BindingDB logo
myBDB logout

null

SMILES: [H][C@@]12C[C@H](C[C@]1([H])CN(CC(O)c1ccc(O)cn1)C2)Oc1ccc(F)cc1F

InChI Key: InChIKey=AKEUOXXGTLYITE-UHAQGQOPSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 370781   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Glutamate receptor ionotropic, NMDA 1/2B


(Homo sapiens (Human))
BDBM370781
PNG
(US10239835, Example 00333)
Show SMILES [H][C@@]12C[C@H](C[C@]1([H])CN(CC(O)c1ccc(O)cn1)C2)Oc1ccc(F)cc1F |r,w:10.11|
Show InChI InChI=1S/C20H22F2N2O3/c21-14-1-4-20(17(22)7-14)27-16-5-12-9-24(10-13(12)6-16)11-19(26)18-3-2-15(25)8-23-18/h1-4,7-8,12-13,16,19,25-26H,5-6,9-11H2/t12-,13+,16+,19?
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 6.81n/an/an/an/an/an/a



Bayer HealthCare Pharmaceuticals Corporation



Assay Description
Cell Culture and plating: HEK293 cells expressing NR1/NR2B (Chantest, Cleveland, Ohio) were grown to 70-80% confluency as an adherent monolayer in st...


J Med Chem 50: 984-1000 (2007)


BindingDB Entry DOI: 10.7270/Q2F19207
More data for this
Ligand-Target Pair