BDBM50052458 3-(4,5-Dihydroxy-10-oxo-9,10-dihydro-anthracen-9-ylsulfanyl)-propionic acid methyl ester::CHEMBL110668

SMILES COC(=O)CCSC1c2cccc(O)c2C(=O)c2c(O)cccc12

InChI Key InChIKey=SBGBTBSEHNMJTE-UHFFFAOYSA-N

Data  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50052458   

TargetPolyunsaturated fatty acid lipoxygenase ALOX12(Mouse)
UniversitäT Regensburg

Curated by ChEMBL
LigandPNGBDBM50052458(3-(4,5-Dihydroxy-10-oxo-9,10-dihydro-anthracen-9-y...)
Affinity DataIC50: 2.70E+4nMAssay Description:Tested for inhibition of 12-LO (12-lipoxygenase) as an inhibitor of 12(S)-HETE biosynthesis in mouse epidermal homogenatesMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
Target5-lipoxygenase(Bovine)
UniversitäT Regensburg

Curated by ChEMBL
LigandPNGBDBM50052458(3-(4,5-Dihydroxy-10-oxo-9,10-dihydro-anthracen-9-y...)
Affinity DataIC50: 1.50E+4nMAssay Description:Tested for inhibition of 5-lipoxygenase as inhibition of 5-HETE and LTB4 biosynthesis in bovine PMNLMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed