Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Prostaglandin D2 receptor 2' and Ligand = 'BDBM50034882'   

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))	BDBM50034882 (CHEMBL3338103) Show SMILES Cc1c(Cc2ccccc2S(=O)(=O)c2cccc(Cl)c2)c2c(CCNC2=O)n1CC(O)=O Show InChI InChI=1S/C23H21ClN2O5S/c1-14-18(22-19(9-10-25-23(22)29)26(14)13-21(27)28)11-15-5-2-3-8-20(15)32(30,31)17-7-4-6-16(24)12-17/h2-8,12H,9-11,13H2,1H3,(H,25,29)(H,27,28)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4	n/a	n/a	n/a	n/a	n/a	n/a
Rhône-Poulenc Rorer Curated by ChEMBL					Assay Description Antagonist activity at CRTh2 (unknown origin) stably expressed in PGD2-stimulated CHO.K1 cells preincubated for 1 hr by radio-labelled [35S]-GTPgamma...				Bioorg Med Chem Lett 24: 5111-7 (2014) Article DOI: 10.1016/j.bmcl.2014.08.026 BindingDB Entry DOI: 10.7270/Q2N01840
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