Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Prostaglandin G/H synthase 1' and Ligand = 'BDBM50206929'   

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))	BDBM50206929 (2-{4-[4-chloro-1-(4-(methylsulfonyl)phenyl)-1H-imi...) Show SMILES CS(=O)(=O)c1ccc(cc1)-n1cnc(Cl)c1-c1ccc(OCCO[N+]([O-])=O)c(F)c1 Show InChI InChI=1S/C18H15ClFN3O6S/c1-30(26,27)14-5-3-13(4-6-14)22-11-21-18(19)17(22)12-2-7-16(15(20)10-12)28-8-9-29-23(24)25/h2-7,10-11H,8-9H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Università degli Studi di Torino Curated by ChEMBL					Assay Description Inhibition of COX1 in human whole blood assessed as TxB2 production after 1 hr				J Med Chem 50: 1449-57 (2007) Article DOI: 10.1021/jm0607247 BindingDB Entry DOI: 10.7270/Q2Q23ZW6
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