Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sphingosine 1-phosphate receptor 5' and Ligand = 'BDBM50185529'   

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
Sphingosine 1-phosphate receptor 5 (Homo sapiens (Human))	BDBM50185529 (2-(trans-5-(4-(5-(4-cyclopentylphenyl)-1,2,4-oxadi...) Show SMILES OC(=O)C[C@@H]1CN[C@H](C1)c1ccc(cc1)-c1noc(n1)-c1ccc(cc1)C1CCCC1 Show InChI InChI=1S/C25H27N3O3/c29-23(30)14-16-13-22(26-15-16)19-7-9-20(10-8-19)24-27-25(31-28-24)21-11-5-18(6-12-21)17-3-1-2-4-17/h5-12,16-17,22,26H,1-4,13-15H2,(H,29,30)/t16-,22-/m1/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	68	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Displacement of [33P]S1P from human S1P5 receptor expressed in CHO cells				Bioorg Med Chem Lett 16: 3564-8 (2006) Article DOI: 10.1016/j.bmcl.2006.03.090 BindingDB Entry DOI: 10.7270/Q2WS8SWT
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