Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Prostaglandin D2 receptor 2' and Ligand = 'BDBM119852'   

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 D2 receptor 2 (Homo sapiens (Human))	BDBM119852 (US8691993, 1) Show SMILES OC(=O)Cc1cc(C2CCN(CC2)S(=O)(=O)c2ccccc2)c2cc(F)ccc2c1 Show InChI InChI=1S/C23H22FNO4S/c24-19-7-6-18-12-16(14-23(26)27)13-21(22(18)15-19)17-8-10-25(11-9-17)30(28,29)20-4-2-1-3-5-20/h1-7,12-13,15,17H,8-11,14H2,(H,26,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	18	n/a	n/a	n/a	n/a	n/a	37
Hoffmann-La Roche Inc. US Patent					Assay Description Calcium Flux Assay Using Fluorometric Imaging Plate Reader (FLIPR). Buffer containing dye (from the FLIPR® Calcium 3 Assay Kit from Molecular D...				US Patent US8691993 (2014) BindingDB Entry DOI: 10.7270/Q2348J11
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