Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 416.4 BDBM50424306

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Prostaglandin E synthase (Homo sapiens (Human))	BDBM50424306 (CHEMBL2314485) Show SMILES OC(=O)c1nnn(CCN(c2ccccc2)S(=O)(=O)c2ccccc2)c1C(O)=O Show InChI InChI=1S/C18H16N4O6S/c23-17(24)15-16(18(25)26)21(20-19-15)11-12-22(13-7-3-1-4-8-13)29(27,28)14-9-5-2-6-10-14/h1-10H,11-12H2,(H,23,24)(H,25,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Kyung Hee University Curated by ChEMBL					Assay Description Inhibition of mPGES1 (unknown origin) using PGH2 as substrate incubated for 30 mins prior to substrate addition by PGH2-coupled spectrophotometric an...				Bioorg Med Chem Lett 23: 75-80 (2012) Article DOI: 10.1016/j.bmcl.2012.11.019 BindingDB Entry DOI: 10.7270/Q2DB8359
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