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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Nuclear factor erythroid 2-related factor 2' and Ligand = 'BDBM50508499'   
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
Nuclear factor erythroid 2-related factor 2


(Homo sapiens (Human))
BDBM50508499
PNG
(CHEMBL4587100)
Show SMILES O=C(CCc1ccccc1)NCCCCN=C=S
Show InChI InChI=1S/C14H18N2OS/c17-14(16-11-5-4-10-15-12-18)9-8-13-6-2-1-3-7-13/h1-3,6-7H,4-5,8-11H2,(H,16,17)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.51E+4n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Binding affinity to FLAG/His-tagged Keap1 (unknown origin)/biotinylated full-length FLAG/His/Tev/Avi-tagged NRF2 (unknown origin) expressed in baculo...


Bioorg Med Chem 27: 579-588 (2019)


Article DOI: 10.1016/j.bmc.2018.12.026
BindingDB Entry DOI: 10.7270/Q2GF0XSX
More data for this
Ligand-Target Pair