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PubMed code 26912202

Compile data set for download or QSAR
Found 6 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 2B


(Rattus norvegicus (Rat))
BDBM50276976
PNG
(2-(4-benzylpiperidin-1-yl)-1-(5-hydroxy-1Hindol-3-...)
Show SMILES Oc1ccc2[nH]cc(C(=O)CN3CCC(Cc4ccccc4)CC3)c2c1
Show InChI InChI=1S/C22H24N2O2/c25-18-6-7-21-19(13-18)20(14-23-21)22(26)15-24-10-8-17(9-11-24)12-16-4-2-1-3-5-16/h1-7,13-14,17,23,25H,8-12,15H2
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PubMed
n/an/a 25n/an/an/an/an/an/a



Farmaceutiche ed Ambientali (CHIBIOFARAM) Universit£ degli Studi di Messina

Curated by ChEMBL


Assay Description
Displacement of [3H]ifenprodil from Sprague-Dawley rat cerebral cortex GluN2B receptor


Bioorg Med Chem 24: 1513-9 (2016)


Article DOI: 10.1016/j.bmc.2016.02.021
BindingDB Entry DOI: 10.7270/Q26M38P3
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 2B


(Rattus norvegicus (Rat))
BDBM50083351
PNG
((+/-)-[2-(4-benzylpiperidino)-1-(4-hydroxyphenyl)-...)
Show SMILES CC(C(O)c1ccc(O)cc1)N1CCC(Cc2ccccc2)CC1
Show InChI InChI=1S/C21H27NO2/c1-16(21(24)19-7-9-20(23)10-8-19)22-13-11-18(12-14-22)15-17-5-3-2-4-6-17/h2-10,16,18,21,23-24H,11-15H2,1H3
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Article
PubMed
n/an/a 47n/an/an/an/an/an/a



Farmaceutiche ed Ambientali (CHIBIOFARAM) Universit£ degli Studi di Messina

Curated by ChEMBL


Assay Description
Displacement of [3H]ifenprodil from Wistar rat cerebral cortex GluN2B receptor after 120 mins


Bioorg Med Chem 24: 1513-9 (2016)


Article DOI: 10.1016/j.bmc.2016.02.021
BindingDB Entry DOI: 10.7270/Q26M38P3
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Glutamate receptor ionotropic, NMDA 2B


(Rattus norvegicus (Rat))
BDBM50148148
PNG
(CHEMBL3765265)
Show SMILES CCc1ccc(CC2CCN(CC(=O)c3c[nH]c4ccc(O)cc34)CC2)cc1
Show InChI InChI=1S/C24H28N2O2/c1-2-17-3-5-18(6-4-17)13-19-9-11-26(12-10-19)16-24(28)22-15-25-23-8-7-20(27)14-21(22)23/h3-8,14-15,19,25,27H,2,9-13,16H2,1H3
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n/an/a 71n/an/an/an/an/an/a



Farmaceutiche ed Ambientali (CHIBIOFARAM) Universit£ degli Studi di Messina

Curated by ChEMBL


Assay Description
Displacement of [3H]ifenprodil from Wistar rat cerebral cortex GluN2B receptor after 120 mins


Bioorg Med Chem 24: 1513-9 (2016)


Article DOI: 10.1016/j.bmc.2016.02.021
BindingDB Entry DOI: 10.7270/Q26M38P3
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 2B


(Rattus norvegicus (Rat))
BDBM50148147
PNG
(CHEMBL3764294)
Show SMILES Cc1ccc(CC2CCN(CC(=O)c3c[nH]c4ccc(O)cc34)CC2)cc1
Show InChI InChI=1S/C23H26N2O2/c1-16-2-4-17(5-3-16)12-18-8-10-25(11-9-18)15-23(27)21-14-24-22-7-6-19(26)13-20(21)22/h2-7,13-14,18,24,26H,8-12,15H2,1H3
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n/an/a 83n/an/an/an/an/an/a



Farmaceutiche ed Ambientali (CHIBIOFARAM) Universit£ degli Studi di Messina

Curated by ChEMBL


Assay Description
Displacement of [3H]ifenprodil from Wistar rat cerebral cortex GluN2B receptor after 120 mins


Bioorg Med Chem 24: 1513-9 (2016)


Article DOI: 10.1016/j.bmc.2016.02.021
BindingDB Entry DOI: 10.7270/Q26M38P3
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 2B


(Rattus norvegicus (Rat))
BDBM50148149
PNG
(CHEMBL3764487)
Show SMILES COc1ccc(CC2CCN(CC(=O)c3c[nH]c4ccc(O)cc34)CC2)cc1
Show InChI InChI=1S/C23H26N2O3/c1-28-19-5-2-16(3-6-19)12-17-8-10-25(11-9-17)15-23(27)21-14-24-22-7-4-18(26)13-20(21)22/h2-7,13-14,17,24,26H,8-12,15H2,1H3
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n/an/a 1.28E+3n/an/an/an/an/an/a



Farmaceutiche ed Ambientali (CHIBIOFARAM) Universit£ degli Studi di Messina

Curated by ChEMBL


Assay Description
Displacement of [3H]ifenprodil from Wistar rat cerebral cortex GluN2B receptor after 120 mins


Bioorg Med Chem 24: 1513-9 (2016)


Article DOI: 10.1016/j.bmc.2016.02.021
BindingDB Entry DOI: 10.7270/Q26M38P3
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 2B


(Rattus norvegicus (Rat))
BDBM50148150
PNG
(CHEMBL3763487)
Show SMILES Cc1ccc(CC2CCN(CC(=O)c3c[nH]c4ccc(O)cc34)CC2)cc1C
Show InChI InChI=1S/C24H28N2O2/c1-16-3-4-19(11-17(16)2)12-18-7-9-26(10-8-18)15-24(28)22-14-25-23-6-5-20(27)13-21(22)23/h3-6,11,13-14,18,25,27H,7-10,12,15H2,1-2H3
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n/an/a 3.33E+3n/an/an/an/an/an/a



Farmaceutiche ed Ambientali (CHIBIOFARAM) Universit£ degli Studi di Messina

Curated by ChEMBL


Assay Description
Displacement of [3H]ifenprodil from Wistar rat cerebral cortex GluN2B receptor after 120 mins


Bioorg Med Chem 24: 1513-9 (2016)


Article DOI: 10.1016/j.bmc.2016.02.021
BindingDB Entry DOI: 10.7270/Q26M38P3
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%