Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Prostaglandin G/H synthase 2' and Ligand = 'BDBM50522765'   

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))	BDBM50522765 (CHEMBL4448997) Show SMILES Brc1ccc(cc1)C(=O)\C=C\C1=Cc2ccccc2OC1 |t:12| Show InChI InChI=1S/C18H13BrO2/c19-16-8-6-14(7-9-16)17(20)10-5-13-11-15-3-1-2-4-18(15)21-12-13/h1-11H,12H2/b10-5+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	420	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang Ocean University Curated by ChEMBL					Assay Description Inhibition of COX2 (unknown origin)				Bioorg Med Chem Lett 29: 1909-1912 (2019) Article DOI: 10.1016/j.bmcl.2019.05.051 BindingDB Entry DOI: 10.7270/Q22F7RVP
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