Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Prostaglandin D2 receptor 2' and Ligand = 'BDBM50312303'   

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))	BDBM50312303 ((+/-)-N-(1-cinnamoyl-2-methyl-1,2,3,4-tetrahydroqu...) Show SMILES CC1CC(N(C(C)=O)c2ccccc2)c2ccccc2N1C(=O)\C=C\c1ccccc1 Show InChI InChI=1S/C27H26N2O2/c1-20-19-26(29(21(2)30)23-13-7-4-8-14-23)24-15-9-10-16-25(24)28(20)27(31)18-17-22-11-5-3-6-12-22/h3-18,20,26H,19H2,1-2H3/b18-17+	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	210	n/a	n/a	n/a	n/a	n/a	n/a
Amgen Inc. Curated by ChEMBL					Assay Description Displacement of [3H]PGD2 from human CRTH2 receptor expressed in 293 cells by scintillation counting in presence of 0.5% BSA				Bioorg Med Chem Lett 19: 6840-4 (2009) Article DOI: 10.1016/j.bmcl.2009.10.094 BindingDB Entry DOI: 10.7270/Q2N58MHF
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