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BDBM95459 1,2-bis(3,4-dihydroxyphenyl)ethane-1,2-dione::1,2-bis[3,4-bis(oxidanyl)phenyl]ethane-1,2-dione::MLS002608408::SMR001527157::cid_238232

SMILES: Oc1ccc(cc1O)C(=O)C(=O)c1ccc(O)c(O)c1

InChI Key: InChIKey=SBUXQLGVTMAJSE-UHFFFAOYSA-N

Data: 1 IC50

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 1 hit for monomerid = 95459   
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
MSRA protein


(Bos taurus)
BDBM95459
PNG
(1,2-bis(3,4-dihydroxyphenyl)ethane-1,2-dione | 1,2...)
Show SMILES Oc1ccc(cc1O)C(=O)C(=O)c1ccc(O)c(O)c1
Show InChI InChI=1S/C14H10O6/c15-9-3-1-7(5-11(9)17)13(19)14(20)8-2-4-10(16)12(18)6-8/h1-6,15-18H
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
n/an/a 1.12E+5n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2013)


BindingDB Entry DOI: 10.7270/Q2639NCQ
More data for this
Ligand-Target Pair