Found 92 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 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
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| Purchase
CHEMBL
DrugBank
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| DrugBank
Article
PubMed
| 2.10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Displacement of [3H]nisoxetine from human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
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
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
DrugBank
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| DrugBank
Article
PubMed
| 3.40 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Inhibition of human NET-mediated norepinephrine uptake in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50005536
(42-548 | 5-(4-Chloro-phenyl)-2,5-dihydro-3H-imidaz...)Show InChI InChI=1S/C16H13ClN2O/c17-12-7-5-11(6-8-12)16(20)14-4-2-1-3-13(14)15-18-9-10-19(15)16/h1-8,20H,9-10H2 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
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| Purchase
CHEMBL
DrugBank
PC cid
PC sid
PDB
UniChem
Patents
Similars
| DrugBank
Article
PubMed
| 22.1 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN35428 from human recombinant DAT expressed in CHO cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319577
(3-[3-(2-Fluorophenyl)-2,2-dioxido-2,1,3-benzothiad...)Show InChI InChI=1S/C16H18FN3O2S/c1-18-11-6-12-19-15-9-4-5-10-16(15)20(23(19,21)22)14-8-3-2-7-13(14)17/h2-5,7-10,18H,6,11-12H2,1H3 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Inhibition of human NET-mediated norepinephrine uptake in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319578
((2S)-(4-[3-(2-Fluorophenyl)-2,2-dioxido-2,1,3-benz...)Show SMILES CNC[C@@H](O)CCN1c2ccccc2N(c2ccccc2F)S1(=O)=O |r| Show InChI InChI=1S/C17H20FN3O3S/c1-19-12-13(22)10-11-20-16-8-4-5-9-17(16)21(25(20,23)24)15-7-3-2-6-14(15)18/h2-9,13,19,22H,10-12H2,1H3/t13-/m0/s1 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Inhibition of human NET-mediated norepinephrine uptake in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319582
(4-[3-(2-Fluorophenyl)-2,2-dioxido-2,1,3-benzothiad...)Show InChI InChI=1S/C17H20FN3O2S/c1-19-12-6-7-13-20-16-10-4-5-11-17(16)21(24(20,22)23)15-9-3-2-8-14(15)18/h2-5,8-11,19H,6-7,12-13H2,1H3 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1.10 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Displacement of [3H]nisoxetine from human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319576
(4-(2,2-Dioxido-3-phenyl-2,1,3-benzothiadiazol-1(3H...)Show InChI InChI=1S/C17H18FN3O3S/c1-19-12-13(22)10-11-20-16-8-4-5-9-17(16)21(25(20,23)24)15-7-3-2-6-14(15)18/h2-9,19H,10-12H2,1H3 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Displacement of [3H]nisoxetine from human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319575
((2S)-(4-[3-(2,5-Difluorophenyl)-2,2-dioxido-2,1,3-...)Show SMILES CNC[C@@H](O)CCN1c2ccccc2N(c2cc(F)ccc2F)S1(=O)=O |r| Show InChI InChI=1S/C17H19F2N3O3S/c1-20-11-13(23)8-9-21-15-4-2-3-5-16(15)22(26(21,24)25)17-10-12(18)6-7-14(17)19/h2-7,10,13,20,23H,8-9,11H2,1H3/t13-/m0/s1 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Displacement of [3H]nisoxetine from human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319580
((2S)-4-(2,2-Dioxido-3-phenyl-2,1,3-benzothiadiazol...)Show SMILES CNC[C@@H](O)CCN1c2ccccc2N(c2ccccc2)S1(=O)=O |r| Show InChI InChI=1S/C17H21N3O3S/c1-18-13-15(21)11-12-19-16-9-5-6-10-17(16)20(24(19,22)23)14-7-3-2-4-8-14/h2-10,15,18,21H,11-13H2,1H3/t15-/m0/s1 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Displacement of [3H]nisoxetine from human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319578
((2S)-(4-[3-(2-Fluorophenyl)-2,2-dioxido-2,1,3-benz...)Show SMILES CNC[C@@H](O)CCN1c2ccccc2N(c2ccccc2F)S1(=O)=O |r| Show InChI InChI=1S/C17H20FN3O3S/c1-19-12-13(22)10-11-20-16-8-4-5-9-17(16)21(25(20,23)24)15-7-3-2-6-14(15)18/h2-9,13,19,22H,10-12H2,1H3/t13-/m0/s1 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Displacement of [3H]nisoxetine from human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319587
(CHEMBL1084042 | {3-[3-(2-Fluoro-phenyl)-2,2-dioxo-...)Show InChI InChI=1S/C17H20FN3O2S/c1-13(11-12-19-2)20-16-9-5-6-10-17(16)21(24(20,22)23)15-8-4-3-7-14(15)18/h3-10,13,19H,11-12H2,1-2H3 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Displacement of [3H]nisoxetine from human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319581
((2S)-(4-[3-(2,6-Difluorophenyl)-2,2-dioxido-2,1,3-...)Show SMILES CNC[C@@H](O)CCN1c2ccccc2N(c2c(F)cccc2F)S1(=O)=O |r| Show InChI InChI=1S/C17H19F2N3O3S/c1-20-11-12(23)9-10-21-15-7-2-3-8-16(15)22(26(21,24)25)17-13(18)5-4-6-14(17)19/h2-8,12,20,23H,9-11H2,1H3/t12-/m0/s1 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Displacement of [3H]nisoxetine from human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319579
(4-(2,2-Dioxido-3-phenyl-2,1,3-benzothiadiazol-1(3H...)Show InChI InChI=1S/C17H21N3O3S/c1-18-13-15(21)11-12-19-16-9-5-6-10-17(16)20(24(19,22)23)14-7-3-2-4-8-14/h2-10,15,18,21H,11-13H2,1H3 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Inhibition of human NET-mediated norepinephrine uptake in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319577
(3-[3-(2-Fluorophenyl)-2,2-dioxido-2,1,3-benzothiad...)Show InChI InChI=1S/C16H18FN3O2S/c1-18-11-6-12-19-15-9-4-5-10-16(15)20(23(19,21)22)14-8-3-2-7-13(14)17/h2-5,7-10,18H,6,11-12H2,1H3 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 2.70 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Displacement of [3H]nisoxetine from human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319583
((2R)-(4-[3-(2-Fluorophenyl)-2,2-dioxido-2,1,3-benz...)Show SMILES CNC[C@H](O)CCN1c2ccccc2N(c2ccccc2F)S1(=O)=O |r| Show InChI InChI=1S/C17H20FN3O3S/c1-19-12-13(22)10-11-20-16-8-4-5-9-17(16)21(25(20,23)24)15-7-3-2-6-14(15)18/h2-9,13,19,22H,10-12H2,1H3/t13-/m1/s1 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Inhibition of human NET-mediated norepinephrine uptake in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319585
((2R)-4-(2,2-Dioxido-3-phenyl-2,1,3-benzothiadiazol...)Show SMILES CNC[C@H](O)CCN1c2ccccc2N(c2ccccc2)S1(=O)=O |r| Show InChI InChI=1S/C17H21N3O3S/c1-18-13-15(21)11-12-19-16-9-5-6-10-17(16)20(24(19,22)23)14-7-3-2-4-8-14/h2-10,15,18,21H,11-13H2,1H3/t15-/m1/s1 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Inhibition of human NET-mediated norepinephrine uptake in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319575
((2S)-(4-[3-(2,5-Difluorophenyl)-2,2-dioxido-2,1,3-...)Show SMILES CNC[C@@H](O)CCN1c2ccccc2N(c2cc(F)ccc2F)S1(=O)=O |r| Show InChI InChI=1S/C17H19F2N3O3S/c1-20-11-13(23)8-9-21-15-4-2-3-5-16(15)22(26(21,24)25)17-10-12(18)6-7-14(17)19/h2-7,10,13,20,23H,8-9,11H2,1H3/t13-/m0/s1 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Inhibition of human NET-mediated norepinephrine uptake in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319583
((2R)-(4-[3-(2-Fluorophenyl)-2,2-dioxido-2,1,3-benz...)Show SMILES CNC[C@H](O)CCN1c2ccccc2N(c2ccccc2F)S1(=O)=O |r| Show InChI InChI=1S/C17H20FN3O3S/c1-19-12-13(22)10-11-20-16-8-4-5-9-17(16)21(25(20,23)24)15-7-3-2-6-14(15)18/h2-9,13,19,22H,10-12H2,1H3/t13-/m1/s1 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 4 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Displacement of [3H]nisoxetine from human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319580
((2S)-4-(2,2-Dioxido-3-phenyl-2,1,3-benzothiadiazol...)Show SMILES CNC[C@@H](O)CCN1c2ccccc2N(c2ccccc2)S1(=O)=O |r| Show InChI InChI=1S/C17H21N3O3S/c1-18-13-15(21)11-12-19-16-9-5-6-10-17(16)20(24(19,22)23)14-7-3-2-4-8-14/h2-10,15,18,21H,11-13H2,1H3/t15-/m0/s1 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 4 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Inhibition of human NET-mediated norepinephrine uptake in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319581
((2S)-(4-[3-(2,6-Difluorophenyl)-2,2-dioxido-2,1,3-...)Show SMILES CNC[C@@H](O)CCN1c2ccccc2N(c2c(F)cccc2F)S1(=O)=O |r| Show InChI InChI=1S/C17H19F2N3O3S/c1-20-11-12(23)9-10-21-15-7-2-3-8-16(15)22(26(21,24)25)17-13(18)5-4-6-14(17)19/h2-8,12,20,23H,9-11H2,1H3/t12-/m0/s1 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 4 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Inhibition of human NET-mediated norepinephrine uptake in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319582
(4-[3-(2-Fluorophenyl)-2,2-dioxido-2,1,3-benzothiad...)Show InChI InChI=1S/C17H20FN3O2S/c1-19-12-6-7-13-20-16-10-4-5-11-17(16)21(24(20,22)23)15-9-3-2-8-14(15)18/h2-5,8-11,19H,6-7,12-13H2,1H3 | Reactome pathway
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| n/a | n/a | 4.5 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Inhibition of human NET-mediated norepinephrine uptake in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319602
(3-[3-(2-Fluorophenyl)-2,2-dioxido-2,1,3-benzothiad...)Show InChI InChI=1S/C17H20FN3O2S/c1-13(19-2)11-12-20-16-9-5-6-10-17(16)21(24(20,22)23)15-8-4-3-7-14(15)18/h3-10,13,19H,11-12H2,1-2H3 | Reactome pathway
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| n/a | n/a | 5 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Displacement of [3H]nisoxetine from human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319576
(4-(2,2-Dioxido-3-phenyl-2,1,3-benzothiadiazol-1(3H...)Show InChI InChI=1S/C17H18FN3O3S/c1-19-12-13(22)10-11-20-16-8-4-5-9-17(16)21(25(20,23)24)15-7-3-2-6-14(15)18/h2-9,19H,10-12H2,1H3 | Reactome pathway
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| n/a | n/a | 5.10 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Inhibition of human NET-mediated norepinephrine uptake in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319586
((2R)-(4-[3-(2,6-Difluorophenyl)-2,2-dioxido-2,1,3-...)Show SMILES CNC[C@H](O)CCN1c2ccccc2N(c2c(F)cccc2F)S1(=O)=O |r| Show InChI InChI=1S/C17H19F2N3O3S/c1-20-11-12(23)9-10-21-15-7-2-3-8-16(15)22(26(21,24)25)17-13(18)5-4-6-14(17)19/h2-8,12,20,23H,9-11H2,1H3/t12-/m1/s1 | Reactome pathway
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| n/a | n/a | 6 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Displacement of [3H]nisoxetine from human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319578
((2S)-(4-[3-(2-Fluorophenyl)-2,2-dioxido-2,1,3-benz...)Show SMILES CNC[C@@H](O)CCN1c2ccccc2N(c2ccccc2F)S1(=O)=O |r| Show InChI InChI=1S/C17H20FN3O3S/c1-19-12-13(22)10-11-20-16-8-4-5-9-17(16)21(25(20,23)24)15-7-3-2-6-14(15)18/h2-9,13,19,22H,10-12H2,1H3/t13-/m0/s1 | Reactome pathway
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| n/a | n/a | 6 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Displacement of [3H]nisoxetine from human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319587
(CHEMBL1084042 | {3-[3-(2-Fluoro-phenyl)-2,2-dioxo-...)Show InChI InChI=1S/C17H20FN3O2S/c1-13(11-12-19-2)20-16-9-5-6-10-17(16)21(24(20,22)23)15-8-4-3-7-14(15)18/h3-10,13,19H,11-12H2,1-2H3 | Reactome pathway
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| n/a | n/a | 7 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Inhibition of human NET-mediated norepinephrine uptake in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319590
((2S)-(4-[3-(2-Chlorophenyl)-2,2-dioxido-2,1,3-benz...)Show SMILES CNC[C@@H](O)CCN1c2ccccc2N(c2ccccc2Cl)S1(=O)=O |r| Show InChI InChI=1S/C17H20ClN3O3S/c1-19-12-13(22)10-11-20-16-8-4-5-9-17(16)21(25(20,23)24)15-7-3-2-6-14(15)18/h2-9,13,19,22H,10-12H2,1H3/t13-/m0/s1 | Reactome pathway
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| n/a | n/a | 8 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Displacement of [3H]nisoxetine from human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319588
(1-(Cyclopropylamino)-4-(2,2-dioxido-3-phenyl-2,1,3...)Show InChI InChI=1S/C19H23N3O3S/c23-17(14-20-15-10-11-15)12-13-21-18-8-4-5-9-19(18)22(26(21,24)25)16-6-2-1-3-7-16/h1-9,15,17,20,23H,10-14H2 | Reactome pathway
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| n/a | n/a | 9 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Inhibition of human NET-mediated norepinephrine uptake in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319586
((2R)-(4-[3-(2,6-Difluorophenyl)-2,2-dioxido-2,1,3-...)Show SMILES CNC[C@H](O)CCN1c2ccccc2N(c2c(F)cccc2F)S1(=O)=O |r| Show InChI InChI=1S/C17H19F2N3O3S/c1-20-11-12(23)9-10-21-15-7-2-3-8-16(15)22(26(21,24)25)17-13(18)5-4-6-14(17)19/h2-8,12,20,23H,9-11H2,1H3/t12-/m1/s1 | Reactome pathway
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| n/a | n/a | 9 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Inhibition of human NET-mediated norepinephrine uptake in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319585
((2R)-4-(2,2-Dioxido-3-phenyl-2,1,3-benzothiadiazol...)Show SMILES CNC[C@H](O)CCN1c2ccccc2N(c2ccccc2)S1(=O)=O |r| Show InChI InChI=1S/C17H21N3O3S/c1-18-13-15(21)11-12-19-16-9-5-6-10-17(16)20(24(19,22)23)14-7-3-2-4-8-14/h2-10,15,18,21H,11-13H2,1H3/t15-/m1/s1 | Reactome pathway
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| n/a | n/a | 9 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Displacement of [3H]nisoxetine from human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM30130
(CHEMBL1201082 | CHEMBL41 | Fluoxetin | Fluoxetine ...)Show InChI InChI=1S/C17H18F3NO/c1-21-12-11-16(13-5-3-2-4-6-13)22-15-9-7-14(8-10-15)17(18,19)20/h2-10,16,21H,11-12H2,1H3 | PDB
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Article
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| n/a | n/a | 9.40 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Inhibition of SERT-mediated serotonin uptake in human JAR cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319578
((2S)-(4-[3-(2-Fluorophenyl)-2,2-dioxido-2,1,3-benz...)Show SMILES CNC[C@@H](O)CCN1c2ccccc2N(c2ccccc2F)S1(=O)=O |r| Show InChI InChI=1S/C17H20FN3O3S/c1-19-12-13(22)10-11-20-16-8-4-5-9-17(16)21(25(20,23)24)15-7-3-2-6-14(15)18/h2-9,13,19,22H,10-12H2,1H3/t13-/m0/s1 | Reactome pathway
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| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Inhibition of human NET-mediated norepinephrine uptake in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319584
((2R)-(4-[3-(2,5-Difluorophenyl)-2,2-dioxido-2,1,3-...)Show SMILES CNC[C@H](O)CCN1c2ccccc2N(c2cc(F)ccc2F)S1(=O)=O |r| Show InChI InChI=1S/C17H19F2N3O3S/c1-20-11-13(23)8-9-21-15-4-2-3-5-16(15)22(26(21,24)25)17-10-12(18)6-7-14(17)19/h2-7,10,13,20,23H,8-9,11H2,1H3/t13-/m1/s1 | Reactome pathway
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| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Inhibition of human NET-mediated norepinephrine uptake in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319593
((2S)-(4-[3-(2,4-Difluorophenyl)-2,2-dioxido-2,1,3-...)Show SMILES CNC[C@@H](O)CCN1c2ccccc2N(c2ccc(F)cc2F)S1(=O)=O |r| Show InChI InChI=1S/C17H19F2N3O3S/c1-20-11-13(23)8-9-21-16-4-2-3-5-17(16)22(26(21,24)25)15-7-6-12(18)10-14(15)19/h2-7,10,13,20,23H,8-9,11H2,1H3/t13-/m0/s1 | Reactome pathway
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| n/a | n/a | 18 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Inhibition of human NET-mediated norepinephrine uptake in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319593
((2S)-(4-[3-(2,4-Difluorophenyl)-2,2-dioxido-2,1,3-...)Show SMILES CNC[C@@H](O)CCN1c2ccccc2N(c2ccc(F)cc2F)S1(=O)=O |r| Show InChI InChI=1S/C17H19F2N3O3S/c1-20-11-13(23)8-9-21-16-4-2-3-5-17(16)22(26(21,24)25)15-7-6-12(18)10-14(15)19/h2-7,10,13,20,23H,8-9,11H2,1H3/t13-/m0/s1 | Reactome pathway
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| n/a | n/a | 19 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Displacement of [3H]nisoxetine from human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319589
((2S)-(4-[3-(3-Methoxyphenyl)-2,2-dioxido-2,1,3-ben...)Show SMILES CNC[C@@H](O)CCN1c2ccccc2N(c2cccc(OC)c2)S1(=O)=O |r| Show InChI InChI=1S/C18H23N3O4S/c1-19-13-15(22)10-11-20-17-8-3-4-9-18(17)21(26(20,23)24)14-6-5-7-16(12-14)25-2/h3-9,12,15,19,22H,10-11,13H2,1-2H3/t15-/m0/s1 | Reactome pathway
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| n/a | n/a | 19 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Displacement of [3H]nisoxetine from human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319596
((2S)-(4-[3-(2-Methylphenyl)-2,2-dioxido-2,1,3-benz...)Show SMILES CNC[C@@H](O)CCN1c2ccccc2N(c2ccccc2C)S1(=O)=O |r| Show InChI InChI=1S/C18H23N3O3S/c1-14-7-3-4-8-16(14)21-18-10-6-5-9-17(18)20(25(21,23)24)12-11-15(22)13-19-2/h3-10,15,19,22H,11-13H2,1-2H3/t15-/m0/s1 | Reactome pathway
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| n/a | n/a | 22 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Displacement of [3H]nisoxetine from human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319589
((2S)-(4-[3-(3-Methoxyphenyl)-2,2-dioxido-2,1,3-ben...)Show SMILES CNC[C@@H](O)CCN1c2ccccc2N(c2cccc(OC)c2)S1(=O)=O |r| Show InChI InChI=1S/C18H23N3O4S/c1-19-13-15(22)10-11-20-17-8-3-4-9-18(17)21(26(20,23)24)14-6-5-7-16(12-14)25-2/h3-9,12,15,19,22H,10-11,13H2,1-2H3/t15-/m0/s1 | Reactome pathway
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| n/a | n/a | 25 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Inhibition of human NET-mediated norepinephrine uptake in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319590
((2S)-(4-[3-(2-Chlorophenyl)-2,2-dioxido-2,1,3-benz...)Show SMILES CNC[C@@H](O)CCN1c2ccccc2N(c2ccccc2Cl)S1(=O)=O |r| Show InChI InChI=1S/C17H20ClN3O3S/c1-19-12-13(22)10-11-20-16-8-4-5-9-17(16)21(25(20,23)24)15-7-3-2-6-14(15)18/h2-9,13,19,22H,10-12H2,1H3/t13-/m0/s1 | Reactome pathway
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| n/a | n/a | 28 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Inhibition of human NET-mediated norepinephrine uptake in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319584
((2R)-(4-[3-(2,5-Difluorophenyl)-2,2-dioxido-2,1,3-...)Show SMILES CNC[C@H](O)CCN1c2ccccc2N(c2cc(F)ccc2F)S1(=O)=O |r| Show InChI InChI=1S/C17H19F2N3O3S/c1-20-11-13(23)8-9-21-15-4-2-3-5-16(15)22(26(21,24)25)17-10-12(18)6-7-14(17)19/h2-7,10,13,20,23H,8-9,11H2,1H3/t13-/m1/s1 | Reactome pathway
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| n/a | n/a | 34 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Displacement of [3H]nisoxetine from human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319595
((2S)-(4-[3-(3,4-Difluorophenyl)-2,2-dioxido-2,1,3-...)Show SMILES CNC[C@@H](O)CCN1c2ccccc2N(c2ccc(F)c(F)c2)S1(=O)=O |r| Show InChI InChI=1S/C17H19F2N3O3S/c1-20-11-13(23)8-9-21-16-4-2-3-5-17(16)22(26(21,24)25)12-6-7-14(18)15(19)10-12/h2-7,10,13,20,23H,8-9,11H2,1H3/t13-/m0/s1 | Reactome pathway
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| n/a | n/a | 36 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Displacement of [3H]nisoxetine from human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319595
((2S)-(4-[3-(3,4-Difluorophenyl)-2,2-dioxido-2,1,3-...)Show SMILES CNC[C@@H](O)CCN1c2ccccc2N(c2ccc(F)c(F)c2)S1(=O)=O |r| Show InChI InChI=1S/C17H19F2N3O3S/c1-20-11-13(23)8-9-21-16-4-2-3-5-17(16)22(26(21,24)25)12-6-7-14(18)15(19)10-12/h2-7,10,13,20,23H,8-9,11H2,1H3/t13-/m0/s1 | Reactome pathway
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| n/a | n/a | 43 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Inhibition of human NET-mediated norepinephrine uptake in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319594
((2R)-(4-[3-(2-Chlorophenyl)-2,2-dioxido-2,1,3-benz...)Show SMILES CNC[C@H](O)CCN1c2ccccc2N(c2ccccc2Cl)S1(=O)=O |r| Show InChI InChI=1S/C17H20ClN3O3S/c1-19-12-13(22)10-11-20-16-8-4-5-9-17(16)21(25(20,23)24)15-7-3-2-6-14(15)18/h2-9,13,19,22H,10-12H2,1H3/t13-/m1/s1 | Reactome pathway
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| n/a | n/a | 48 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Displacement of [3H]nisoxetine from human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319599
((2S)-(4-[3-(4-Fluorophenyl)-2,2-dioxido-2,1,3-benz...)Show SMILES CNC[C@@H](O)CCN1c2ccccc2N(c2ccc(F)cc2)S1(=O)=O |r| Show InChI InChI=1S/C17H20FN3O3S/c1-19-12-15(22)10-11-20-16-4-2-3-5-17(16)21(25(20,23)24)14-8-6-13(18)7-9-14/h2-9,15,19,22H,10-12H2,1H3/t15-/m0/s1 | Reactome pathway
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| n/a | n/a | 51 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Displacement of [3H]nisoxetine from human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319604
((2R)-3-[3-(2-Fluorophenyl)-2,2-dioxido-2,1,3-benzo...)Show SMILES CNC[C@@H](C)CN1c2ccccc2N(c2ccccc2F)S1(=O)=O |r| Show InChI InChI=1S/C17H20FN3O2S/c1-13(11-19-2)12-20-16-9-5-6-10-17(16)21(24(20,22)23)15-8-4-3-7-14(15)18/h3-10,13,19H,11-12H2,1-2H3/t13-/m1/s1 | Reactome pathway
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| n/a | n/a | 57 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Displacement of [3H]nisoxetine from human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319594
((2R)-(4-[3-(2-Chlorophenyl)-2,2-dioxido-2,1,3-benz...)Show SMILES CNC[C@H](O)CCN1c2ccccc2N(c2ccccc2Cl)S1(=O)=O |r| Show InChI InChI=1S/C17H20ClN3O3S/c1-19-12-13(22)10-11-20-16-8-4-5-9-17(16)21(25(20,23)24)15-7-3-2-6-14(15)18/h2-9,13,19,22H,10-12H2,1H3/t13-/m1/s1 | Reactome pathway
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| n/a | n/a | 61 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Inhibition of human NET-mediated norepinephrine uptake in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319596
((2S)-(4-[3-(2-Methylphenyl)-2,2-dioxido-2,1,3-benz...)Show SMILES CNC[C@@H](O)CCN1c2ccccc2N(c2ccccc2C)S1(=O)=O |r| Show InChI InChI=1S/C18H23N3O3S/c1-14-7-3-4-8-16(14)21-18-10-6-5-9-17(18)20(25(21,23)24)12-11-15(22)13-19-2/h3-10,15,19,22H,11-13H2,1-2H3/t15-/m0/s1 | Reactome pathway
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| n/a | n/a | 64 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Inhibition of human NET-mediated norepinephrine uptake in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319602
(3-[3-(2-Fluorophenyl)-2,2-dioxido-2,1,3-benzothiad...)Show InChI InChI=1S/C17H20FN3O2S/c1-13(19-2)11-12-20-16-9-5-6-10-17(16)21(24(20,22)23)15-8-4-3-7-14(15)18/h3-10,13,19H,11-12H2,1-2H3 | Reactome pathway
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| n/a | n/a | 72 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Inhibition of human NET-mediated norepinephrine uptake in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319597
((2R)-(4-[3-(3-Methoxyphenyl)-2,2-dioxido-2,1,3-ben...)Show SMILES CNC[C@H](O)CCN1c2ccccc2N(c2cccc(OC)c2)S1(=O)=O |r| Show InChI InChI=1S/C18H23N3O4S/c1-19-13-15(22)10-11-20-17-8-3-4-9-18(17)21(26(20,23)24)14-6-5-7-16(12-14)25-2/h3-9,12,15,19,22H,10-11,13H2,1-2H3/t15-/m1/s1 | Reactome pathway
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| n/a | n/a | 80 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Displacement of [3H]nisoxetine from human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319600
(2,2-Difluoro-3-[3-(2-fluorophenyl)-2,2-dioxido-2,1...)Show InChI InChI=1S/C16H16F3N3O2S/c1-20-10-16(18,19)11-21-14-8-4-5-9-15(14)22(25(21,23)24)13-7-3-2-6-12(13)17/h2-9,20H,10-11H2,1H3 | Reactome pathway
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| n/a | n/a | 94 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Displacement of [3H]nisoxetine from human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319592
((2R)-(4-[3-(2,4-Difluorophenyl)-2,2-dioxido-2,1,3-...)Show SMILES CNC[C@H](O)CCN1c2ccccc2N(c2ccc(F)cc2F)S1(=O)=O |r| Show InChI InChI=1S/C17H19F2N3O3S/c1-20-11-13(23)8-9-21-16-4-2-3-5-17(16)22(26(21,24)25)15-7-6-12(18)10-14(15)19/h2-7,10,13,20,23H,8-9,11H2,1H3/t13-/m1/s1 | Reactome pathway
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| n/a | n/a | 100 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Inhibition of human NET-mediated norepinephrine uptake in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319592
((2R)-(4-[3-(2,4-Difluorophenyl)-2,2-dioxido-2,1,3-...)Show SMILES CNC[C@H](O)CCN1c2ccccc2N(c2ccc(F)cc2F)S1(=O)=O |r| Show InChI InChI=1S/C17H19F2N3O3S/c1-20-11-13(23)8-9-21-16-4-2-3-5-17(16)22(26(21,24)25)15-7-6-12(18)10-14(15)19/h2-7,10,13,20,23H,8-9,11H2,1H3/t13-/m1/s1 | Reactome pathway
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| n/a | n/a | 109 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Displacement of [3H]nisoxetine from human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319597
((2R)-(4-[3-(3-Methoxyphenyl)-2,2-dioxido-2,1,3-ben...)Show SMILES CNC[C@H](O)CCN1c2ccccc2N(c2cccc(OC)c2)S1(=O)=O |r| Show InChI InChI=1S/C18H23N3O4S/c1-19-13-15(22)10-11-20-17-8-3-4-9-18(17)21(26(20,23)24)14-6-5-7-16(12-14)25-2/h3-9,12,15,19,22H,10-11,13H2,1-2H3/t15-/m1/s1 | Reactome pathway
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PubMed
| n/a | n/a | 143 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Inhibition of human NET-mediated norepinephrine uptake in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319599
((2S)-(4-[3-(4-Fluorophenyl)-2,2-dioxido-2,1,3-benz...)Show SMILES CNC[C@@H](O)CCN1c2ccccc2N(c2ccc(F)cc2)S1(=O)=O |r| Show InChI InChI=1S/C17H20FN3O3S/c1-19-12-15(22)10-11-20-16-4-2-3-5-17(16)21(25(20,23)24)14-8-6-13(18)7-9-14/h2-9,15,19,22H,10-12H2,1H3/t15-/m0/s1 | Reactome pathway
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PC sid
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PubMed
| n/a | n/a | 146 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Inhibition of human NET-mediated norepinephrine uptake in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319591
((2R)-(4-[3-(2-Methylphenyl)-2,2-dioxido-2,1,3-benz...)Show SMILES CNC[C@H](O)CCN1c2ccccc2N(c2ccccc2C)S1(=O)=O |r| Show InChI InChI=1S/C18H23N3O3S/c1-14-7-3-4-8-16(14)21-18-10-6-5-9-17(18)20(25(21,23)24)12-11-15(22)13-19-2/h3-10,15,19,22H,11-13H2,1-2H3/t15-/m1/s1 | Reactome pathway
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PubMed
| n/a | n/a | 155 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Displacement of [3H]nisoxetine from human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319603
(4-(2,2-Dioxido-3-phenyl-2,1,3-benzothiadiazol-1(3H...)Show InChI InChI=1S/C18H23N3O3S/c1-2-19-14-16(22)12-13-20-17-10-6-7-11-18(17)21(25(20,23)24)15-8-4-3-5-9-15/h3-11,16,19,22H,2,12-14H2,1H3 | Reactome pathway
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PC sid
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PubMed
| n/a | n/a | 196 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Inhibition of human NET-mediated norepinephrine uptake in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319600
(2,2-Difluoro-3-[3-(2-fluorophenyl)-2,2-dioxido-2,1...)Show InChI InChI=1S/C16H16F3N3O2S/c1-20-10-16(18,19)11-21-14-8-4-5-9-15(14)22(25(21,23)24)13-7-3-2-6-12(13)17/h2-9,20H,10-11H2,1H3 | Reactome pathway
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PubMed
| n/a | n/a | 238 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Inhibition of human NET-mediated norepinephrine uptake in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319601
((2R)-(4-[3-(4-Fluorophenyl)-2,2-dioxido-2,1,3-benz...)Show SMILES CNC[C@H](O)CCN1c2ccccc2N(c2ccc(F)cc2)S1(=O)=O |r| Show InChI InChI=1S/C17H20FN3O3S/c1-19-12-15(22)10-11-20-16-4-2-3-5-17(16)21(25(20,23)24)14-8-6-13(18)7-9-14/h2-9,15,19,22H,10-12H2,1H3/t15-/m1/s1 | Reactome pathway
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| n/a | n/a | 244 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Displacement of [3H]nisoxetine from human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50319601
((2R)-(4-[3-(4-Fluorophenyl)-2,2-dioxido-2,1,3-benz...)Show SMILES CNC[C@H](O)CCN1c2ccccc2N(c2ccc(F)cc2)S1(=O)=O |r| Show InChI InChI=1S/C17H20FN3O3S/c1-19-12-15(22)10-11-20-16-4-2-3-5-17(16)21(25(20,23)24)14-8-6-13(18)7-9-14/h2-9,15,19,22H,10-12H2,1H3/t15-/m1/s1 | NCI pathway
Reactome pathway
KEGG
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PC sid
UniChem
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| Article
PubMed
| n/a | n/a | 262 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN35428 from human recombinant DAT expressed in CHO cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50319597
((2R)-(4-[3-(3-Methoxyphenyl)-2,2-dioxido-2,1,3-ben...)Show SMILES CNC[C@H](O)CCN1c2ccccc2N(c2cccc(OC)c2)S1(=O)=O |r| Show InChI InChI=1S/C18H23N3O4S/c1-19-13-15(22)10-11-20-17-8-3-4-9-18(17)21(26(20,23)24)14-6-5-7-16(12-14)25-2/h3-9,12,15,19,22H,10-11,13H2,1-2H3/t15-/m1/s1 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
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| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 267 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN35428 from human recombinant DAT expressed in CHO cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319598
((2R)-(4-[3-(3,4-Difluorophenyl)-2,2-dioxido-2,1,3-...)Show SMILES CNC[C@H](O)CCN1c2ccccc2N(c2ccc(F)c(F)c2)S1(=O)=O |r| Show InChI InChI=1S/C17H19F2N3O3S/c1-20-11-13(23)8-9-21-16-4-2-3-5-17(16)22(26(21,24)25)12-6-7-14(18)15(19)10-12/h2-7,10,13,20,23H,8-9,11H2,1H3/t13-/m1/s1 | Reactome pathway
KEGG
UniProtKB/SwissProt
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antibodypedia
GoogleScholar
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| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 277 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Displacement of [3H]nisoxetine from human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50319598
((2R)-(4-[3-(3,4-Difluorophenyl)-2,2-dioxido-2,1,3-...)Show SMILES CNC[C@H](O)CCN1c2ccccc2N(c2ccc(F)c(F)c2)S1(=O)=O |r| Show InChI InChI=1S/C17H19F2N3O3S/c1-20-11-13(23)8-9-21-16-4-2-3-5-17(16)22(26(21,24)25)12-6-7-14(18)15(19)10-12/h2-7,10,13,20,23H,8-9,11H2,1H3/t13-/m1/s1 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 291 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN35428 from human recombinant DAT expressed in CHO cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319591
((2R)-(4-[3-(2-Methylphenyl)-2,2-dioxido-2,1,3-benz...)Show SMILES CNC[C@H](O)CCN1c2ccccc2N(c2ccccc2C)S1(=O)=O |r| Show InChI InChI=1S/C18H23N3O3S/c1-14-7-3-4-8-16(14)21-18-10-6-5-9-17(18)20(25(21,23)24)12-11-15(22)13-19-2/h3-10,15,19,22H,11-13H2,1-2H3/t15-/m1/s1 | Reactome pathway
KEGG
UniProtKB/SwissProt
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antibodypedia
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| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 294 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Inhibition of human NET-mediated norepinephrine uptake in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319604
((2R)-3-[3-(2-Fluorophenyl)-2,2-dioxido-2,1,3-benzo...)Show SMILES CNC[C@@H](C)CN1c2ccccc2N(c2ccccc2F)S1(=O)=O |r| Show InChI InChI=1S/C17H20FN3O2S/c1-13(11-19-2)12-20-16-9-5-6-10-17(16)21(24(20,22)23)15-8-4-3-7-14(15)18/h3-10,13,19H,11-12H2,1-2H3/t13-/m1/s1 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
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| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 305 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Inhibition of human NET-mediated norepinephrine uptake in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319601
((2R)-(4-[3-(4-Fluorophenyl)-2,2-dioxido-2,1,3-benz...)Show SMILES CNC[C@H](O)CCN1c2ccccc2N(c2ccc(F)cc2)S1(=O)=O |r| Show InChI InChI=1S/C17H20FN3O3S/c1-19-12-15(22)10-11-20-16-4-2-3-5-17(16)21(25(20,23)24)14-8-6-13(18)7-9-14/h2-9,15,19,22H,10-12H2,1H3/t15-/m1/s1 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 328 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Inhibition of human NET-mediated norepinephrine uptake in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50319599
((2S)-(4-[3-(4-Fluorophenyl)-2,2-dioxido-2,1,3-benz...)Show SMILES CNC[C@@H](O)CCN1c2ccccc2N(c2ccc(F)cc2)S1(=O)=O |r| Show InChI InChI=1S/C17H20FN3O3S/c1-19-12-15(22)10-11-20-16-4-2-3-5-17(16)21(25(20,23)24)14-8-6-13(18)7-9-14/h2-9,15,19,22H,10-12H2,1H3/t15-/m0/s1 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 386 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN35428 from human recombinant DAT expressed in CHO cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319598
((2R)-(4-[3-(3,4-Difluorophenyl)-2,2-dioxido-2,1,3-...)Show SMILES CNC[C@H](O)CCN1c2ccccc2N(c2ccc(F)c(F)c2)S1(=O)=O |r| Show InChI InChI=1S/C17H19F2N3O3S/c1-20-11-13(23)8-9-21-16-4-2-3-5-17(16)22(26(21,24)25)12-6-7-14(18)15(19)10-12/h2-7,10,13,20,23H,8-9,11H2,1H3/t13-/m1/s1 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 394 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Inhibition of human NET-mediated norepinephrine uptake in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319606
((2S)-3-[3-(2-Fluorophenyl)-2,2-dioxido-2,1,3-benzo...)Show SMILES CNC[C@H](C)CN1c2ccccc2N(c2ccccc2F)S1(=O)=O |r| Show InChI InChI=1S/C17H20FN3O2S/c1-13(11-19-2)12-20-16-9-5-6-10-17(16)21(24(20,22)23)15-8-4-3-7-14(15)18/h3-10,13,19H,11-12H2,1-2H3/t13-/m0/s1 | Reactome pathway
KEGG
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DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 441 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Displacement of [3H]nisoxetine from human NET expressed in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319605
(1-(Dimethylamino)-4-(2,2-dioxido-3-phenyl-2,1,3-be...)Show InChI InChI=1S/C18H23N3O3S/c1-19(2)14-16(22)12-13-20-17-10-6-7-11-18(17)21(25(20,23)24)15-8-4-3-5-9-15/h3-11,16,22H,12-14H2,1-2H3 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 481 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Inhibition of human NET-mediated norepinephrine uptake in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50319584
((2R)-(4-[3-(2,5-Difluorophenyl)-2,2-dioxido-2,1,3-...)Show SMILES CNC[C@H](O)CCN1c2ccccc2N(c2cc(F)ccc2F)S1(=O)=O |r| Show InChI InChI=1S/C17H19F2N3O3S/c1-20-11-13(23)8-9-21-15-4-2-3-5-16(15)22(26(21,24)25)17-10-12(18)6-7-14(17)19/h2-7,10,13,20,23H,8-9,11H2,1H3/t13-/m1/s1 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 509 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN35428 from human recombinant DAT expressed in CHO cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50319577
(3-[3-(2-Fluorophenyl)-2,2-dioxido-2,1,3-benzothiad...)Show InChI InChI=1S/C16H18FN3O2S/c1-18-11-6-12-19-15-9-4-5-10-16(15)20(23(19,21)22)14-8-3-2-7-13(14)17/h2-5,7-10,18H,6,11-12H2,1H3 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 512 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN35428 from human recombinant DAT expressed in CHO cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319606
((2S)-3-[3-(2-Fluorophenyl)-2,2-dioxido-2,1,3-benzo...)Show SMILES CNC[C@H](C)CN1c2ccccc2N(c2ccccc2F)S1(=O)=O |r| Show InChI InChI=1S/C17H20FN3O2S/c1-13(11-19-2)12-20-16-9-5-6-10-17(16)21(24(20,22)23)15-8-4-3-7-14(15)18/h3-10,13,19H,11-12H2,1-2H3/t13-/m0/s1 | Reactome pathway
KEGG
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antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 602 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Inhibition of human NET-mediated norepinephrine uptake in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319607
(1-(tert-Butylamino)-4-(2,2-dioxido-3-phenyl-2,1,3-...)Show SMILES CC(C)(C)NCC(O)CCN1c2ccccc2N(c2ccccc2)S1(=O)=O Show InChI InChI=1S/C20H27N3O3S/c1-20(2,3)21-15-17(24)13-14-22-18-11-7-8-12-19(18)23(27(22,25)26)16-9-5-4-6-10-16/h4-12,17,21,24H,13-15H2,1-3H3 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 853 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Inhibition of human NET-mediated norepinephrine uptake in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50319592
((2R)-(4-[3-(2,4-Difluorophenyl)-2,2-dioxido-2,1,3-...)Show SMILES CNC[C@H](O)CCN1c2ccccc2N(c2ccc(F)cc2F)S1(=O)=O |r| Show InChI InChI=1S/C17H19F2N3O3S/c1-20-11-13(23)8-9-21-16-4-2-3-5-17(16)22(26(21,24)25)15-7-6-12(18)10-14(15)19/h2-7,10,13,20,23H,8-9,11H2,1H3/t13-/m1/s1 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 998 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN35428 from human recombinant DAT expressed in CHO cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50319576
(4-(2,2-Dioxido-3-phenyl-2,1,3-benzothiadiazol-1(3H...)Show InChI InChI=1S/C17H18FN3O3S/c1-19-12-13(22)10-11-20-16-8-4-5-9-17(16)21(25(20,23)24)15-7-3-2-6-14(15)18/h2-9,19H,10-12H2,1H3 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1.48E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN35428 from human recombinant DAT expressed in CHO cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50319591
((2R)-(4-[3-(2-Methylphenyl)-2,2-dioxido-2,1,3-benz...)Show SMILES CNC[C@H](O)CCN1c2ccccc2N(c2ccccc2C)S1(=O)=O |r| Show InChI InChI=1S/C18H23N3O3S/c1-14-7-3-4-8-16(14)21-18-10-6-5-9-17(18)20(25(21,23)24)12-11-15(22)13-19-2/h3-10,15,19,22H,11-13H2,1-2H3/t15-/m1/s1 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1.87E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN35428 from human recombinant DAT expressed in CHO cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50319582
(4-[3-(2-Fluorophenyl)-2,2-dioxido-2,1,3-benzothiad...)Show InChI InChI=1S/C17H20FN3O2S/c1-19-12-6-7-13-20-16-10-4-5-11-17(16)21(24(20,22)23)15-9-3-2-8-14(15)18/h2-5,8-11,19H,6-7,12-13H2,1H3 | PDB
KEGG
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antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 2.04E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Inhibition of SERT-mediated serotonin uptake in human JAR cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50319575
((2S)-(4-[3-(2,5-Difluorophenyl)-2,2-dioxido-2,1,3-...)Show SMILES CNC[C@@H](O)CCN1c2ccccc2N(c2cc(F)ccc2F)S1(=O)=O |r| Show InChI InChI=1S/C17H19F2N3O3S/c1-20-11-13(23)8-9-21-15-4-2-3-5-16(15)22(26(21,24)25)17-10-12(18)6-7-14(17)19/h2-7,10,13,20,23H,8-9,11H2,1H3/t13-/m0/s1 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 2.09E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN35428 from human recombinant DAT expressed in CHO cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50319580
((2S)-4-(2,2-Dioxido-3-phenyl-2,1,3-benzothiadiazol...)Show SMILES CNC[C@@H](O)CCN1c2ccccc2N(c2ccccc2)S1(=O)=O |r| Show InChI InChI=1S/C17H21N3O3S/c1-18-13-15(21)11-12-19-16-9-5-6-10-17(16)20(24(19,22)23)14-7-3-2-4-8-14/h2-10,15,18,21H,11-13H2,1H3/t15-/m0/s1 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 2.11E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN35428 from human recombinant DAT expressed in CHO cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50319608
(4-(2,2-Dioxido-3-phenyl-2,1,3-benzothiadiazol-1(3H...)Show InChI InChI=1S/C19H25N3O3S/c1-15(2)20-14-17(23)12-13-21-18-10-6-7-11-19(18)22(26(21,24)25)16-8-4-3-5-9-16/h3-11,15,17,20,23H,12-14H2,1-2H3 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 2.26E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Inhibition of human NET-mediated norepinephrine uptake in MDCK-Net6 cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50319596
((2S)-(4-[3-(2-Methylphenyl)-2,2-dioxido-2,1,3-benz...)Show SMILES CNC[C@@H](O)CCN1c2ccccc2N(c2ccccc2C)S1(=O)=O |r| Show InChI InChI=1S/C18H23N3O3S/c1-14-7-3-4-8-16(14)21-18-10-6-5-9-17(18)20(25(21,23)24)12-11-15(22)13-19-2/h3-10,15,19,22H,11-13H2,1-2H3/t15-/m0/s1 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 2.33E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN35428 from human recombinant DAT expressed in CHO cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50319583
((2R)-(4-[3-(2-Fluorophenyl)-2,2-dioxido-2,1,3-benz...)Show SMILES CNC[C@H](O)CCN1c2ccccc2N(c2ccccc2F)S1(=O)=O |r| Show InChI InChI=1S/C17H20FN3O3S/c1-19-12-13(22)10-11-20-16-8-4-5-9-17(16)21(25(20,23)24)15-7-3-2-6-14(15)18/h2-9,13,19,22H,10-12H2,1H3/t13-/m1/s1 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 2.41E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN35428 from human recombinant DAT expressed in CHO cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50319589
((2S)-(4-[3-(3-Methoxyphenyl)-2,2-dioxido-2,1,3-ben...)Show SMILES CNC[C@@H](O)CCN1c2ccccc2N(c2cccc(OC)c2)S1(=O)=O |r| Show InChI InChI=1S/C18H23N3O4S/c1-19-13-15(22)10-11-20-17-8-3-4-9-18(17)21(26(20,23)24)14-6-5-7-16(12-14)25-2/h3-9,12,15,19,22H,10-11,13H2,1-2H3/t15-/m0/s1 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 2.57E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN35428 from human recombinant DAT expressed in CHO cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50319581
((2S)-(4-[3-(2,6-Difluorophenyl)-2,2-dioxido-2,1,3-...)Show SMILES CNC[C@@H](O)CCN1c2ccccc2N(c2c(F)cccc2F)S1(=O)=O |r| Show InChI InChI=1S/C17H19F2N3O3S/c1-20-11-12(23)9-10-21-15-7-2-3-8-16(15)22(26(21,24)25)17-13(18)5-4-6-14(17)19/h2-8,12,20,23H,9-11H2,1H3/t12-/m0/s1 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 2.62E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN35428 from human recombinant DAT expressed in CHO cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50319593
((2S)-(4-[3-(2,4-Difluorophenyl)-2,2-dioxido-2,1,3-...)Show SMILES CNC[C@@H](O)CCN1c2ccccc2N(c2ccc(F)cc2F)S1(=O)=O |r| Show InChI InChI=1S/C17H19F2N3O3S/c1-20-11-13(23)8-9-21-16-4-2-3-5-17(16)22(26(21,24)25)15-7-6-12(18)10-14(15)19/h2-7,10,13,20,23H,8-9,11H2,1H3/t13-/m0/s1 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 3.19E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN35428 from human recombinant DAT expressed in CHO cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50319578
((2S)-(4-[3-(2-Fluorophenyl)-2,2-dioxido-2,1,3-benz...)Show SMILES CNC[C@@H](O)CCN1c2ccccc2N(c2ccccc2F)S1(=O)=O |r| Show InChI InChI=1S/C17H20FN3O3S/c1-19-12-13(22)10-11-20-16-8-4-5-9-17(16)21(25(20,23)24)15-7-3-2-6-14(15)18/h2-9,13,19,22H,10-12H2,1H3/t13-/m0/s1 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 3.62E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN35428 from human recombinant DAT expressed in CHO cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50319578
((2S)-(4-[3-(2-Fluorophenyl)-2,2-dioxido-2,1,3-benz...)Show SMILES CNC[C@@H](O)CCN1c2ccccc2N(c2ccccc2F)S1(=O)=O |r| Show InChI InChI=1S/C17H20FN3O3S/c1-19-12-13(22)10-11-20-16-8-4-5-9-17(16)21(25(20,23)24)15-7-3-2-6-14(15)18/h2-9,13,19,22H,10-12H2,1H3/t13-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 4.59E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Inhibition of SERT-mediated serotonin uptake in human JAR cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50319586
((2R)-(4-[3-(2,6-Difluorophenyl)-2,2-dioxido-2,1,3-...)Show SMILES CNC[C@H](O)CCN1c2ccccc2N(c2c(F)cccc2F)S1(=O)=O |r| Show InChI InChI=1S/C17H19F2N3O3S/c1-20-11-12(23)9-10-21-15-7-2-3-8-16(15)22(26(21,24)25)17-13(18)5-4-6-14(17)19/h2-8,12,20,23H,9-11H2,1H3/t12-/m1/s1 | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 5.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Displacement of [3H]WIN35428 from human recombinant DAT expressed in CHO cells |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50319580
((2S)-4-(2,2-Dioxido-3-phenyl-2,1,3-benzothiadiazol...)Show SMILES CNC[C@@H](O)CCN1c2ccccc2N(c2ccccc2)S1(=O)=O |r| Show InChI InChI=1S/C17H21N3O3S/c1-18-13-15(21)11-12-19-16-9-5-6-10-17(16)20(24(19,22)23)14-7-3-2-4-8-14/h2-10,15,18,21H,11-13H2,1H3/t15-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 8.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Inhibition of human ERG |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50319575
((2S)-(4-[3-(2,5-Difluorophenyl)-2,2-dioxido-2,1,3-...)Show SMILES CNC[C@@H](O)CCN1c2ccccc2N(c2cc(F)ccc2F)S1(=O)=O |r| Show InChI InChI=1S/C17H19F2N3O3S/c1-20-11-13(23)8-9-21-15-4-2-3-5-16(15)22(26(21,24)25)17-10-12(18)6-7-14(17)19/h2-7,10,13,20,23H,8-9,11H2,1H3/t13-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1.30E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Inhibition of human ERG |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50319581
((2S)-(4-[3-(2,6-Difluorophenyl)-2,2-dioxido-2,1,3-...)Show SMILES CNC[C@@H](O)CCN1c2ccccc2N(c2c(F)cccc2F)S1(=O)=O |r| Show InChI InChI=1S/C17H19F2N3O3S/c1-20-11-12(23)9-10-21-15-7-2-3-8-16(15)22(26(21,24)25)17-13(18)5-4-6-14(17)19/h2-8,12,20,23H,9-11H2,1H3/t12-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 2.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Inhibition of human ERG |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50319578
((2S)-(4-[3-(2-Fluorophenyl)-2,2-dioxido-2,1,3-benz...)Show SMILES CNC[C@@H](O)CCN1c2ccccc2N(c2ccccc2F)S1(=O)=O |r| Show InChI InChI=1S/C17H20FN3O3S/c1-19-12-13(22)10-11-20-16-8-4-5-9-17(16)21(25(20,23)24)15-7-3-2-6-14(15)18/h2-9,13,19,22H,10-12H2,1H3/t13-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research& Development
Curated by ChEMBL
| Assay Description
Inhibition of human ERG |
J Med Chem 53: 4511-21 (2010)
Article DOI: 10.1021/jm100053t
BindingDB Entry DOI: 10.7270/Q2PC32JR |
More data for this
Ligand-Target Pair | |
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