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SMILES: COc1cc(OC)c2cc3c(nc(=S)[nH]c3=O)oc2c1

InChI Key: InChIKey=FZYGAYXYTXHBRG-UHFFFAOYSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 367250   
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
Nuclear factor NF-kappa-B p105 subunit


(Homo sapiens (Human))
BDBM367250
PNG
(US10226464, Compound 18)
Show SMILES COc1cc(OC)c2cc3c(nc(=S)[nH]c3=O)oc2c1
Show InChI InChI=1S/C13H10N2O4S/c1-17-6-3-9(18-2)7-5-8-11(16)14-13(20)15-12(8)19-10(7)4-6/h3-5H,1-2H3,(H,14,16,20)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 1.00E+4n/an/an/an/an/an/a



Amgen



Assay Description
NFκB/Jurkat/GFP transcriptional reporter cell line was obtained from SBI System Biosciences. NF-κB/Jurkat/GFP™ Reporter cells (5×105 cells)...


Bioorg Med Chem Lett 17: 5384-9 (2007)


BindingDB Entry DOI: 10.7270/Q2028TVG
More data for this
Ligand-Target Pair
Nuclear factor NF-kappa-B p105 subunit


(Homo sapiens (Human))
BDBM367250
PNG
(US10226464, Compound 18)
Show SMILES COc1cc(OC)c2cc3c(nc(=S)[nH]c3=O)oc2c1
Show InChI InChI=1S/C13H10N2O4S/c1-17-6-3-9(18-2)7-5-8-11(16)14-13(20)15-12(8)19-10(7)4-6/h3-5H,1-2H3,(H,14,16,20)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<500n/an/an/an/an/an/a



Amgen



Assay Description
DNA binding reaction (20 μL) was carried out in 1×DNA Binding Buffer (10 mM Tris, 40 mM NaCl, 1 mM EDTA, 4% glycerol) with 10 nM c-Rel protein a...


Bioorg Med Chem Lett 17: 5384-9 (2007)


BindingDB Entry DOI: 10.7270/Q2028TVG
More data for this
Ligand-Target Pair