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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Toll-like receptor 7' and Ligand = 'BDBM50236149'   
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 7


(Homo sapiens (Human))
BDBM50236149
PNG
(CHEMBL4093530)
Show SMILES CCCCNc1nc(N)nc(C)c1CCCn1c(C)nc2ccccc12
Show InChI InChI=1S/C20H28N6/c1-4-5-12-22-19-16(14(2)23-20(21)25-19)9-8-13-26-15(3)24-17-10-6-7-11-18(17)26/h6-7,10-11H,4-5,8-9,12-13H2,1-3H3,(H3,21,22,23,25)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 379n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at human TLR7 expressed in HEK293 cells co-expressing secreted alkaline phosphatase assessed as induction of NF-kappaB/AP-1 promoter...


J Med Chem 60: 2084-2098 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01860
BindingDB Entry DOI: 10.7270/Q27083QG
More data for this
Ligand-Target Pair