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BDBM50267948 CHEMBL4097333

SMILES: Nc1ccc(cc1)C1=NN(C2CC(Br)=NO2)C(=O)Cc2cc3OCCOc3cc12

InChI Key: InChIKey=WXZDBSUEQSNNNB-UHFFFAOYSA-N

Data: 2 KI

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 2 hits for monomerid = 50267948   
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 AMPA 2/3


(Homo sapiens (Human))
BDBM50267948
PNG
(CHEMBL4097333)
Show SMILES Nc1ccc(cc1)C1=NN(C2CC(Br)=NO2)C(=O)Cc2cc3OCCOc3cc12 |c:14,t:8|
Show InChI InChI=1S/C20H17BrN4O4/c21-17-10-19(29-24-17)25-18(26)8-12-7-15-16(28-6-5-27-15)9-14(12)20(23-25)11-1-3-13(22)4-2-11/h1-4,7,9,19H,5-6,8,10,22H2
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
3.00E+3n/an/an/an/an/an/an/an/a



Department of Chemical, Biological, Pharmaceutical and Environmental Sciences, University of Messina, Viale Annunziata, 98168 Messina, Italy.

Curated by ChEMBL


Assay Description
Antagonist activity at closed state of GluA2Qflip isoform (unknown origin) expressed in HEK293 cells assessed as reduction in glutamate-induced curre...


Bioorg Med Chem 25: 3631-3637 (2017)


Article DOI: 10.1016/j.bmc.2017.05.036
BindingDB Entry DOI: 10.7270/Q2TF00T9
More data for this
Ligand-Target Pair
Glutamate receptor AMPA 2/3


(Homo sapiens (Human))
BDBM50267948
PNG
(CHEMBL4097333)
Show SMILES Nc1ccc(cc1)C1=NN(C2CC(Br)=NO2)C(=O)Cc2cc3OCCOc3cc12 |c:14,t:8|
Show InChI InChI=1S/C20H17BrN4O4/c21-17-10-19(29-24-17)25-18(26)8-12-7-15-16(28-6-5-27-15)9-14(12)20(23-25)11-1-3-13(22)4-2-11/h1-4,7,9,19H,5-6,8,10,22H2
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
1.40E+4n/an/an/an/an/an/an/an/a



Department of Chemical, Biological, Pharmaceutical and Environmental Sciences, University of Messina, Viale Annunziata, 98168 Messina, Italy.

Curated by ChEMBL


Assay Description
Antagonist activity at open state of GluA2Qflip isoform (unknown origin) expressed in HEK293 cells assessed as reduction in glutamate-induced current...


Bioorg Med Chem 25: 3631-3637 (2017)


Article DOI: 10.1016/j.bmc.2017.05.036
BindingDB Entry DOI: 10.7270/Q2TF00T9
More data for this
Ligand-Target Pair