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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Toll-like receptor 8' and Ligand = 'BDBM50514799'   
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
Toll-like receptor 8


(Homo sapiens (Human))
BDBM50514799
PNG
(CHEMBL4445770)
Show SMILES CSc1nnc(CCO)n1-c1ccc(Cl)cc1Cl |(15.33,-12.38,;14.19,-13.42,;12.72,-12.95,;12.24,-11.48,;10.7,-11.49,;10.23,-12.96,;8.77,-13.44,;7.62,-12.42,;6.16,-12.9,;11.48,-13.86,;11.49,-15.4,;12.82,-16.16,;12.83,-17.7,;11.5,-18.48,;11.51,-20.02,;10.16,-17.71,;10.16,-16.17,;8.82,-15.41,)|
Show InChI InChI=1S/C11H11Cl2N3OS/c1-18-11-15-14-10(4-5-17)16(11)9-3-2-7(12)6-8(9)13/h2-3,6,17H,4-5H2,1H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 590n/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
BindingDB Entry DOI: 10.7270/Q2NV9NMG
More data for this
Ligand-Target Pair