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PubMed code 8182696

Compile data set for download or QSAR
Found 10 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)		BDBM50038171
PNG
(7-Chloro-4-hydroxy-3-[3-(thiophen-3-yloxy)-phenyl]...)
Show SMILES Oc1c(-c2cccc(Oc3ccsc3)c2)c(=O)[nH]c2cc(Cl)ccc12
Show InChI InChI=1S/C19H12ClNO3S/c20-12-4-5-15-16(9-12)21-19(23)17(18(15)22)11-2-1-3-13(8-11)24-14-6-7-25-10-14/h1-10H,(H2,21,22,23)
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n/an/a 1.40n/an/an/an/an/an/a



Merck Sharp and Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of the binding of [3H]-L-689,560 ([3H]-4) to the strychnine-insensitive glycine site on rat brain membranes

J Med Chem 37: 1402-5 (1994)


BindingDB Entry DOI: 10.7270/Q2DF6Q8C
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)		BDBM50038168
PNG
(7-Chloro-4-hydroxy-3-(3-phenoxy-phenyl)-1H-quinoli...)
Show SMILES Oc1c(-c2cccc(Oc3ccccc3)c2)c(=O)[nH]c2cc(Cl)ccc12
Show InChI InChI=1S/C21H14ClNO3/c22-14-9-10-17-18(12-14)23-21(25)19(20(17)24)13-5-4-8-16(11-13)26-15-6-2-1-3-7-15/h1-12H,(H2,23,24,25)
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n/an/a 2n/an/an/an/an/an/a



Merck Sharp and Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of the binding of [3H]-L-689,560 ([3H]-4) to the strychnine-insensitive glycine site on rat brain membranes

J Med Chem 37: 1402-5 (1994)


BindingDB Entry DOI: 10.7270/Q2DF6Q8C
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)		BDBM50041466
PNG
(7-Chloro-4-hydroxy-3-[3-(4-methoxymethoxy-benzyl)-...)
Show SMILES COCOc1ccc(Cc2cccc(c2)-c2c(O)c3ccc(Cl)cc3[nH]c2=O)cc1
Show InChI InChI=1S/C24H20ClNO4/c1-29-14-30-19-8-5-15(6-9-19)11-16-3-2-4-17(12-16)22-23(27)20-10-7-18(25)13-21(20)26-24(22)28/h2-10,12-13H,11,14H2,1H3,(H2,26,27,28)
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n/an/a 2.20n/an/an/an/an/an/a



Merck Sharp and Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of the binding of [3H]-L-689,560 ([3H]-4) to the strychnine-insensitive glycine site on rat brain membranes

J Med Chem 37: 1402-5 (1994)


BindingDB Entry DOI: 10.7270/Q2DF6Q8C
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)		BDBM50041468
PNG
(7-Chloro-4-hydroxy-3-(3-thiophen-3-ylmethyl-phenyl...)
Show SMILES Oc1c(-c2cccc(Cc3ccsc3)c2)c(=O)[nH]c2cc(Cl)ccc12
Show InChI InChI=1S/C20H14ClNO2S/c21-15-4-5-16-17(10-15)22-20(24)18(19(16)23)14-3-1-2-12(9-14)8-13-6-7-25-11-13/h1-7,9-11H,8H2,(H2,22,23,24)
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n/an/a 2.30n/an/an/an/an/an/a



Merck Sharp and Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of the binding of [3H]-L-689,560 ([3H]-4) to the strychnine-insensitive glycine site on rat brain membranes

J Med Chem 37: 1402-5 (1994)


BindingDB Entry DOI: 10.7270/Q2DF6Q8C
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)		BDBM50005075
PNG
((2R,4S)-5,7-Dichloro-4-(3-phenyl-ureido)-1,2,3,4-t...)
Show SMILES OC(=O)[C@H]1C[C@H](NC(=O)Nc2ccccc2)c2c(Cl)cc(Cl)cc2N1
Show InChI InChI=1S/C17H15Cl2N3O3/c18-9-6-11(19)15-12(7-9)21-14(16(23)24)8-13(15)22-17(25)20-10-4-2-1-3-5-10/h1-7,13-14,21H,8H2,(H,23,24)(H2,20,22,25)/t13-,14+/m0/s1
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n/an/a 4n/an/an/an/an/an/a



Merck Sharp and Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of the binding of [3H]-L-689,560 ([3H]-4) to the strychnine-insensitive glycine site on rat brain membranes

J Med Chem 37: 1402-5 (1994)


BindingDB Entry DOI: 10.7270/Q2DF6Q8C
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Glutamate receptor ionotropic, NMDA 1


(RAT)		BDBM50041464
PNG
(3-(3-Benzyl-phenyl)-7-chloro-4-hydroxy-1H-quinolin...)
Show SMILES Oc1c(-c2cccc(Cc3ccccc3)c2)c(=O)[nH]c2cc(Cl)ccc12
Show InChI InChI=1S/C22H16ClNO2/c23-17-9-10-18-19(13-17)24-22(26)20(21(18)25)16-8-4-7-15(12-16)11-14-5-2-1-3-6-14/h1-10,12-13H,11H2,(H2,24,25,26)
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n/an/a 4.10n/an/an/an/an/an/a



Merck Sharp and Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of the binding of [3H]-L-689,560 ([3H]-4) to the strychnine-insensitive glycine site on rat brain membranes

J Med Chem 37: 1402-5 (1994)


BindingDB Entry DOI: 10.7270/Q2DF6Q8C
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)		BDBM50041465
PNG
(7-Chloro-4-hydroxy-3-[3-(4-methoxy-benzyl)-phenyl]...)
Show SMILES COc1ccc(Cc2cccc(c2)-c2c(O)c3ccc(Cl)cc3[nH]c2=O)cc1
Show InChI InChI=1S/C23H18ClNO3/c1-28-18-8-5-14(6-9-18)11-15-3-2-4-16(12-15)21-22(26)19-10-7-17(24)13-20(19)25-23(21)27/h2-10,12-13H,11H2,1H3,(H2,25,26,27)
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n/an/a 4.5n/an/an/an/an/an/a



Merck Sharp and Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of the binding of [3H]-L-689,560 ([3H]-4) to the strychnine-insensitive glycine site on rat brain membranes

J Med Chem 37: 1402-5 (1994)


BindingDB Entry DOI: 10.7270/Q2DF6Q8C
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)		BDBM50005034
PNG
(7-Chloro-5-iodo-4-oxo-1,4-dihydro-quinoline-2-carb...)
Show SMILES OC(=O)c1cc(O)c2c(I)cc(Cl)cc2n1
Show InChI InChI=1S/C10H5ClINO3/c11-4-1-5(12)9-6(2-4)13-7(10(15)16)3-8(9)14/h1-3H,(H,13,14)(H,15,16)
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n/an/a 14n/an/an/an/an/an/a



Merck Sharp and Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of the binding of [3H]-L-689,560 ([3H]-4) to the strychnine-insensitive glycine site on rat brain membranes

J Med Chem 37: 1402-5 (1994)


BindingDB Entry DOI: 10.7270/Q2DF6Q8C
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)		BDBM50004952
PNG
(3-(2-Carboxy-ethyl)-4,6-dichloro-1H-indole-2-carbo...)
Show SMILES OC(=O)CCc1c([nH]c2cc(Cl)cc(Cl)c12)C(O)=O
Show InChI InChI=1S/C12H9Cl2NO4/c13-5-3-7(14)10-6(1-2-9(16)17)11(12(18)19)15-8(10)4-5/h3-4,15H,1-2H2,(H,16,17)(H,18,19)
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n/an/a 69n/an/an/an/an/an/a



Merck Sharp and Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of the binding of [3H]-L-689,560 ([3H]-4) to the strychnine-insensitive glycine site on rat brain membranes

J Med Chem 37: 1402-5 (1994)


BindingDB Entry DOI: 10.7270/Q2DF6Q8C
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)		BDBM50041467
PNG
(7-Chloro-4-hydroxy-3-phenyl-1H-quinolin-2-one | 7-...)
Show SMILES Oc1c(-c2ccccc2)c(=O)[nH]c2cc(Cl)ccc12
Show InChI InChI=1S/C15H10ClNO2/c16-10-6-7-11-12(8-10)17-15(19)13(14(11)18)9-4-2-1-3-5-9/h1-8H,(H2,17,18,19)
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n/an/a 170n/an/an/an/an/an/a



Merck Sharp and Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of the binding of [3H]-L-689,560 ([3H]-4) to the strychnine-insensitive glycine site on rat brain membranes

J Med Chem 37: 1402-5 (1994)


BindingDB Entry DOI: 10.7270/Q2DF6Q8C
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%