Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Prostaglandin G/H synthase 1' and Ligand = 'BDBM50090628'   

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 1 (Homo sapiens (Human))	BDBM50090628 (3-(4-Fluoro-phenyl)-4-(4-methanesulfonyl-phenyl)-1...) Show SMILES CS(=O)(=O)c1ccc(cc1)C1=C(C(=O)N(C1)c1ccc(cc1)C(F)(F)F)c1ccc(F)cc1 |t:11| Show InChI InChI=1S/C24H17F4NO3S/c1-33(31,32)20-12-4-15(5-13-20)21-14-29(19-10-6-17(7-11-19)24(26,27)28)23(30)22(21)16-2-8-18(25)9-3-16/h2-13H,14H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	7.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Barcelona Curated by ChEMBL					Assay Description Biochemical index for Prostaglandin G/H synthase 1 measured as, tromboxane 2 (TXB2) levels following blood coagulation				Bioorg Med Chem Lett 10: 1745-8 (2000) BindingDB Entry DOI: 10.7270/Q2ZG6RH7
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