Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Prostaglandin E synthase' and Ligand = 'BDBM50259028'   

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))	BDBM50259028 (CHEMBL4091339) Show SMILES O=C(Oc1ccc2C(=O)c3nc4nonc4nc3-c2c1)c1ccccc1 Show InChI InChI=1S/C18H8N4O4/c23-15-11-7-6-10(25-18(24)9-4-2-1-3-5-9)8-12(11)13-14(15)20-17-16(19-13)21-26-22-17/h1-8H	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Salerno Curated by ChEMBL					Assay Description Inhibition of mPGES-1 in microsomes isolated from IL-1beta-stimulated human A549 cells using PGH2 as substrate preincubated for 15 mins followed by s...				Eur J Med Chem 125: 278-287 (2017) Article DOI: 10.1016/j.ejmech.2016.09.042 BindingDB Entry DOI: 10.7270/Q2WM1GV8
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