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Compile Data Set for Download or QSAR

Found 10 hits of ic50 for UniProtKB: O55192   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Sodium-dependent noradrenaline transporter


(MOUSE)
BDBM50010307
PNG
(CHEMBL3251303)
Show SMILES Cl.CN(C)C1CC(C1)(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C18H21N.ClH/c1-19(2)17-13-18(14-17,15-9-5-3-6-10-15)16-11-7-4-8-12-16;/h3-12,17H,13-14H2,1-2H3;1H
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n/an/a 800n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of noradrenaline transporter in NMRI albino mouse brain assessed as [3H]NA accumulation in hypothalamus after 5 mins


J Med Chem 21: 78-82 (1978)


BindingDB Entry DOI: 10.7270/Q2P270P4
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(MOUSE)
BDBM50010306
PNG
(CHEMBL3251302)
Show SMILES Cl.CNC1CC(C1)(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C17H19N.ClH/c1-18-16-12-17(13-16,14-8-4-2-5-9-14)15-10-6-3-7-11-15;/h2-11,16,18H,12-13H2,1H3;1H
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n/an/a 800n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of noradrenaline transporter in NMRI albino mouse brain assessed as [3H]NA accumulation in hypothalamus after 5 mins


J Med Chem 21: 78-82 (1978)


BindingDB Entry DOI: 10.7270/Q2P270P4
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(MOUSE)
BDBM77970
PNG
(3-(2-chloranyl-5,6-dihydrobenzo[b][1]benzazepin-11...)
Show SMILES CN(C)CCCN1c2ccccc2CCc2ccc(Cl)cc12
Show InChI InChI=1S/C19H23ClN2/c1-21(2)12-5-13-22-18-7-4-3-6-15(18)8-9-16-10-11-17(20)14-19(16)22/h3-4,6-7,10-11,14H,5,8-9,12-13H2,1-2H3
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n/an/a 900n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of noradrenaline transporter in NMRI albino mouse brain assessed as [3H]NA accumulation in hypothalamus after 5 mins


J Med Chem 21: 78-82 (1978)


BindingDB Entry DOI: 10.7270/Q2P270P4
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(MOUSE)
BDBM50005246
PNG
(1-Phenylpropan-2-amin | 1-phenyl-2-aminopropane | ...)
Show SMILES CC(N)Cc1ccccc1
Show InChI InChI=1S/C9H13N/c1-8(10)7-9-5-3-2-4-6-9/h2-6,8H,7,10H2,1H3
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n/an/a 1.00E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of noradrenaline transporter in NMRI albino mouse brain assessed as [3H]NA accumulation in hypothalamus after 5 mins


J Med Chem 21: 78-82 (1978)


BindingDB Entry DOI: 10.7270/Q2P270P4
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(MOUSE)
BDBM35229
PNG
(3-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-N-met...)
Show SMILES CNCCCN1c2ccccc2CCc2ccccc12
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
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n/an/a 1.60E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of noradrenaline transporter in NMRI albino mouse brain assessed as [3H]NA accumulation in hypothalamus after 5 mins


J Med Chem 21: 78-82 (1978)


BindingDB Entry DOI: 10.7270/Q2P270P4
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(MOUSE)
BDBM50010305
PNG
(CHEMBL3251301)
Show SMILES Cl.NC1CC(C1)(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C16H17N.ClH/c17-15-11-16(12-15,13-7-3-1-4-8-13)14-9-5-2-6-10-14;/h1-10,15H,11-12,17H2;1H
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n/an/a 2.20E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of noradrenaline transporter in NMRI albino mouse brain assessed as [3H]NA accumulation in hypothalamus after 5 mins


J Med Chem 21: 78-82 (1978)


BindingDB Entry DOI: 10.7270/Q2P270P4
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(MOUSE)
BDBM50063500
PNG
(CHEMBL3398506)
Show SMILES [#8]-[#6](=O)C(F)(F)F.[H][C@@]1([#6]-[#6]-[#6]-[#7]1-[#6]-[#6]\[#6]=[#6](/c1sccc1-[#6])-c1sccc1-[#6])[#6@@H](-[#7])-[#6](-[#8])=O |r|
Show InChI InChI=1S/C20H26N2O2S2/c1-13-7-11-25-18(13)15(19-14(2)8-12-26-19)5-3-9-22-10-4-6-16(22)17(21)20(23)24/h5,7-8,11-12,16-17H,3-4,6,9-10,21H2,1-2H3,(H,23,24)/t16-,17-/m1/s1
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n/an/a 4.27E+4n/an/an/an/an/an/a



Ludwig-Maximilians-Universit£t M£nchen

Curated by ChEMBL


Assay Description
Inhibition of mouse GAT2 expressed in HEK293 cells by [3H]GABA uptake assay


Bioorg Med Chem 23: 1284-306 (2015)


Article DOI: 10.1016/j.bmc.2015.01.035
BindingDB Entry DOI: 10.7270/Q2QR4ZTK
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(MOUSE)
BDBM50063507
PNG
(CHEMBL3398507)
Show SMILES [#8]-[#6](=O)C(F)(F)F.[H][C@@]1([#6]-[#6]-[#6]-[#7]1-[#6]-[#6]\[#6]=[#6](/c1sccc1-[#6])-c1sccc1-[#6])[#6@H](-[#7])-[#6](-[#8])=O |r|
Show InChI InChI=1S/C20H26N2O2S2/c1-13-7-11-25-18(13)15(19-14(2)8-12-26-19)5-3-9-22-10-4-6-16(22)17(21)20(23)24/h5,7-8,11-12,16-17H,3-4,6,9-10,21H2,1-2H3,(H,23,24)/t16-,17+/m1/s1
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n/an/a 1.00E+5n/an/an/an/an/an/a



Ludwig-Maximilians-Universit£t M£nchen

Curated by ChEMBL


Assay Description
Inhibition of mouse GAT2 expressed in HEK293 cells by [3H]GABA uptake assay


Bioorg Med Chem 23: 1284-306 (2015)


Article DOI: 10.1016/j.bmc.2015.01.035
BindingDB Entry DOI: 10.7270/Q2QR4ZTK
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(MOUSE)
BDBM50063513
PNG
(CHEMBL3398496)
Show SMILES OC(=O)C(F)(F)F.[H][C@@]1(CCCN1)[C@@H](N)C(O)=O |r|
Show InChI InChI=1S/C6H12N2O2/c7-5(6(9)10)4-2-1-3-8-4/h4-5,8H,1-3,7H2,(H,9,10)/t4-,5-/m1/s1
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n/an/a 1.58E+5n/an/an/an/an/an/a



Ludwig-Maximilians-Universit£t M£nchen

Curated by ChEMBL


Assay Description
Inhibition of mouse GAT2 expressed in HEK293 cells by [3H]GABA uptake assay


Bioorg Med Chem 23: 1284-306 (2015)


Article DOI: 10.1016/j.bmc.2015.01.035
BindingDB Entry DOI: 10.7270/Q2QR4ZTK
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(MOUSE)
BDBM50063510
PNG
(CHEMBL3398494)
Show SMILES [H][C@@]1(CCCN1)[C@@H](O)C(O)=O |r|
Show InChI InChI=1S/C6H11NO3/c8-5(6(9)10)4-2-1-3-7-4/h4-5,7-8H,1-3H2,(H,9,10)/t4-,5-/m1/s1
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n/an/a 1.70E+5n/an/an/an/an/an/a



Ludwig-Maximilians-Universit£t M£nchen

Curated by ChEMBL


Assay Description
Inhibition of mouse GAT2 expressed in HEK293 cells by [3H]GABA uptake assay


Bioorg Med Chem 23: 1284-306 (2015)


Article DOI: 10.1016/j.bmc.2015.01.035
BindingDB Entry DOI: 10.7270/Q2QR4ZTK
More data for this
Ligand-Target Pair