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PubMed code 1310117

Compile data set for download or QSAR
Found 12 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-NMDA


(RAT)
BDBM18133
PNG
(2-aminoacetic acid | CHEMBL773 | Glycine | [14C]Gl...)
Show SMILES NCC(O)=O
Show InChI InChI=1S/C2H5NO2/c3-1-2(4)5/h1,3H2,(H,4,5)
PDB

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CHEMBL
DrugBank
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
PubMed
n/an/a 6.20E+3n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound required to inhibit [3H]-strychnine binding to N-methyl-D-aspartate glutamate receptor 1


Citation and Details
More data for this
Ligand-Target Pair
Glutamate-NMDA


(RAT)
BDBM50000101
PNG
(2,5-Dihydro-1H-pyrrole-3-carboxylic acid | CHEMBL3...)
Show SMILES OC(=O)C1=CCNC1
Show InChI InChI=1S/C5H7NO2/c7-5(8)4-1-2-6-3-4/h1,6H,2-3H2,(H,7,8)
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PC cid
PC sid
UniChem
PubMed
n/an/a 7.90E+3n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound required to inhibit [3H]-strychnine binding to N-methyl-D-aspartate glutamate receptor 1


Citation and Details
More data for this
Ligand-Target Pair
Glutamate-NMDA


(RAT)
BDBM50000102
PNG
(3-aminopropanoic acidbeta-alanine | Alanine-beta |...)
Show SMILES NCCC(O)=O
Show InChI InChI=1S/C3H7NO2/c4-2-1-3(5)6/h1-2,4H2,(H,5,6)
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KEGG
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PC cid
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UniChem

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PubMed
n/an/a 1.16E+4n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound required to inhibit [3H]-strychnine binding to N-methyl-D-aspartate glutamate receptor 1 of rat spinal cord ...


Citation and Details
More data for this
Ligand-Target Pair
Glutamate-NMDA


(RAT)
BDBM50000105
PNG
(CHEMBL72275 | Hpro | Prolin | prolina | proline | ...)
Show SMILES OC(=O)C1CCCN1
Show InChI InChI=1S/C5H9NO2/c7-5(8)4-2-1-3-6-4/h4,6H,1-3H2,(H,7,8)
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PubMed
n/an/a 1.72E+4n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound required to inhibit [3H]-strychnine binding to N-methyl-D-aspartate glutamate receptor 1


Citation and Details
More data for this
Ligand-Target Pair
Glutamate-NMDA


(RAT)
BDBM50000104
PNG
(Azetidine-3-carboxylic acid | CHEMBL310435)
Show SMILES OC(=O)C1CNC1
Show InChI InChI=1S/C4H7NO2/c6-4(7)3-1-5-2-3/h3,5H,1-2H2,(H,6,7)
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PubMed
n/an/a 2.37E+4n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound required to inhibit [3H]-strychnine binding to N-methyl-D-aspartate glutamate receptor 1


Citation and Details
More data for this
Ligand-Target Pair
Glutamate-NMDA


(RAT)
BDBM50000109
PNG
((2R)-2-aminopropanoic acid | (R)-2-aminopropanoic ...)
Show SMILES C[C@@H](N)C(O)=O
Show InChI InChI=1S/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m1/s1
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PubMed
n/an/a 9.09E+4n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound required to inhibit [3H]-strychnine binding to N-methyl-D-aspartate glutamate receptor 1 of rat spinal cord ...


Citation and Details
More data for this
Ligand-Target Pair
Glutamate-NMDA


(RAT)
BDBM50000106
PNG
(4-CARBOXYPIPERIDINE | CHEMBL279998 | Piperidine-4-...)
Show SMILES OC(=O)C1CCNCC1
Show InChI InChI=1S/C6H11NO2/c8-6(9)5-1-3-7-4-2-5/h5,7H,1-4H2,(H,8,9)
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PubMed
n/an/a 9.41E+4n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound required to inhibit [3H]-strychnine binding to N-methyl-D-aspartate glutamate receptor 1


Citation and Details
More data for this
Ligand-Target Pair
Glutamate-NMDA


(RAT)
BDBM50000099
PNG
((2S)-2-aminopropanoic acid | (S)-2-aminopropanoic ...)
Show SMILES C[C@H](N)C(O)=O
Show InChI InChI=1S/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1
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PubMed
n/an/a 1.98E+5n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound required to inhibit [3H]-strychnine binding to N-methyl-D-aspartate glutamate receptor 1


Citation and Details
More data for this
Ligand-Target Pair
Glutamate-NMDA


(RAT)
BDBM50000103
PNG
(2,5-Dihydro-1H-pyrrole-2-carboxylic acid | CHEMBL3...)
Show SMILES OC(=O)C1NCC=C1
Show InChI InChI=1S/C5H7NO2/c7-5(8)4-2-1-3-6-4/h1-2,4,6H,3H2,(H,7,8)
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PubMed
n/an/a 2.42E+5n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound required to inhibit [3H]-strychnine binding to N-methyl-D-aspartate glutamate receptor 1


Citation and Details
More data for this
Ligand-Target Pair
Glutamate-NMDA


(RAT)
BDBM50000108
PNG
(CHEMBL33592 | azetidine-2-carboxylic acid)
Show SMILES OC(=O)C1CCN1
Show InChI InChI=1S/C4H7NO2/c6-4(7)3-1-2-5-3/h3,5H,1-2H2,(H,6,7)
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PubMed
n/an/a 3.99E+5n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound required to inhibit [3H]-strychnine binding to N-methyl-D-aspartate glutamate receptor 1


Citation and Details
More data for this
Ligand-Target Pair
Glutamate-NMDA


(RAT)
BDBM50000100
PNG
((-)-(S)-proline | (-)-2-pyrrolidinecarboxylic acid...)
Show SMILES OC(=O)[C@@H]1CCCN1
Show InChI InChI=1S/C5H9NO2/c7-5(8)4-2-1-3-6-4/h4,6H,1-3H2,(H,7,8)/t4-/m0/s1
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PubMed
n/an/a 4.14E+5n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound required to inhibit [3H]-strychnine binding to N-methyl-D-aspartate glutamate receptor 1


Citation and Details
More data for this
Ligand-Target Pair
Glutamate-NMDA


(RAT)
BDBM50000107
PNG
(1-Methyl-1,2,5,6-tetrahydro-pyridine-3-carboxylic ...)
Show SMILES CN1CCC=C(C1)C(O)=O
Show InChI InChI=1S/C7H11NO2/c1-8-4-2-3-6(5-8)7(9)10/h3H,2,4-5H2,1H3,(H,9,10)
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PubMed
n/an/a 6.94E+5n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound required to inhibit [3H]-strychnine binding to N-methyl-D-aspartate glutamate receptor 1


Citation and Details
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%