Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Prostaglandin G/H synthase 2' and Ligand = 'BDBM50084350'   

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 G/H synthase 2 (Homo sapiens (Human))	BDBM50084350 (4-(5-Methyl-2-oxo-3-m-tolyl-2,3-dihydro-oxazol-4-y...) Show SMILES Cc1oc(=O)n(c1-c1ccc(cc1)S(N)(=O)=O)-c1cccc(C)c1 Show InChI InChI=1S/C17H16N2O4S/c1-11-4-3-5-14(10-11)19-16(12(2)23-17(19)20)13-6-8-15(9-7-13)24(18,21)22/h3-10H,1-2H3,(H2,18,21,22)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	929	n/a	n/a	n/a	n/a	n/a	n/a
Jadavpur University Curated by ChEMBL					Assay Description Binding affinity towards Prostaglandin G/H synthase 2				Bioorg Med Chem Lett 13: 3753-7 (2003) BindingDB Entry DOI: 10.7270/Q2JM2BS0
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 2 (Homo sapiens (Human))	BDBM50084350 (4-(5-Methyl-2-oxo-3-m-tolyl-2,3-dihydro-oxazol-4-y...) Show SMILES Cc1oc(=O)n(c1-c1ccc(cc1)S(N)(=O)=O)-c1cccc(C)c1 Show InChI InChI=1S/C17H16N2O4S/c1-11-4-3-5-14(10-11)19-16(12(2)23-17(19)20)13-6-8-15(9-7-13)24(18,21)22/h3-10H,1-2H3,(H2,18,21,22)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	930	n/a	n/a	n/a	n/a	n/a	n/a
Rhône-Poulenc Rorer Curated by ChEMBL					Assay Description Inhibitory activity against prostaglandin G/H synthase 2				J Med Chem 43: 214-23 (2000) BindingDB Entry DOI: 10.7270/Q2DV1KK0
					More data for this Ligand-Target Pair