BindingDB logo
myBDB logout

BDBM114966 5-hydroxy-2-methyl-3-benzo[g]benzofurancarboxylic acid ethyl ester::5-hydroxy-2-methyl-benzo[g]benzofuran-3-carboxylic acid ethyl ester::MLS000090329::SMR000024939::cid_678599::ethyl 2-methyl-5-oxidanyl-benzo[g][1]benzofuran-3-carboxylate::ethyl 5-hydroxy-2-methylbenzo[g][1]benzofuran-3-carboxylate::ethyl 5-hydroxy-2-methylnaphtho[1,2-b]furan-3-carboxylate

SMILES: CCOC(=O)c1c(C)oc2c1cc(O)c1ccccc21

InChI Key: InChIKey=NAYMIPUFIQUKOS-UHFFFAOYSA-N

Data: 1 EC50

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 = 114966   
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
Oxysterols receptor LXR-beta


(Homo sapiens (Human))
BDBM114966
PNG
(5-hydroxy-2-methyl-3-benzo[g]benzofurancarboxylic ...)
Show SMILES CCOC(=O)c1c(C)oc2c1cc(O)c1ccccc21
Show InChI InChI=1S/C16H14O4/c1-3-19-16(18)14-9(2)20-15-11-7-5-4-6-10(11)13(17)8-12(14)15/h4-8,17H,3H2,1-2H3
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a 6.75E+4n/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: UT Southwestern Assay Provider: David Mangelsdorf,...


PubChem Bioassay (2013)


BindingDB Entry DOI: 10.7270/Q2ZP44SP
More data for this
Ligand-Target Pair