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BDBM50391695 CHEMBL2148187

SMILES: COC(=O)\C=C\c1ccccc1[N+]([O-])=O

InChI Key: InChIKey=VKKNUVQQEHKTCG-VOTSOKGWSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50391695   
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
Toll-like receptor 4/MD-2/CD14


(Mus musculus)
BDBM50391695
PNG
(CHEMBL2148187)
Show SMILES COC(=O)\C=C\c1ccccc1[N+]([O-])=O
Show InChI InChI=1S/C10H9NO4/c1-15-10(12)7-6-8-4-2-3-5-9(8)11(13)14/h2-7H,1H3/b7-6+
PDB
MMDB

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PC cid
PC sid
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Similars

Article
PubMed
n/an/a 4.53E+3n/an/an/an/an/an/a



University of Colorado at Boulder

Curated by ChEMBL


Assay Description
Inhibition of TLR4 in LPS-stimulated mouse RAW264.7 cells assessed as reduction of NO production after 24 hrs


Bioorg Med Chem 20: 6073-9 (2012)


Article DOI: 10.1016/j.bmc.2012.08.022
BindingDB Entry DOI: 10.7270/Q2S75HDN
More data for this
Ligand-Target Pair