(F)c2)c2ccccc12 |r| Show InChI InChI=1S/C20H25FN2O/c1-3-14-13-23(18-10-5-4-9-17(14)18)20(19(24)12-22-2)15-7-6-8-16(21)11-15/h4-11,14,19-20,22,24H,3,12-13H2,1-2H3/t14?,19-,20+/m1/s1 | Reactome pathway
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 14 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibition of norepinephrine uptake at human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 2051-62 (2010)
Article DOI: 10.1021/jm901559e
BindingDB Entry DOI: 10.7270/Q21J99VS |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50307471
((1S,2R)-1-[5-(Benzyloxy)-2,3-dihydro-1H-indol-1-yl...)Show SMILES CNC[C@@H](O)[C@@H](N1CCc2cc(OCc3ccccc3)ccc12)c1cccc(F)c1 |r| Show InChI InChI=1S/C25H27FN2O2/c1-27-16-24(29)25(20-8-5-9-21(26)14-20)28-13-12-19-15-22(10-11-23(19)28)30-17-18-6-3-2-4-7-18/h2-11,14-15,24-25,27,29H,12-13,16-17H2,1H3/t24-,25+/m1/s1 | Reactome pathway
KEGG
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 15 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibition of norepinephrine uptake at human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 2051-62 (2010)
Article DOI: 10.1021/jm901559e
BindingDB Entry DOI: 10.7270/Q21J99VS |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50307478
((1S,2R)-1-(6-Fluoro-3,3-dimethyl-2,3-dihydro-1H-in...)Show SMILES CNC[C@@H](O)[C@@H](N1CC(C)(C)c2ccc(F)cc12)c1cccc(F)c1 |r| Show InChI InChI=1S/C20H24F2N2O/c1-20(2)12-24(17-10-15(22)7-8-16(17)20)19(18(25)11-23-3)13-5-4-6-14(21)9-13/h4-10,18-19,23,25H,11-12H2,1-3H3/t18-,19+/m1/s1 | Reactome pathway
KEGG
UniProtKB/SwissProt
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GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 17 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibition of norepinephrine uptake at human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 2051-62 (2010)
Article DOI: 10.1021/jm901559e
BindingDB Entry DOI: 10.7270/Q21J99VS |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50307477
((1S,2R)-1-(5-Fluoro-3,3-dimethyl-2,3-dihydro-1H-in...)Show SMILES CNC[C@@H](O)[C@@H](N1CC(C)(C)c2cc(F)ccc12)c1cccc(F)c1 |r| Show InChI InChI=1S/C20H24F2N2O/c1-20(2)12-24(17-8-7-15(22)10-16(17)20)19(18(25)11-23-3)13-5-4-6-14(21)9-13/h4-10,18-19,23,25H,11-12H2,1-3H3/t18-,19+/m1/s1 | Reactome pathway
KEGG
UniProtKB/SwissProt
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antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 19 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibition of norepinephrine uptake at human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 2051-62 (2010)
Article DOI: 10.1021/jm901559e
BindingDB Entry DOI: 10.7270/Q21J99VS |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50307474
((1S,2R)-1-(3-Fluorophenyl)-3-(methylamino)-1-spiro...)Show SMILES CNC[C@@H](O)[C@@H](N1CC2(CCCC2)c2ccccc12)c1cccc(F)c1 |r| Show InChI InChI=1S/C22H27FN2O/c1-24-14-20(26)21(16-7-6-8-17(23)13-16)25-15-22(11-4-5-12-22)18-9-2-3-10-19(18)25/h2-3,6-10,13,20-21,24,26H,4-5,11-12,14-15H2,1H3/t20-,21+/m1/s1 | Reactome pathway
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| n/a | n/a | 21 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibition of norepinephrine uptake at human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 2051-62 (2010)
Article DOI: 10.1021/jm901559e
BindingDB Entry DOI: 10.7270/Q21J99VS |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50307468
((1S,2R)-1-(3-Fluorophenyl)-1-(3-isopropyl-2,3-dihy...)Show SMILES CNC[C@@H](O)[C@@H](N1CC(C(C)C)c2ccccc12)c1cccc(F)c1 |r| Show InChI InChI=1S/C21H27FN2O/c1-14(2)18-13-24(19-10-5-4-9-17(18)19)21(20(25)12-23-3)15-7-6-8-16(22)11-15/h4-11,14,18,20-21,23,25H,12-13H2,1-3H3/t18?,20-,21+/m1/s1 | Reactome pathway
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Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibition of norepinephrine uptake at human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 2051-62 (2010)
Article DOI: 10.1021/jm901559e
BindingDB Entry DOI: 10.7270/Q21J99VS |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50307475
((1S,2R)-1-(3-Fluorophenyl)-3-(methylamino)-1-spiro...)Show SMILES CNC[C@@H](O)[C@@H](N1CC2(CCCCC2)c2ccccc12)c1cccc(F)c1 |r| Show InChI InChI=1S/C23H29FN2O/c1-25-15-21(27)22(17-8-7-9-18(24)14-17)26-16-23(12-5-2-6-13-23)19-10-3-4-11-20(19)26/h3-4,7-11,14,21-22,25,27H,2,5-6,12-13,15-16H2,1H3/t21-,22+/m1/s1 | Reactome pathway
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Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibition of norepinephrine uptake at human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 2051-62 (2010)
Article DOI: 10.1021/jm901559e
BindingDB Entry DOI: 10.7270/Q21J99VS |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50307463
((1S,2R)-1-(3-Fluorophenyl)-3-(methylamino)-1-(2-me...)Show SMILES CNC[C@@H](O)[C@@H](N1C(C)Cc2ccccc12)c1cccc(F)c1 |r| Show InChI InChI=1S/C19H23FN2O/c1-13-10-14-6-3-4-9-17(14)22(13)19(18(23)12-21-2)15-7-5-8-16(20)11-15/h3-9,11,13,18-19,21,23H,10,12H2,1-2H3/t13?,18-,19+/m1/s1 | Reactome pathway
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Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibition of norepinephrine uptake at human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 2051-62 (2010)
Article DOI: 10.1021/jm901559e
BindingDB Entry DOI: 10.7270/Q21J99VS |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50307473
((1S,2R)-1-(3,3-Diethyl-2,3-dihydro-1H-indol-1-yl)-...)Show SMILES CCC1(CC)CN([C@H]([C@H](O)CNC)c2cccc(F)c2)c2ccccc12 |r| Show InChI InChI=1S/C22H29FN2O/c1-4-22(5-2)15-25(19-12-7-6-11-18(19)22)21(20(26)14-24-3)16-9-8-10-17(23)13-16/h6-13,20-21,24,26H,4-5,14-15H2,1-3H3/t20-,21+/m1/s1 | Reactome pathway
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Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibition of norepinephrine uptake at human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 2051-62 (2010)
Article DOI: 10.1021/jm901559e
BindingDB Entry DOI: 10.7270/Q21J99VS |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50307472
((1S,2R)-1-(3-Fluorophenyl)-3-(methylamino)-1-(7-me...)Show SMILES CNC[C@@H](O)[C@@H](N1CCc2cccc(C)c12)c1cccc(F)c1 |r| Show InChI InChI=1S/C19H23FN2O/c1-13-5-3-6-14-9-10-22(18(13)14)19(17(23)12-21-2)15-7-4-8-16(20)11-15/h3-8,11,17,19,21,23H,9-10,12H2,1-2H3/t17-,19+/m1/s1 | Reactome pathway
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| n/a | n/a | 170 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibition of norepinephrine uptake at human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 2051-62 (2010)
Article DOI: 10.1021/jm901559e
BindingDB Entry DOI: 10.7270/Q21J99VS |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50259228
((1S,2R)-1-(methyl(o-tolyl)amino)-3-(methylamino)-1...)Show SMILES CNC[C@@H](O)[C@@H](N(C)c1ccccc1C)c1ccccc1 |r| Show InChI InChI=1S/C18H24N2O/c1-14-9-7-8-12-16(14)20(3)18(17(21)13-19-2)15-10-5-4-6-11-15/h4-12,17-19,21H,13H2,1-3H3/t17-,18+/m1/s1 | Reactome pathway
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| n/a | n/a | 217 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibition of norepinephrine uptake at human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 2051-62 (2010)
Article DOI: 10.1021/jm901559e
BindingDB Entry DOI: 10.7270/Q21J99VS |
More data for this
Ligand-Target Pair | |
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