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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Glutamate receptor ionotropic, NMDA 2B' and Ligand = 'BDBM50037707'   
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


(Homo sapiens (Human))
BDBM50037707
PNG
(CHEMBL3357792)
Show SMILES C1C[C@@H](CC[C@H]1NC1CCc2ccccc2CC1)c1ccccc1 |r,wU:5.6,wD:2.20,(12.23,-10.22,;13,-11.55,;12.25,-12.88,;10.71,-12.89,;9.94,-11.57,;10.7,-10.23,;9.92,-8.91,;8.37,-8.93,;7.72,-10.34,;6.2,-10.7,;4.96,-9.73,;3.62,-10.52,;2.28,-9.74,;2.28,-8.19,;3.62,-7.42,;4.95,-8.18,;6.17,-7.2,;7.69,-7.53,;13.01,-14.21,;12.25,-15.54,;13.02,-16.86,;14.55,-16.85,;15.32,-15.51,;14.54,-14.2,)|
Show InChI InChI=1/C23H29N/c1-2-6-18(7-3-1)21-12-16-23(17-13-21)24-22-14-10-19-8-4-5-9-20(19)11-15-22/h1-9,21-24H,10-17H2/t21-,23-
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
5.70n/an/an/an/an/an/an/an/a



Institut f£r Pharmazeutische und Medizinische Chemie der Universit£t M£nster

Curated by ChEMBL


Assay Description
Displacement of [3H]ifenprodil from human GluN2B expressed in mouse L(tk-) cells co-expressing GluN1a after 120 mins by scintillation counting method


Bioorg Med Chem 22: 6638-46 (2015)


Article DOI: 10.1016/j.bmc.2014.10.004
BindingDB Entry DOI: 10.7270/Q2ZW1NH7
More data for this
Ligand-Target Pair