BDBM50512039 CHEMBL4441218

SMILES CCOc1ccc(cc1)-c1cc(nn1-c1ccc(cc1)S(N)(=O)=O)C(=O)OCCN1CCOCC1

InChI Key InChIKey=QZLYORBDDDBZHV-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 = 50512039   

TargetPolyunsaturated fatty acid 5-lipoxygenase(Rat)
Nanjing University

Curated by ChEMBL
LigandPNGBDBM50512039(CHEMBL4441218)
Affinity DataIC50: 790nMAssay Description:Inhibition of Sprague-Dawley rat 5-LOX assessed as calcium ionophore A23187-stimulated LTB4 production preincubated for 30 mins followed by calcium i...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/20/2021
Entry Details Article
PubMed
TargetProstaglandin G/H synthase 2(Human)
Nanjing University

Curated by ChEMBL
LigandPNGBDBM50512039(CHEMBL4441218)
Affinity DataIC50: 1.11E+3nMAssay Description:Inhibition of COX2 (unknown origin) using arachidonic acid as substrate incubated for 10 mins by Ellman's reagent based COX-1/COX-2 ELISA assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/20/2021
Entry Details Article
PubMed