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PubMed code 22594609

Compile data set for download or QSAR
Found 30 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Excitatory amino acid transporter 1


(HUMAN)
BDBM50328509
PNG
(2-Amino-4-methyl-7-(naphthalen-1-yl)-5-oxo-5,6,7,8...)
Show SMILES CC1C(C#N)C(=N)OC2=C1C(=O)CC(C2)c1cccc2ccccc12
Show InChI InChI=1S/C21H18N2O2/c1-12-17(11-22)21(23)25-19-10-14(9-18(24)20(12)19)16-8-4-6-13-5-2-3-7-15(13)16/h2-8,12,14,17,23H,9-10H2,1H3
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n/an/a 420n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Inhibition of human EAAT1 expressed in HEK293 cells assessed as inhibition of 3[H]-D-Aspartate uptake after 6 mins by scintillation counting method


J Med Chem 55: 5403-12 (2012)


Article DOI: 10.1021/jm300345z
BindingDB Entry DOI: 10.7270/Q2Q81F5W
More data for this
Ligand-Target Pair
Excitatory amino acid transporter 1


(HUMAN)
BDBM50292997
PNG
(2-Amino-4-(4-methoxyphenyl)-7-(naphthalene-1-yl)-5...)
Show SMILES COc1ccc(cc1)C1C(C#N)C(=N)OC2=C1C(=O)CC(C2)c1cccc2ccccc12
Show InChI InChI=1S/C27H22N2O3/c1-31-19-11-9-17(10-12-19)25-22(15-28)27(29)32-24-14-18(13-23(30)26(24)25)21-8-4-6-16-5-2-3-7-20(16)21/h2-12,18,22,25,29H,13-14H2,1H3
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n/an/a 660n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Inhibition of human EAAT1 expressed in HEK293 cells assessed as inhibition of 3[H]-D-Aspartate uptake after 6 mins by scintillation counting method


J Med Chem 55: 5403-12 (2012)


Article DOI: 10.1021/jm300345z
BindingDB Entry DOI: 10.7270/Q2Q81F5W
More data for this
Ligand-Target Pair
Excitatory amino acid transporter 1


(HUMAN)
BDBM50389168
PNG
(CHEMBL2062786)
Show SMILES C[C@@H](N1CC(=O)C2=C(C1)OC(=N)C(C#N)[C@H]2c1ccccc1)c1ccccc1
Show InChI InChI=1S/C23H21N3O2/c1-15(16-8-4-2-5-9-16)26-13-19(27)22-20(14-26)28-23(25)18(12-24)21(22)17-10-6-3-7-11-17/h2-11,15,18,21,25H,13-14H2,1H3/t15-,18?,21-/m1/s1
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n/an/a 3.72E+3n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Inhibition of human EAAT1 expressed in HEK293 cells assessed as inhibition of 3[H]-D-Aspartate uptake after 6 mins by scintillation counting method


J Med Chem 55: 5403-12 (2012)


Article DOI: 10.1021/jm300345z
BindingDB Entry DOI: 10.7270/Q2Q81F5W
More data for this
Ligand-Target Pair
Excitatory amino acid transporter 1


(HUMAN)
BDBM50328510
PNG
(2-Amino-5-oxo-4,7-diphenyl-5,6,7,8-tetrahydro-4H-c...)
Show SMILES N=C1OC2=C(C(C1C#N)c1ccccc1)C(=O)CC(C2)c1ccccc1
Show InChI InChI=1S/C22H18N2O2/c23-13-17-20(15-9-5-2-6-10-15)21-18(25)11-16(12-19(21)26-22(17)24)14-7-3-1-4-8-14/h1-10,16-17,20,24H,11-12H2
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n/an/a 3.90E+3n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Inhibition of human EAAT1 expressed in HEK293 cells assessed as inhibition of 3[H]-D-Aspartate uptake after 6 mins by scintillation counting method


J Med Chem 55: 5403-12 (2012)


Article DOI: 10.1021/jm300345z
BindingDB Entry DOI: 10.7270/Q2Q81F5W
More data for this
Ligand-Target Pair
Excitatory amino acid transporter 1


(HUMAN)
BDBM50328507
PNG
(2-Amino-7-benzyl-4-(4-methoxyphenyl)-5-oxo-5,6,7,8...)
Show SMILES COc1ccc(cc1)C1C(C#N)C(=N)OC2=C1C(=O)CC(Cc1ccccc1)C2
Show InChI InChI=1S/C24H22N2O3/c1-28-18-9-7-17(8-10-18)22-19(14-25)24(26)29-21-13-16(12-20(27)23(21)22)11-15-5-3-2-4-6-15/h2-10,16,19,22,26H,11-13H2,1H3
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n/an/a 5.10E+3n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Inhibition of human EAAT1 expressed in HEK293 cells assessed as inhibition of 3[H]-D-Aspartate uptake after 6 mins by scintillation counting method


J Med Chem 55: 5403-12 (2012)


Article DOI: 10.1021/jm300345z
BindingDB Entry DOI: 10.7270/Q2Q81F5W
More data for this
Ligand-Target Pair
Excitatory amino acid transporter 1


(HUMAN)
BDBM50389173
PNG
(CHEMBL2062783)
Show SMILES C[C@H](N1CC(=O)C2=C(C1)OC(=N)C(C#N)[C@H]2c1ccccc1)c1ccccc1
Show InChI InChI=1S/C23H21N3O2/c1-15(16-8-4-2-5-9-16)26-13-19(27)22-20(14-26)28-23(25)18(12-24)21(22)17-10-6-3-7-11-17/h2-11,15,18,21,25H,13-14H2,1H3/t15-,18?,21+/m0/s1
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n/an/a 5.25E+3n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Inhibition of human EAAT1 expressed in HEK293 cells assessed as inhibition of 3[H]-D-Aspartate uptake after 6 mins by scintillation counting method


J Med Chem 55: 5403-12 (2012)


Article DOI: 10.1021/jm300345z
BindingDB Entry DOI: 10.7270/Q2Q81F5W
More data for this
Ligand-Target Pair
Excitatory amino acid transporter 1


(HUMAN)
BDBM50292990
PNG
(2-amino-4-methyl-5-oxo-7-phenyl-5,6,7,8-tetrahydro...)
Show SMILES CC1C(C#N)C(=N)OC2=C1C(=O)CC(C2)c1ccccc1
Show InChI InChI=1S/C17H16N2O2/c1-10-13(9-18)17(19)21-15-8-12(7-14(20)16(10)15)11-5-3-2-4-6-11/h2-6,10,12-13,19H,7-8H2,1H3
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n/an/a 9.20E+3n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Inhibition of human EAAT1 expressed in HEK293 cells assessed as inhibition of 3[H]-D-Aspartate uptake after 6 mins by scintillation counting method


J Med Chem 55: 5403-12 (2012)


Article DOI: 10.1021/jm300345z
BindingDB Entry DOI: 10.7270/Q2Q81F5W
More data for this
Ligand-Target Pair
Excitatory amino acid transporter 1


(HUMAN)
BDBM50389169
PNG
(CHEMBL2062781)
Show SMILES N=C1OC2=C(C(C1C#N)c1ccccc1)C(=O)CN(Cc1ccccc1)C2
Show InChI InChI=1S/C22H19N3O2/c23-11-17-20(16-9-5-2-6-10-16)21-18(26)13-25(14-19(21)27-22(17)24)12-15-7-3-1-4-8-15/h1-10,17,20,24H,12-14H2
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n/an/a 1.62E+4n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Inhibition of human EAAT1 expressed in HEK293 cells assessed as inhibition of 3[H]-D-Aspartate uptake after 6 mins by scintillation counting method


J Med Chem 55: 5403-12 (2012)


Article DOI: 10.1021/jm300345z
BindingDB Entry DOI: 10.7270/Q2Q81F5W
More data for this
Ligand-Target Pair
Excitatory amino acid transporter 3


(HUMAN)
BDBM50389170
PNG
(CHEMBL2062782)
Show SMILES N=C1OC2=C(C(C1C#N)c1ccccc1)C(=O)CN(C2)C(=O)c1ccccc1
Show InChI InChI=1S/C22H17N3O3/c23-11-16-19(14-7-3-1-4-8-14)20-17(26)12-25(13-18(20)28-21(16)24)22(27)15-9-5-2-6-10-15/h1-10,16,19,24H,12-13H2
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Inhibition of human EAAT3 expressed in HEK293 cells assessed as inhibition of 3[H]-D-Aspartate uptake after 6 mins by scintillation counting method


J Med Chem 55: 5403-12 (2012)


Article DOI: 10.1021/jm300345z
BindingDB Entry DOI: 10.7270/Q2Q81F5W
More data for this
Ligand-Target Pair
Excitatory Amino Acid EAAT2


()
BDBM50389175
PNG
(CHEMBL2062780)
Show SMILES N=C1OC2=C(C(C1C#N)c1ccccc1)C(=O)CN(C2)c1ccccc1
Show InChI InChI=1S/C21H17N3O2/c22-11-16-19(14-7-3-1-4-8-14)20-17(25)12-24(13-18(20)26-21(16)23)15-9-5-2-6-10-15/h1-10,16,19,23H,12-13H2
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Inhibition of human EAAT2 expressed in HEK293 cells assessed as inhibition of 3[H]-D-Aspartate uptake after 6 mins by scintillation counting method


J Med Chem 55: 5403-12 (2012)


Article DOI: 10.1021/jm300345z
BindingDB Entry DOI: 10.7270/Q2Q81F5W
More data for this
Ligand-Target Pair
Excitatory amino acid transporter 1


(HUMAN)
BDBM50389170
PNG
(CHEMBL2062782)
Show SMILES N=C1OC2=C(C(C1C#N)c1ccccc1)C(=O)CN(C2)C(=O)c1ccccc1
Show InChI InChI=1S/C22H17N3O3/c23-11-16-19(14-7-3-1-4-8-14)20-17(26)12-25(13-18(20)28-21(16)24)22(27)15-9-5-2-6-10-15/h1-10,16,19,24H,12-13H2
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Inhibition of human EAAT1 expressed in HEK293 cells assessed as inhibition of 3[H]-D-Aspartate uptake after 6 mins by scintillation counting method


J Med Chem 55: 5403-12 (2012)


Article DOI: 10.1021/jm300345z
BindingDB Entry DOI: 10.7270/Q2Q81F5W
More data for this
Ligand-Target Pair
Excitatory amino acid transporter 1


(HUMAN)
BDBM50389175
PNG
(CHEMBL2062780)
Show SMILES N=C1OC2=C(C(C1C#N)c1ccccc1)C(=O)CN(C2)c1ccccc1
Show InChI InChI=1S/C21H17N3O2/c22-11-16-19(14-7-3-1-4-8-14)20-17(25)12-24(13-18(20)26-21(16)23)15-9-5-2-6-10-15/h1-10,16,19,23H,12-13H2
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Inhibition of human EAAT1 expressed in HEK293 cells assessed as inhibition of 3[H]-D-Aspartate uptake after 6 mins by scintillation counting method


J Med Chem 55: 5403-12 (2012)


Article DOI: 10.1021/jm300345z
BindingDB Entry DOI: 10.7270/Q2Q81F5W
More data for this
Ligand-Target Pair
Excitatory amino acid transporter 3


(HUMAN)
BDBM50389175
PNG
(CHEMBL2062780)
Show SMILES N=C1OC2=C(C(C1C#N)c1ccccc1)C(=O)CN(C2)c1ccccc1
Show InChI InChI=1S/C21H17N3O2/c22-11-16-19(14-7-3-1-4-8-14)20-17(25)12-24(13-18(20)26-21(16)23)15-9-5-2-6-10-15/h1-10,16,19,23H,12-13H2
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Inhibition of human EAAT3 expressed in HEK293 cells assessed as inhibition of 3[H]-D-Aspartate uptake after 6 mins by scintillation counting method


J Med Chem 55: 5403-12 (2012)


Article DOI: 10.1021/jm300345z
BindingDB Entry DOI: 10.7270/Q2Q81F5W
More data for this
Ligand-Target Pair
Excitatory Amino Acid EAAT2


()
BDBM50389170
PNG
(CHEMBL2062782)
Show SMILES N=C1OC2=C(C(C1C#N)c1ccccc1)C(=O)CN(C2)C(=O)c1ccccc1
Show InChI InChI=1S/C22H17N3O3/c23-11-16-19(14-7-3-1-4-8-14)20-17(26)12-25(13-18(20)28-21(16)24)22(27)15-9-5-2-6-10-15/h1-10,16,19,24H,12-13H2
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Inhibition of human EAAT2 expressed in HEK293 cells assessed as inhibition of 3[H]-D-Aspartate uptake after 6 mins by scintillation counting method


J Med Chem 55: 5403-12 (2012)


Article DOI: 10.1021/jm300345z
BindingDB Entry DOI: 10.7270/Q2Q81F5W
More data for this
Ligand-Target Pair
Excitatory Amino Acid EAAT2


()
BDBM50389173
PNG
(CHEMBL2062783)
Show SMILES C[C@H](N1CC(=O)C2=C(C1)OC(=N)C(C#N)[C@H]2c1ccccc1)c1ccccc1
Show InChI InChI=1S/C23H21N3O2/c1-15(16-8-4-2-5-9-16)26-13-19(27)22-20(14-26)28-23(25)18(12-24)21(22)17-10-6-3-7-11-17/h2-11,15,18,21,25H,13-14H2,1H3/t15-,18?,21+/m0/s1
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n/an/a>3.00E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Inhibition of human EAAT2 expressed in HEK293 cells assessed as inhibition of 3[H]-D-Aspartate uptake after 6 mins by scintillation counting method


J Med Chem 55: 5403-12 (2012)


Article DOI: 10.1021/jm300345z
BindingDB Entry DOI: 10.7270/Q2Q81F5W
More data for this
Ligand-Target Pair
Excitatory Amino Acid EAAT2


()
BDBM50389172
PNG
(CHEMBL2062785)
Show SMILES C[C@@H](N1CC(=O)C2=C(C1)OC(=N)C(C#N)[C@@H]2c1ccccc1)c1ccccc1
Show InChI InChI=1S/C23H21N3O2/c1-15(16-8-4-2-5-9-16)26-13-19(27)22-20(14-26)28-23(25)18(12-24)21(22)17-10-6-3-7-11-17/h2-11,15,18,21,25H,13-14H2,1H3/t15-,18?,21+/m1/s1
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n/an/a>3.00E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Inhibition of human EAAT2 expressed in HEK293 cells assessed as inhibition of 3[H]-D-Aspartate uptake after 6 mins by scintillation counting method


J Med Chem 55: 5403-12 (2012)


Article DOI: 10.1021/jm300345z
BindingDB Entry DOI: 10.7270/Q2Q81F5W
More data for this
Ligand-Target Pair
Excitatory Amino Acid EAAT2


()
BDBM50389171
PNG
(CHEMBL2062784)
Show SMILES C[C@H](N1CC(=O)C2=C(C1)OC(=N)C(C#N)[C@@H]2c1ccccc1)c1ccccc1
Show InChI InChI=1S/C23H21N3O2/c1-15(16-8-4-2-5-9-16)26-13-19(27)22-20(14-26)28-23(25)18(12-24)21(22)17-10-6-3-7-11-17/h2-11,15,18,21,25H,13-14H2,1H3/t15-,18?,21-/m0/s1
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n/an/a>3.00E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Inhibition of human EAAT2 expressed in HEK293 cells assessed as inhibition of 3[H]-D-Aspartate uptake after 6 mins by scintillation counting method


J Med Chem 55: 5403-12 (2012)


Article DOI: 10.1021/jm300345z
BindingDB Entry DOI: 10.7270/Q2Q81F5W
More data for this
Ligand-Target Pair
Excitatory Amino Acid EAAT2


()
BDBM50389169
PNG
(CHEMBL2062781)
Show SMILES N=C1OC2=C(C(C1C#N)c1ccccc1)C(=O)CN(Cc1ccccc1)C2
Show InChI InChI=1S/C22H19N3O2/c23-11-17-20(16-9-5-2-6-10-16)21-18(26)13-25(14-19(21)27-22(17)24)12-15-7-3-1-4-8-15/h1-10,17,20,24H,12-14H2
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n/an/a>3.00E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Inhibition of human EAAT2 expressed in HEK293 cells assessed as inhibition of 3[H]-D-Aspartate uptake after 6 mins by scintillation counting method


J Med Chem 55: 5403-12 (2012)


Article DOI: 10.1021/jm300345z
BindingDB Entry DOI: 10.7270/Q2Q81F5W
More data for this
Ligand-Target Pair
Excitatory amino acid transporter 1


(HUMAN)
BDBM50292989
PNG
(2-Amino-5-oxo-7-phenyl-5,6,7,8-tetrahydro-4H-chrom...)
Show SMILES N=C1OC2=C(CC1C#N)C(=O)CC(C2)c1ccccc1
Show InChI InChI=1S/C16H14N2O2/c17-9-12-6-13-14(19)7-11(8-15(13)20-16(12)18)10-4-2-1-3-5-10/h1-5,11-12,18H,6-8H2
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n/an/a>3.00E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Inhibition of human EAAT1 expressed in HEK293 cells assessed as inhibition of 3[H]-D-Aspartate uptake after 6 mins by scintillation counting method


J Med Chem 55: 5403-12 (2012)


Article DOI: 10.1021/jm300345z
BindingDB Entry DOI: 10.7270/Q2Q81F5W
More data for this
Ligand-Target Pair
Excitatory amino acid transporter 3


(HUMAN)
BDBM50389169
PNG
(CHEMBL2062781)
Show SMILES N=C1OC2=C(C(C1C#N)c1ccccc1)C(=O)CN(Cc1ccccc1)C2
Show InChI InChI=1S/C22H19N3O2/c23-11-17-20(16-9-5-2-6-10-16)21-18(26)13-25(14-19(21)27-22(17)24)12-15-7-3-1-4-8-15/h1-10,17,20,24H,12-14H2
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n/an/a>3.00E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Inhibition of human EAAT3 expressed in HEK293 cells assessed as inhibition of 3[H]-D-Aspartate uptake after 6 mins by scintillation counting method


J Med Chem 55: 5403-12 (2012)


Article DOI: 10.1021/jm300345z
BindingDB Entry DOI: 10.7270/Q2Q81F5W
More data for this
Ligand-Target Pair
Excitatory amino acid transporter 3


(HUMAN)
BDBM50389168
PNG
(CHEMBL2062786)
Show SMILES C[C@@H](N1CC(=O)C2=C(C1)OC(=N)C(C#N)[C@H]2c1ccccc1)c1ccccc1
Show InChI InChI=1S/C23H21N3O2/c1-15(16-8-4-2-5-9-16)26-13-19(27)22-20(14-26)28-23(25)18(12-24)21(22)17-10-6-3-7-11-17/h2-11,15,18,21,25H,13-14H2,1H3/t15-,18?,21-/m1/s1
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n/an/a>3.00E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Inhibition of human EAAT3 expressed in HEK293 cells assessed as inhibition of 3[H]-D-Aspartate uptake after 6 mins by scintillation counting method


J Med Chem 55: 5403-12 (2012)


Article DOI: 10.1021/jm300345z
BindingDB Entry DOI: 10.7270/Q2Q81F5W
More data for this
Ligand-Target Pair
Excitatory Amino Acid EAAT2


()
BDBM50389168
PNG
(CHEMBL2062786)
Show SMILES C[C@@H](N1CC(=O)C2=C(C1)OC(=N)C(C#N)[C@H]2c1ccccc1)c1ccccc1
Show InChI InChI=1S/C23H21N3O2/c1-15(16-8-4-2-5-9-16)26-13-19(27)22-20(14-26)28-23(25)18(12-24)21(22)17-10-6-3-7-11-17/h2-11,15,18,21,25H,13-14H2,1H3/t15-,18?,21-/m1/s1
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n/an/a>3.00E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Inhibition of human EAAT2 expressed in HEK293 cells assessed as inhibition of 3[H]-D-Aspartate uptake after 6 mins by scintillation counting method


J Med Chem 55: 5403-12 (2012)


Article DOI: 10.1021/jm300345z
BindingDB Entry DOI: 10.7270/Q2Q81F5W
More data for this
Ligand-Target Pair
Excitatory amino acid transporter 1


(HUMAN)
BDBM50328518
PNG
(CHEMBL1259081 | syn-2-amino-5-oxo-4,7-diphenyl-5,6...)
Show SMILES N=C1OC2=C([C@@H](C1C#N)c1ccccc1)C(=O)N[C@H](C2)c1ccccc1
Show InChI InChI=1S/C21H17N3O2/c22-12-15-18(14-9-5-2-6-10-14)19-17(26-20(15)23)11-16(24-21(19)25)13-7-3-1-4-8-13/h1-10,15-16,18,23H,11H2,(H,24,25)/t15?,16-,18-/m1/s1
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n/an/a>3.00E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Inhibition of human EAAT1 expressed in HEK293 cells assessed as inhibition of 3[H]-D-Aspartate uptake after 6 mins by scintillation counting method


J Med Chem 55: 5403-12 (2012)


Article DOI: 10.1021/jm300345z
BindingDB Entry DOI: 10.7270/Q2Q81F5W
More data for this
Ligand-Target Pair
Excitatory amino acid transporter 1


(HUMAN)
BDBM50389174
PNG
(CHEMBL2062777)
Show SMILES CC1(C)C(C#N)C(=N)OC2=C1C(=O)CC(C2)c1ccccc1
Show InChI InChI=1S/C18H18N2O2/c1-18(2)13(10-19)17(20)22-15-9-12(8-14(21)16(15)18)11-6-4-3-5-7-11/h3-7,12-13,20H,8-9H2,1-2H3
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n/an/a>3.00E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Inhibition of human EAAT1 expressed in HEK293 cells assessed as inhibition of 3[H]-D-Aspartate uptake after 6 mins by scintillation counting method


J Med Chem 55: 5403-12 (2012)


Article DOI: 10.1021/jm300345z
BindingDB Entry DOI: 10.7270/Q2Q81F5W
More data for this
Ligand-Target Pair
Excitatory amino acid transporter 3


(HUMAN)
BDBM50389172
PNG
(CHEMBL2062785)
Show SMILES C[C@@H](N1CC(=O)C2=C(C1)OC(=N)C(C#N)[C@@H]2c1ccccc1)c1ccccc1
Show InChI InChI=1S/C23H21N3O2/c1-15(16-8-4-2-5-9-16)26-13-19(27)22-20(14-26)28-23(25)18(12-24)21(22)17-10-6-3-7-11-17/h2-11,15,18,21,25H,13-14H2,1H3/t15-,18?,21+/m1/s1
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n/an/a>3.00E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Inhibition of human EAAT3 expressed in HEK293 cells assessed as inhibition of 3[H]-D-Aspartate uptake after 6 mins by scintillation counting method


J Med Chem 55: 5403-12 (2012)


Article DOI: 10.1021/jm300345z
BindingDB Entry DOI: 10.7270/Q2Q81F5W
More data for this
Ligand-Target Pair
Excitatory amino acid transporter 3


(HUMAN)
BDBM50389171
PNG
(CHEMBL2062784)
Show SMILES C[C@H](N1CC(=O)C2=C(C1)OC(=N)C(C#N)[C@@H]2c1ccccc1)c1ccccc1
Show InChI InChI=1S/C23H21N3O2/c1-15(16-8-4-2-5-9-16)26-13-19(27)22-20(14-26)28-23(25)18(12-24)21(22)17-10-6-3-7-11-17/h2-11,15,18,21,25H,13-14H2,1H3/t15-,18?,21-/m0/s1
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n/an/a>3.00E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Inhibition of human EAAT3 expressed in HEK293 cells assessed as inhibition of 3[H]-D-Aspartate uptake after 6 mins by scintillation counting method


J Med Chem 55: 5403-12 (2012)


Article DOI: 10.1021/jm300345z
BindingDB Entry DOI: 10.7270/Q2Q81F5W
More data for this
Ligand-Target Pair
Excitatory amino acid transporter 1


(HUMAN)
BDBM50328520
PNG
(CHEMBL1259099 | syn-2-Amino-5-oxo-4,7-diphenyl-4,5...)
Show SMILES N=C1OC2=C([C@@H](C1C#N)c1ccccc1)C(=O)O[C@H](C2)c1ccccc1
Show InChI InChI=1S/C21H16N2O3/c22-12-15-18(14-9-5-2-6-10-14)19-17(25-20(15)23)11-16(26-21(19)24)13-7-3-1-4-8-13/h1-10,15-16,18,23H,11H2/t15?,16-,18-/m1/s1
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n/an/a>3.00E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Inhibition of human EAAT1 expressed in HEK293 cells assessed as inhibition of 3[H]-D-Aspartate uptake after 6 mins by scintillation counting method


J Med Chem 55: 5403-12 (2012)


Article DOI: 10.1021/jm300345z
BindingDB Entry DOI: 10.7270/Q2Q81F5W
More data for this
Ligand-Target Pair
Excitatory amino acid transporter 3


(HUMAN)
BDBM50389173
PNG
(CHEMBL2062783)
Show SMILES C[C@H](N1CC(=O)C2=C(C1)OC(=N)C(C#N)[C@H]2c1ccccc1)c1ccccc1
Show InChI InChI=1S/C23H21N3O2/c1-15(16-8-4-2-5-9-16)26-13-19(27)22-20(14-26)28-23(25)18(12-24)21(22)17-10-6-3-7-11-17/h2-11,15,18,21,25H,13-14H2,1H3/t15-,18?,21+/m0/s1
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n/an/a>3.00E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Inhibition of human EAAT3 expressed in HEK293 cells assessed as inhibition of 3[H]-D-Aspartate uptake after 6 mins by scintillation counting method


J Med Chem 55: 5403-12 (2012)


Article DOI: 10.1021/jm300345z
BindingDB Entry DOI: 10.7270/Q2Q81F5W
More data for this
Ligand-Target Pair
Excitatory amino acid transporter 1


(HUMAN)
BDBM50389172
PNG
(CHEMBL2062785)
Show SMILES C[C@@H](N1CC(=O)C2=C(C1)OC(=N)C(C#N)[C@@H]2c1ccccc1)c1ccccc1
Show InChI InChI=1S/C23H21N3O2/c1-15(16-8-4-2-5-9-16)26-13-19(27)22-20(14-26)28-23(25)18(12-24)21(22)17-10-6-3-7-11-17/h2-11,15,18,21,25H,13-14H2,1H3/t15-,18?,21+/m1/s1
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n/an/a>3.16E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Inhibition of human EAAT1 expressed in HEK293 cells assessed as inhibition of 3[H]-D-Aspartate uptake after 6 mins by scintillation counting method


J Med Chem 55: 5403-12 (2012)


Article DOI: 10.1021/jm300345z
BindingDB Entry DOI: 10.7270/Q2Q81F5W
More data for this
Ligand-Target Pair
Excitatory amino acid transporter 1


(HUMAN)
BDBM50389171
PNG
(CHEMBL2062784)
Show SMILES C[C@H](N1CC(=O)C2=C(C1)OC(=N)C(C#N)[C@@H]2c1ccccc1)c1ccccc1
Show InChI InChI=1S/C23H21N3O2/c1-15(16-8-4-2-5-9-16)26-13-19(27)22-20(14-26)28-23(25)18(12-24)21(22)17-10-6-3-7-11-17/h2-11,15,18,21,25H,13-14H2,1H3/t15-,18?,21-/m0/s1
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n/an/a>3.16E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Inhibition of human EAAT1 expressed in HEK293 cells assessed as inhibition of 3[H]-D-Aspartate uptake after 6 mins by scintillation counting method


J Med Chem 55: 5403-12 (2012)


Article DOI: 10.1021/jm300345z
BindingDB Entry DOI: 10.7270/Q2Q81F5W
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%