Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Prostaglandin E synthase' and Ligand = 'BDBM50337635'   

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))	BDBM50337635 (1-benzyl-1-(biphenyl-3-ylmethyl)-3-isopropylurea |...) Show SMILES CC(C)NC(=O)N(Cc1ccccc1)Cc1cccc(c1)-c1ccccc1 Show InChI InChI=1S/C24H26N2O/c1-19(2)25-24(27)26(17-20-10-5-3-6-11-20)18-21-12-9-15-23(16-21)22-13-7-4-8-14-22/h3-16,19H,17-18H2,1-2H3,(H,25,27)	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	1.70E+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) Article DOI: 10.1016/j.bmc.2015.05.045 BindingDB Entry DOI: 10.7270/Q2M90BF8
					More data for this Ligand-Target Pair
Prostaglandin E synthase (Homo sapiens (Human))	BDBM50337635 (1-benzyl-1-(biphenyl-3-ylmethyl)-3-isopropylurea |...) Show SMILES CC(C)NC(=O)N(Cc1ccccc1)Cc1cccc(c1)-c1ccccc1 Show InChI InChI=1S/C24H26N2O/c1-19(2)25-24(27)26(17-20-10-5-3-6-11-20)18-21-12-9-15-23(16-21)22-13-7-4-8-14-22/h3-16,19H,17-18H2,1-2H3,(H,25,27)	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	1.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Merck Frosst Center for Therapeutic Research Curated by ChEMBL					Assay Description Inhibition of mPGES1				Bioorg Med Chem Lett 21: 1488-92 (2011) Article DOI: 10.1016/j.bmcl.2011.01.006 BindingDB Entry DOI: 10.7270/Q2XS5VNP
					More data for this Ligand-Target Pair
Prostaglandin E synthase (Homo sapiens (Human))	BDBM50337635 (1-benzyl-1-(biphenyl-3-ylmethyl)-3-isopropylurea |...) Show SMILES CC(C)NC(=O)N(Cc1ccccc1)Cc1cccc(c1)-c1ccccc1 Show InChI InChI=1S/C24H26N2O/c1-19(2)25-24(27)26(17-20-10-5-3-6-11-20)18-21-12-9-15-23(16-21)22-13-7-4-8-14-22/h3-16,19H,17-18H2,1-2H3,(H,25,27)	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	1.19E+4	n/a	n/a	n/a	n/a	n/a	n/a
Merck Frosst Center for Therapeutic Research Curated by ChEMBL					Assay Description Inhibition of mPGES1 in IL-1beta treated human A549 cell microsome assessed as inhibition of PGE2 production after 1 min in presence of 50% FBS				Bioorg Med Chem Lett 21: 1488-92 (2011) Article DOI: 10.1016/j.bmcl.2011.01.006 BindingDB Entry DOI: 10.7270/Q2XS5VNP
					More data for this Ligand-Target Pair