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BDBM50204913 2-(2,6-dihydroxybenzoyl)-3-hydroxy-5-methylbenzoic acid::CHEMBL373394

SMILES: Cc1cc(O)c(C(=O)c2c(O)cccc2O)c(c1)C(O)=O

InChI Key: InChIKey=UMNWQJSVQOCNEM-UHFFFAOYSA-N

Data: 1 IC50

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Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50204913   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Quinone oxidoreductase


(Mus musculus)
BDBM50204913
PNG
(2-(2,6-dihydroxybenzoyl)-3-hydroxy-5-methylbenzoic...)
Show SMILES Cc1cc(O)c(C(=O)c2c(O)cccc2O)c(c1)C(O)=O
Show InChI InChI=1S/C15H12O6/c1-7-5-8(15(20)21)12(11(18)6-7)14(19)13-9(16)3-2-4-10(13)17/h2-6,16-18H,1H3,(H,20,21)
KEGG

UniProtKB/SwissProt

GoogleScholar
CHEBI
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>5.00E+4n/an/an/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Induction of NAD(P)H:quinone reductase in mouse Hepa 1c1c7 cells


J Nat Prod 70: 353-60 (2007)


Article DOI: 10.1021/np060505o
BindingDB Entry DOI: 10.7270/Q2930STQ
More data for this
Ligand-Target Pair