Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Prostaglandin G/H synthase 1' and Ligand = 'BDBM50176536'   

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 (Canis familiaris)	BDBM50176536 (5-(bicyclo[2.2.1]heptan-2-ylamino)-1-(5-(methylsul...) Show SMILES CS(=O)(=O)c1ccc(nc1)-n1nc(c(C#N)c1NC1CC2CCC1C2)C(F)(F)F |TLB:17:18:22.21:24| Show InChI InChI=1S/C18H18F3N5O2S/c1-29(27,28)12-4-5-15(23-9-12)26-17(13(8-22)16(25-26)18(19,20)21)24-14-7-10-2-3-11(14)6-10/h4-5,9-11,14,24H,2-3,6-7H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.55E+4	n/a	n/a	n/a	n/a	n/a	n/a
Veterinary Medicine Research and Development Pfizer Inc. Curated by ChEMBL					Assay Description Inhibitory activity against COX1 in canine whole blood				Bioorg Med Chem Lett 16: 288-92 (2005) Article DOI: 10.1016/j.bmcl.2005.10.006 BindingDB Entry DOI: 10.7270/Q2NZ876S
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