BDBM50664902 CHEMBL6171680

SMILES Clc1ccc(-c2nnc(CN3CCN(C(c4ccccc4)c4ccc(Cl)cc4)CC3)o2)cc1

InChI Key InChIKey=LRUXPRYGFBWINI-UHFFFAOYSA-N

Data  1 KI  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50664902   

TargetProstaglandin G/H synthase 2(Human)
India Institute of Technology (Banaras Hindu University)

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50664902BDBM50664902(CHEMBL6171680)
Affinity DataKi:  220nMAssay Description:Competitive inhibition of COX-2 (unknown origin) using arachidonic acid as substrateMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/6/2026
Entry Details
PubMed
TargetProstaglandin G/H synthase 2(Sheep)
India Institute of Technology (Banaras Hindu University)

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50664902BDBM50664902(CHEMBL6171680)
Affinity DataIC50: 250nMAssay Description:Inhibition of recombinant ovine COX-2 using arachidonic acid as substrate in presence of hemin by TMPD reagent-based colorimetryMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/6/2026
Entry Details
PubMed
TargetPolyunsaturated fatty acid 5-lipoxygenase(Human)
India Institute of Technology (Banaras Hindu University)

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50664902BDBM50664902(CHEMBL6171680)
Affinity DataIC50: 7.87E+3nMAssay Description:Inhibition of 5-LOX (unknown origin) using arachidonic acid as substrate preincubated for 5 mins followed by substrate addition measured after 10 min...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/6/2026
Entry Details
PubMed
TargetProstaglandin G/H synthase 1(Sheep)
India Institute of Technology (Banaras Hindu University)

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50664902BDBM50664902(CHEMBL6171680)
Affinity DataIC50: 3.41E+4nMAssay Description:Inhibition of ovine COX-1 using arachidonic acid as substrate in presence of hemin by TMPD reagent-based colorimetryMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/6/2026
Entry Details
PubMed