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PubMed code 11164381

Compile data set for download or QSAR
Found 20 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 3


(RAT)
BDBM85743
PNG
(CAS_5289517 | NSC_5289517 | Thio-ATPA | Thio-ATPA-...)
Show SMILES CC(C)(C)c1s[n-]c(=O)c1CC([NH3+])C(O)=O
Show InChI InChI=1S/C10H16N2O3S/c1-10(2,3)7-5(8(13)12-16-7)4-6(11)9(14)15/h6H,4,11H2,1-3H3,(H2,12,13,14,15)
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270n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by PDSP Ki Database




Eur J Pharmacol 411: 245-53 (2001)


Article DOI: 10.1016/s0014-2999(00)00916-x
BindingDB Entry DOI: 10.7270/Q2G73C8N
More data for this
Ligand-Target Pair
Glutamate receptor 3


(RAT)
BDBM85743
PNG
(CAS_5289517 | NSC_5289517 | Thio-ATPA | Thio-ATPA-...)
Show SMILES CC(C)(C)c1s[n-]c(=O)c1CC([NH3+])C(O)=O
Show InChI InChI=1S/C10H16N2O3S/c1-10(2,3)7-5(8(13)12-16-7)4-6(11)9(14)15/h6H,4,11H2,1-3H3,(H2,12,13,14,15)
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570n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by PDSP Ki Database




Eur J Pharmacol 411: 245-53 (2001)


Article DOI: 10.1016/s0014-2999(00)00916-x
BindingDB Entry DOI: 10.7270/Q2G73C8N
More data for this
Ligand-Target Pair
Glutamate receptor 3


(RAT)
BDBM85744
PNG
(ATPA-S)
Show SMILES CC(C)(C)c1o[nH]c(=O)c1C[C@@H](N)C(O)=O |r|
Show InChI InChI=1S/C10H16N2O4/c1-10(2,3)7-5(8(13)12-16-7)4-6(11)9(14)15/h6H,4,11H2,1-3H3,(H,12,13)(H,14,15)/t6-/m1/s1
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1.80E+3n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by PDSP Ki Database




Eur J Pharmacol 411: 245-53 (2001)


Article DOI: 10.1016/s0014-2999(00)00916-x
BindingDB Entry DOI: 10.7270/Q2G73C8N
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)
BDBM85743
PNG
(CAS_5289517 | NSC_5289517 | Thio-ATPA | Thio-ATPA-...)
Show SMILES CC(C)(C)c1s[n-]c(=O)c1CC([NH3+])C(O)=O
Show InChI InChI=1S/C10H16N2O3S/c1-10(2,3)7-5(8(13)12-16-7)4-6(11)9(14)15/h6H,4,11H2,1-3H3,(H2,12,13,14,15)
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>1.00E+4n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by PDSP Ki Database




Eur J Pharmacol 411: 245-53 (2001)


Article DOI: 10.1016/s0014-2999(00)00916-x
BindingDB Entry DOI: 10.7270/Q2G73C8N
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, kainate 1


(RAT)
BDBM85743
PNG
(CAS_5289517 | NSC_5289517 | Thio-ATPA | Thio-ATPA-...)
Show SMILES CC(C)(C)c1s[n-]c(=O)c1CC([NH3+])C(O)=O
Show InChI InChI=1S/C10H16N2O3S/c1-10(2,3)7-5(8(13)12-16-7)4-6(11)9(14)15/h6H,4,11H2,1-3H3,(H2,12,13,14,15)
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>1.00E+4n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by PDSP Ki Database




Eur J Pharmacol 411: 245-53 (2001)


Article DOI: 10.1016/s0014-2999(00)00916-x
BindingDB Entry DOI: 10.7270/Q2G73C8N
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)
BDBM85741
PNG
(ATPA | CAS_140158-50-5 | NSC_2253)
Show SMILES CC(C)(C)c1o[nH]c(=O)c1CC(N)C(O)=O
Show InChI InChI=1S/C10H16N2O4/c1-10(2,3)7-5(8(13)12-16-7)4-6(11)9(14)15/h6H,4,11H2,1-3H3,(H,12,13)(H,14,15)
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>1.00E+4n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by PDSP Ki Database




Eur J Pharmacol 411: 245-53 (2001)


Article DOI: 10.1016/s0014-2999(00)00916-x
BindingDB Entry DOI: 10.7270/Q2G73C8N
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)
BDBM85744
PNG
(ATPA-S)
Show SMILES CC(C)(C)c1o[nH]c(=O)c1C[C@@H](N)C(O)=O |r|
Show InChI InChI=1S/C10H16N2O4/c1-10(2,3)7-5(8(13)12-16-7)4-6(11)9(14)15/h6H,4,11H2,1-3H3,(H,12,13)(H,14,15)/t6-/m1/s1
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>1.00E+4n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by PDSP Ki Database




Eur J Pharmacol 411: 245-53 (2001)


Article DOI: 10.1016/s0014-2999(00)00916-x
BindingDB Entry DOI: 10.7270/Q2G73C8N
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)
BDBM85743
PNG
(CAS_5289517 | NSC_5289517 | Thio-ATPA | Thio-ATPA-...)
Show SMILES CC(C)(C)c1s[n-]c(=O)c1CC([NH3+])C(O)=O
Show InChI InChI=1S/C10H16N2O3S/c1-10(2,3)7-5(8(13)12-16-7)4-6(11)9(14)15/h6H,4,11H2,1-3H3,(H2,12,13,14,15)
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>1.00E+4n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by PDSP Ki Database




Eur J Pharmacol 411: 245-53 (2001)


Article DOI: 10.1016/s0014-2999(00)00916-x
BindingDB Entry DOI: 10.7270/Q2G73C8N
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)
BDBM50002370
PNG
((R,S)-alpha-amino-3-hydroxy-5-methyl-4-isooxazole-...)
Show SMILES Cc1o[nH]c(=O)c1CC(N)C(O)=O
Show InChI InChI=1S/C7H10N2O4/c1-3-4(6(10)9-13-3)2-5(8)7(11)12/h5H,2,8H2,1H3,(H,9,10)(H,11,12)
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>1.00E+4n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by PDSP Ki Database




Eur J Pharmacol 411: 245-53 (2001)


Article DOI: 10.1016/s0014-2999(00)00916-x
BindingDB Entry DOI: 10.7270/Q2G73C8N
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, kainate 1


(RAT)
BDBM85744
PNG
(ATPA-S)
Show SMILES CC(C)(C)c1o[nH]c(=O)c1C[C@@H](N)C(O)=O |r|
Show InChI InChI=1S/C10H16N2O4/c1-10(2,3)7-5(8(13)12-16-7)4-6(11)9(14)15/h6H,4,11H2,1-3H3,(H,12,13)(H,14,15)/t6-/m1/s1
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>1.00E+4n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by PDSP Ki Database




Eur J Pharmacol 411: 245-53 (2001)


Article DOI: 10.1016/s0014-2999(00)00916-x
BindingDB Entry DOI: 10.7270/Q2G73C8N
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, kainate 1


(RAT)
BDBM85743
PNG
(CAS_5289517 | NSC_5289517 | Thio-ATPA | Thio-ATPA-...)
Show SMILES CC(C)(C)c1s[n-]c(=O)c1CC([NH3+])C(O)=O
Show InChI InChI=1S/C10H16N2O3S/c1-10(2,3)7-5(8(13)12-16-7)4-6(11)9(14)15/h6H,4,11H2,1-3H3,(H2,12,13,14,15)
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>1.00E+4n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by PDSP Ki Database




Eur J Pharmacol 411: 245-53 (2001)


Article DOI: 10.1016/s0014-2999(00)00916-x
BindingDB Entry DOI: 10.7270/Q2G73C8N
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, kainate 1


(RAT)
BDBM85743
PNG
(CAS_5289517 | NSC_5289517 | Thio-ATPA | Thio-ATPA-...)
Show SMILES CC(C)(C)c1s[n-]c(=O)c1CC([NH3+])C(O)=O
Show InChI InChI=1S/C10H16N2O3S/c1-10(2,3)7-5(8(13)12-16-7)4-6(11)9(14)15/h6H,4,11H2,1-3H3,(H2,12,13,14,15)
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>1.00E+4n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by PDSP Ki Database




Eur J Pharmacol 411: 245-53 (2001)


Article DOI: 10.1016/s0014-2999(00)00916-x
BindingDB Entry DOI: 10.7270/Q2G73C8N
More data for this
Ligand-Target Pair
Glutamate receptor 3


(RAT)
BDBM85741
PNG
(ATPA | CAS_140158-50-5 | NSC_2253)
Show SMILES CC(C)(C)c1o[nH]c(=O)c1CC(N)C(O)=O
Show InChI InChI=1S/C10H16N2O4/c1-10(2,3)7-5(8(13)12-16-7)4-6(11)9(14)15/h6H,4,11H2,1-3H3,(H,12,13)(H,14,15)
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>1.00E+4n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by PDSP Ki Database




Eur J Pharmacol 411: 245-53 (2001)


Article DOI: 10.1016/s0014-2999(00)00916-x
BindingDB Entry DOI: 10.7270/Q2G73C8N
More data for this
Ligand-Target Pair
Glutamate receptor 3


(RAT)
BDBM85742
PNG
(ATPA-R)
Show SMILES CC(C)(C)c1o[nH]c(=O)c1C[C@H](N)C(O)=O |r|
Show InChI InChI=1S/C10H16N2O4/c1-10(2,3)7-5(8(13)12-16-7)4-6(11)9(14)15/h6H,4,11H2,1-3H3,(H,12,13)(H,14,15)/t6-/m0/s1
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>1.00E+4n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by PDSP Ki Database




Eur J Pharmacol 411: 245-53 (2001)


Article DOI: 10.1016/s0014-2999(00)00916-x
BindingDB Entry DOI: 10.7270/Q2G73C8N
More data for this
Ligand-Target Pair
Glutamate receptor 3


(RAT)
BDBM85743
PNG
(CAS_5289517 | NSC_5289517 | Thio-ATPA | Thio-ATPA-...)
Show SMILES CC(C)(C)c1s[n-]c(=O)c1CC([NH3+])C(O)=O
Show InChI InChI=1S/C10H16N2O3S/c1-10(2,3)7-5(8(13)12-16-7)4-6(11)9(14)15/h6H,4,11H2,1-3H3,(H2,12,13,14,15)
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>1.00E+4n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by PDSP Ki Database




Eur J Pharmacol 411: 245-53 (2001)


Article DOI: 10.1016/s0014-2999(00)00916-x
BindingDB Entry DOI: 10.7270/Q2G73C8N
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)
BDBM85743
PNG
(CAS_5289517 | NSC_5289517 | Thio-ATPA | Thio-ATPA-...)
Show SMILES CC(C)(C)c1s[n-]c(=O)c1CC([NH3+])C(O)=O
Show InChI InChI=1S/C10H16N2O3S/c1-10(2,3)7-5(8(13)12-16-7)4-6(11)9(14)15/h6H,4,11H2,1-3H3,(H2,12,13,14,15)
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>1.00E+4n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by PDSP Ki Database




Eur J Pharmacol 411: 245-53 (2001)


Article DOI: 10.1016/s0014-2999(00)00916-x
BindingDB Entry DOI: 10.7270/Q2G73C8N
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, kainate 1


(RAT)
BDBM85741
PNG
(ATPA | CAS_140158-50-5 | NSC_2253)
Show SMILES CC(C)(C)c1o[nH]c(=O)c1CC(N)C(O)=O
Show InChI InChI=1S/C10H16N2O4/c1-10(2,3)7-5(8(13)12-16-7)4-6(11)9(14)15/h6H,4,11H2,1-3H3,(H,12,13)(H,14,15)
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>1.00E+4n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by PDSP Ki Database




Eur J Pharmacol 411: 245-53 (2001)


Article DOI: 10.1016/s0014-2999(00)00916-x
BindingDB Entry DOI: 10.7270/Q2G73C8N
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)
BDBM85742
PNG
(ATPA-R)
Show SMILES CC(C)(C)c1o[nH]c(=O)c1C[C@H](N)C(O)=O |r|
Show InChI InChI=1S/C10H16N2O4/c1-10(2,3)7-5(8(13)12-16-7)4-6(11)9(14)15/h6H,4,11H2,1-3H3,(H,12,13)(H,14,15)/t6-/m0/s1
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>1.00E+4n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by PDSP Ki Database




Eur J Pharmacol 411: 245-53 (2001)


Article DOI: 10.1016/s0014-2999(00)00916-x
BindingDB Entry DOI: 10.7270/Q2G73C8N
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, kainate 1


(RAT)
BDBM85742
PNG
(ATPA-R)
Show SMILES CC(C)(C)c1o[nH]c(=O)c1C[C@H](N)C(O)=O |r|
Show InChI InChI=1S/C10H16N2O4/c1-10(2,3)7-5(8(13)12-16-7)4-6(11)9(14)15/h6H,4,11H2,1-3H3,(H,12,13)(H,14,15)/t6-/m0/s1
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>1.00E+4n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by PDSP Ki Database




Eur J Pharmacol 411: 245-53 (2001)


Article DOI: 10.1016/s0014-2999(00)00916-x
BindingDB Entry DOI: 10.7270/Q2G73C8N
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, kainate 1


(RAT)
BDBM50002370
PNG
((R,S)-alpha-amino-3-hydroxy-5-methyl-4-isooxazole-...)
Show SMILES Cc1o[nH]c(=O)c1CC(N)C(O)=O
Show InChI InChI=1S/C7H10N2O4/c1-3-4(6(10)9-13-3)2-5(8)7(11)12/h5H,2,8H2,1H3,(H,9,10)(H,11,12)
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>1.00E+4n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by PDSP Ki Database




Eur J Pharmacol 411: 245-53 (2001)


Article DOI: 10.1016/s0014-2999(00)00916-x
BindingDB Entry DOI: 10.7270/Q2G73C8N
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%