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BDBM50514814 CHEMBL4437700

SMILES: CSc1nnc(CCCO)n1-c1c(Cl)cc(Cl)cc1Cl

InChI Key: InChIKey=BIOJADAIUCQBKC-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50514814   
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 8


(Homo sapiens (Human))		BDBM50514814
PNG
(CHEMBL4437700)
Show SMILES CSc1nnc(CCCO)n1-c1c(Cl)cc(Cl)cc1Cl |(25.82,-26.98,;25.2,-28.39,;26.1,-29.63,;27.64,-29.63,;28.12,-31.1,;26.87,-32,;26.87,-33.54,;28.21,-34.31,;29.54,-33.54,;30.87,-34.31,;25.63,-31.1,;24.16,-31.57,;23.02,-30.54,;23.34,-29.04,;21.55,-31.02,;21.23,-32.53,;19.77,-33,;22.38,-33.56,;23.84,-33.08,;24.99,-34.11,)|
Show InChI InChI=1S/C12H12Cl3N3OS/c1-20-12-17-16-10(3-2-4-19)18(12)11-8(14)5-7(13)6-9(11)15/h5-6,19H,2-4H2,1H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.81E+3n/an/an/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Inhibition of human TLR8 expressed in HEK-Blue cells assessed as inhibition of R848-induced NF-kappaB activation measured after 24 hrs by quanti-blue...

J Med Chem 63: 4117-4132 (2020)


Article DOI: 10.1021/acs.jmedchem.9b02128
More data for this
Ligand-Target Pair