Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Prostaglandin E synthase' and Ligand = 'BDBM50028855'   

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))	BDBM50028855 (CHEMBL3342694) Show SMILES FC(F)(F)c1ccc(NC(=O)c2cccc(NC(=O)c3ccccc3C(F)(F)F)c2)nc1 Show InChI InChI=1S/C21H13F6N3O2/c22-20(23,24)13-8-9-17(28-11-13)30-18(31)12-4-3-5-14(10-12)29-19(32)15-6-1-2-7-16(15)21(25,26)27/h1-11H,(H,29,32)(H,28,30,31)	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	49	n/a	n/a	n/a	n/a	n/a	n/a
Glenmark Pharmaceuticals Limited Curated by ChEMBL					Assay Description Inhibition of human mPGES-1 using PGH2 as substrate by RP-HPLC analysis				Bioorg Med Chem Lett 24: 4838-44 (2014) Article DOI: 10.1016/j.bmcl.2014.08.056 BindingDB Entry DOI: 10.7270/Q2X068MN
					More data for this Ligand-Target Pair
Prostaglandin E synthase (Homo sapiens (Human))	BDBM50028855 (CHEMBL3342694) Show SMILES FC(F)(F)c1ccc(NC(=O)c2cccc(NC(=O)c3ccccc3C(F)(F)F)c2)nc1 Show InChI InChI=1S/C21H13F6N3O2/c22-20(23,24)13-8-9-17(28-11-13)30-18(31)12-4-3-5-14(10-12)29-19(32)15-6-1-2-7-16(15)21(25,26)27/h1-11H,(H,29,32)(H,28,30,31)	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	500	n/a	n/a	n/a	n/a	n/a	n/a
Glenmark Pharmaceuticals Limited Curated by ChEMBL					Assay Description Inhibition of human recombinant mPGES-1 expressed in CHO cells using PGH2 as substrate incubated for 10 mins prior to substrate addition measured aft...				Bioorg Med Chem Lett 24: 4838-44 (2014) Article DOI: 10.1016/j.bmcl.2014.08.056 BindingDB Entry DOI: 10.7270/Q2X068MN
					More data for this Ligand-Target Pair