Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sphingosine 1-phosphate receptor 1' and Ligand = 'BDBM50198839'   

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 1 (Homo sapiens (Human))	BDBM50198839 (CHEMBL228137 | [3-hydroxy-4-(4-octylphenoxy)-butyl...) Show SMILES CCCCCCCCc1ccc(OC[C@@H](O)CCP(O)(O)=O)cc1 Show InChI InChI=1S/C18H31O5P/c1-2-3-4-5-6-7-8-16-9-11-18(12-10-16)23-15-17(19)13-14-24(20,21)22/h9-12,17,19H,2-8,13-15H2,1H3,(H2,20,21,22)/t17-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	33	n/a	n/a	n/a	n/a
University of Virginia Curated by ChEMBL					Assay Description Activity at human S1P1 receptor expressed in HEK293T cells by [35S]GTPgammaS binding assay				Bioorg Med Chem 15: 663-77 (2006) Article DOI: 10.1016/j.bmc.2006.10.060 BindingDB Entry DOI: 10.7270/Q2FN15VV
					More data for this Ligand-Target Pair