BDBM50109822 CHEMBL1288945

SMILES: Fc1cccc(Cl)c1-c1cnc([nH]1)-c1ccc(Br)cc1

InChI Key: InChIKey=QJJUMTXOSQZNMB-UHFFFAOYSA-N

Data: 1 IC50

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 = 50109822   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Prostaglandin E synthase (Homo sapiens (Human))	BDBM50109822 (CHEMBL1288945) Show SMILES Fc1cccc(Cl)c1-c1cnc([nH]1)-c1ccc(Br)cc1 Show InChI InChI=1S/C15H9BrClFN2/c16-10-6-4-9(5-7-10)15-19-8-13(20-15)14-11(17)2-1-3-12(14)18/h1-8H,(H,19,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	3.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Innsbruck Curated by ChEMBL					Assay Description Inhibition of mPGES-1 in IL-1beta-stimulated human A549 cell microsomal membranes assessed as reduction in PGE2 formation incubated for 15 mins using...				Bioorg Med Chem 23: 4839-45 (2015) BindingDB Entry DOI: 10.7270/Q2M90BF8
					More data for this Ligand-Target Pair