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PubMed code 11855983

Compile data set for download or QSAR
Found 18 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
Glutamate receptor ionotropic, NMDA 1


(RAT)
BDBM50078513
PNG
(7,8-Dichloro-4-oxo-4,5-dihydro-[1,2,4]triazolo[1,5...)
Show SMILES OC(=O)c1nc2n(n1)c1cc(Cl)c(Cl)cc1[nH]c2=O
Show InChI InChI=1S/C10H4Cl2N4O3/c11-3-1-5-6(2-4(3)12)16-8(9(17)13-5)14-7(15-16)10(18)19/h1-2H,(H,13,17)(H,18,19)
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74n/an/an/an/an/an/an/an/a



Universita' di Firenze

Curated by ChEMBL


Assay Description
Inhibition by displacing [3H]-Glycine of N-methyl-D-aspartate glutamate receptor 1 in rat cortical membranes


J Med Chem 45: 1035-44 (2002)


BindingDB Entry DOI: 10.7270/Q2WD3ZW6
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)
BDBM50110216
PNG
(8,9-Dichloro-5-oxo-5,6-dihydro-pyrazolo[1,5-c]quin...)
Show SMILES OC(=O)c1cc2c3cc(Cl)c(Cl)cc3[nH]c(=O)n2n1
Show InChI InChI=1S/C11H5Cl2N3O3/c12-5-1-4-7(2-6(5)13)14-11(19)16-9(4)3-8(15-16)10(17)18/h1-3H,(H,14,19)(H,17,18)
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160n/an/an/an/an/an/an/an/a



Universita' di Firenze

Curated by ChEMBL


Assay Description
Displacement of [3H]-Glycine from N-methyl-D-aspartate glutamate receptor 1 in rat cortical membranes


J Med Chem 45: 1035-44 (2002)


BindingDB Entry DOI: 10.7270/Q2WD3ZW6
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)
BDBM50110211
PNG
(8,9-Dichloro-5-oxo-1,5,6,10b-tetrahydro-pyrazolo[1...)
Show SMILES OC(=O)C1=NN2C(C1)c1cc(Cl)c(Cl)cc1NC2=O |t:3|
Show InChI InChI=1S/C11H7Cl2N3O3/c12-5-1-4-7(2-6(5)13)14-11(19)16-9(4)3-8(15-16)10(17)18/h1-2,9H,3H2,(H,14,19)(H,17,18)
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190n/an/an/an/an/an/an/an/a



Universita' di Firenze

Curated by ChEMBL


Assay Description
Inhibition by displacing [3H]-Glycine of N-methyl-D-aspartate glutamate receptor 1 in rat cortical membranes


J Med Chem 45: 1035-44 (2002)


BindingDB Entry DOI: 10.7270/Q2WD3ZW6
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)
BDBM50110213
PNG
(8-Chloro-5-oxo-1,5,6,10b-tetrahydro-pyrazolo[1,5-c...)
Show SMILES OC(=O)C1=NN2C(C1)c1ccc(Cl)cc1NC2=O |t:3|
Show InChI InChI=1S/C11H8ClN3O3/c12-5-1-2-6-7(3-5)13-11(18)15-9(6)4-8(14-15)10(16)17/h1-3,9H,4H2,(H,13,18)(H,16,17)
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240n/an/an/an/an/an/an/an/a



Universita' di Firenze

Curated by ChEMBL


Assay Description
Displacement of [3H]-Glycine from N-methyl-D-aspartate glutamate receptor 1 in rat cortical membranes


J Med Chem 45: 1035-44 (2002)


BindingDB Entry DOI: 10.7270/Q2WD3ZW6
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)
BDBM50110223
PNG
(8-Chloro-5-oxo-5,6-dihydro-pyrazolo[1,5-c]quinazol...)
Show SMILES OC(=O)c1cc2c3ccc(Cl)cc3[nH]c(=O)n2n1
Show InChI InChI=1S/C11H6ClN3O3/c12-5-1-2-6-7(3-5)13-11(18)15-9(6)4-8(14-15)10(16)17/h1-4H,(H,13,18)(H,16,17)
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480n/an/an/an/an/an/an/an/a



Universita' di Firenze

Curated by ChEMBL


Assay Description
Displacement of [3H]-Glycine from N-methyl-D-aspartate glutamate receptor 1 in rat cortical membranes


J Med Chem 45: 1035-44 (2002)


BindingDB Entry DOI: 10.7270/Q2WD3ZW6
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)
BDBM50110210
PNG
(8-Chloro-9-nitro-5-oxo-5,6-dihydro-pyrazolo[1,5-c]...)
Show SMILES OC(=O)c1cc2c3cc(c(Cl)cc3[n-]c(=[OH+])n2n1)[N+]([O-])=O
Show InChI InChI=1S/C11H5ClN4O5/c12-5-2-6-4(1-9(5)16(20)21)8-3-7(10(17)18)14-15(8)11(19)13-6/h1-3H,(H2,13,14,17,18,19)
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1.10E+3n/an/an/an/an/an/an/an/a



Universita' di Firenze

Curated by ChEMBL


Assay Description
Percent Inhibition by displacing [3H]-Glycine of N-methyl-D-aspartate glutamate receptor 1 in rat cortical membranes


J Med Chem 45: 1035-44 (2002)


BindingDB Entry DOI: 10.7270/Q2WD3ZW6
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)
BDBM50110217
PNG
(8,9-Dichloro-5-oxo-5,6-dihydro-pyrazolo[1,5-c]quin...)
Show SMILES COC(=O)c1cc2c3cc(Cl)c(Cl)cc3[nH]c(=O)n2n1
Show InChI InChI=1S/C12H7Cl2N3O3/c1-20-11(18)9-4-10-5-2-6(13)7(14)3-8(5)15-12(19)17(10)16-9/h2-4H,1H3,(H,15,19)
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1.30E+3n/an/an/an/an/an/an/an/a



Universita' di Firenze

Curated by ChEMBL


Assay Description
Displacement of [3H]-Glycine from N-methyl-D-aspartate glutamate receptor 1 in rat cortical membranes


J Med Chem 45: 1035-44 (2002)


BindingDB Entry DOI: 10.7270/Q2WD3ZW6
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)
BDBM50052298
PNG
(5-Oxo-5,6-dihydro-pyrazolo[1,5-c]quinazoline-2-car...)
Show SMILES OC(=O)c1cc2c3ccccc3[nH]c(=O)n2n1
Show InChI InChI=1S/C11H7N3O3/c15-10(16)8-5-9-6-3-1-2-4-7(6)12-11(17)14(9)13-8/h1-5H,(H,12,17)(H,15,16)
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1.41E+3n/an/an/an/an/an/an/an/a



Universita' di Firenze

Curated by ChEMBL


Assay Description
Displacement of [3H]-Glycine from N-methyl-D-aspartate glutamate receptor 1 in rat cortical membranes


J Med Chem 45: 1035-44 (2002)


BindingDB Entry DOI: 10.7270/Q2WD3ZW6
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)
BDBM50110221
PNG
(5-Oxo-1,5,6,10b-tetrahydro-pyrazolo[1,5-c]quinazol...)
Show SMILES OC(=O)C1=NN2C(C1)c1ccccc1NC2=O |t:3|
Show InChI InChI=1S/C11H9N3O3/c15-10(16)8-5-9-6-3-1-2-4-7(6)12-11(17)14(9)13-8/h1-4,9H,5H2,(H,12,17)(H,15,16)
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2.00E+3n/an/an/an/an/an/an/an/a



Universita' di Firenze

Curated by ChEMBL


Assay Description
Displacement of [3H]-Glycine from N-methyl-D-aspartate glutamate receptor 1 in rat cortical membranes


J Med Chem 45: 1035-44 (2002)


BindingDB Entry DOI: 10.7270/Q2WD3ZW6
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)
BDBM50110222
PNG
(8,9-Dichloro-5-oxo-1,5,6,10b-tetrahydro-pyrazolo[1...)
Show SMILES COC(=O)C1=NN2C(C1)c1cc(Cl)c(Cl)cc1NC2=O |t:4|
Show InChI InChI=1S/C12H9Cl2N3O3/c1-20-11(18)9-4-10-5-2-6(13)7(14)3-8(5)15-12(19)17(10)16-9/h2-3,10H,4H2,1H3,(H,15,19)
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4.00E+3n/an/an/an/an/an/an/an/a



Universita' di Firenze

Curated by ChEMBL


Assay Description
Displacement of [3H]-Glycine from N-methyl-D-aspartate glutamate receptor 1 in rat cortical membranes


J Med Chem 45: 1035-44 (2002)


BindingDB Entry DOI: 10.7270/Q2WD3ZW6
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)
BDBM50110209
PNG
(8-Chloro-9-(3-formyl-pyrrol-1-yl)-5-oxo-5,6-dihydr...)
Show SMILES OC(=O)c1cc2c3cc(c(Cl)cc3[nH]c(=O)n2n1)-n1ccc(C=O)c1
Show InChI InChI=1S/C16H9ClN4O4/c17-10-4-11-9(3-14(10)20-2-1-8(6-20)7-22)13-5-12(15(23)24)19-21(13)16(25)18-11/h1-7H,(H,18,25)(H,23,24)
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8.20E+3n/an/an/an/an/an/an/an/a



Universita' di Firenze

Curated by ChEMBL


Assay Description
Inhibition by displacing [3H]-Glycine of N-methyl-D-aspartate glutamate receptor 1 in rat cortical membranes


J Med Chem 45: 1035-44 (2002)


BindingDB Entry DOI: 10.7270/Q2WD3ZW6
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)
BDBM50229505
PNG
(8-Chloro-5-oxo-9-[1,2,4]triazol-4-yl-5,6-dihydro-p...)
Show SMILES OC(=O)c1cc2c3cc(c(Cl)cc3[nH]c(=O)n2n1)-n1cnnc1
Show InChI InChI=1S/C13H7ClN6O3/c14-7-2-8-6(1-11(7)19-4-15-16-5-19)10-3-9(12(21)22)18-20(10)13(23)17-8/h1-5H,(H,17,23)(H,21,22)
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8.30E+3n/an/an/an/an/an/an/an/a



Universita' di Firenze

Curated by ChEMBL


Assay Description
Displacement of [3H]-Glycine from N-methyl-D-aspartate glutamate receptor 1 in rat cortical membranes


J Med Chem 45: 1035-44 (2002)


BindingDB Entry DOI: 10.7270/Q2WD3ZW6
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)
BDBM50110224
PNG
(8-Chloro-9-nitro-5-oxo-5,6-dihydro-pyrazolo[1,5-c]...)
Show SMILES CCOC(=O)c1cc2c3cc(c(Cl)cc3[n-]c(=[OH+])n2n1)[N+]([O-])=O
Show InChI InChI=1S/C13H9ClN4O5/c1-2-23-12(19)9-5-10-6-3-11(18(21)22)7(14)4-8(6)15-13(20)17(10)16-9/h3-5H,2H2,1H3,(H,15,16,20)
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1.06E+4n/an/an/an/an/an/an/an/a



Universita' di Firenze

Curated by ChEMBL


Assay Description
Displacement of [3H]-Glycine from N-methyl-D-aspartate glutamate receptor 1 in rat cortical membranes


J Med Chem 45: 1035-44 (2002)


BindingDB Entry DOI: 10.7270/Q2WD3ZW6
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)
BDBM50110215
PNG
(8-Chloro-5-oxo-1,5,6,10b-tetrahydro-pyrazolo[1,5-c...)
Show SMILES COC(=O)C1=NN2C(C1)c1ccc(Cl)cc1NC2=O |t:4|
Show InChI InChI=1S/C12H10ClN3O3/c1-19-11(17)9-5-10-7-3-2-6(13)4-8(7)14-12(18)16(10)15-9/h2-4,10H,5H2,1H3,(H,14,18)
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1.06E+4n/an/an/an/an/an/an/an/a



Universita' di Firenze

Curated by ChEMBL


Assay Description
Displacement of [3H]-Glycine from N-methyl-D-aspartate glutamate receptor 1 in rat cortical membranes


J Med Chem 45: 1035-44 (2002)


BindingDB Entry DOI: 10.7270/Q2WD3ZW6
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)
BDBM50110214
PNG
(8-Chloro-5-oxo-5,6-dihydro-pyrazolo[1,5-c]quinazol...)
Show SMILES CCOC(=O)c1cc2c3ccc(Cl)cc3[nH]c(=O)n2n1
Show InChI InChI=1S/C13H10ClN3O3/c1-2-20-12(18)10-6-11-8-4-3-7(14)5-9(8)15-13(19)17(11)16-10/h3-6H,2H2,1H3,(H,15,19)
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2.65E+4n/an/an/an/an/an/an/an/a



Universita' di Firenze

Curated by ChEMBL


Assay Description
Displacement of [3H]-Glycine from N-methyl-D-aspartate glutamate receptor 1 in rat cortical membranes


J Med Chem 45: 1035-44 (2002)


BindingDB Entry DOI: 10.7270/Q2WD3ZW6
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)
BDBM50052308
PNG
(5-Oxo-5,6-dihydro-pyrazolo[1,5-c]quinazoline-2-car...)
Show SMILES CCOC(=O)c1cc2c3ccccc3[nH]c(=O)n2n1
Show InChI InChI=1S/C13H11N3O3/c1-2-19-12(17)10-7-11-8-5-3-4-6-9(8)14-13(18)16(11)15-10/h3-7H,2H2,1H3,(H,14,18)
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3.33E+4n/an/an/an/an/an/an/an/a



Universita' di Firenze

Curated by ChEMBL


Assay Description
Displacement of [3H]-Glycine from N-methyl-D-aspartate glutamate receptor 1 in rat cortical membranes


J Med Chem 45: 1035-44 (2002)


BindingDB Entry DOI: 10.7270/Q2WD3ZW6
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)
BDBM50092637
PNG
(7-Chloro-4-oxo-8-[1,2,4]triazol-4-yl-4,5-dihydro-[...)
Show SMILES OC(=O)c1nc2n(n1)c1cc(c(Cl)cc1[nH]c2=O)-n1cnnc1
Show InChI InChI=1S/C12H6ClN7O3/c13-5-1-6-8(2-7(5)19-3-14-15-4-19)20-10(11(21)16-6)17-9(18-20)12(22)23/h1-4H,(H,16,21)(H,22,23)
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3.35E+4n/an/an/an/an/an/an/an/a



Universita' di Firenze

Curated by ChEMBL


Assay Description
Inhibition by displacing [3H]-Glycine of N-methyl-D-aspartate glutamate receptor 1 in rat cortical membranes


J Med Chem 45: 1035-44 (2002)


BindingDB Entry DOI: 10.7270/Q2WD3ZW6
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)
BDBM50110220
PNG
(8-Chloro-9-(3-formyl-pyrrol-1-yl)-5-oxo-5,6-dihydr...)
Show SMILES CCOC(=O)c1cc2c3cc(c(Cl)cc3[nH]c(=O)n2n1)-n1ccc(C=O)c1
Show InChI InChI=1S/C18H13ClN4O4/c1-2-27-17(25)14-7-15-11-5-16(22-4-3-10(8-22)9-24)12(19)6-13(11)20-18(26)23(15)21-14/h3-9H,2H2,1H3,(H,20,26)
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5.70E+4n/an/an/an/an/an/an/an/a



Universita' di Firenze

Curated by ChEMBL


Assay Description
Inhibition by displacing [3H]-Glycine of N-methyl-D-aspartate glutamate receptor 1 in rat cortical membranes


J Med Chem 45: 1035-44 (2002)


BindingDB Entry DOI: 10.7270/Q2WD3ZW6
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%