Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sphingosine 1-phosphate receptor 1' and Ligand = 'BDBM127538'   

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))	BDBM127538 (US8791100, 36) Show SMILES CC[C@@H](Nc1ccc(CC)c(CN2CC[C@H](C2)C(O)=O)c1)c1ccc(Cl)c(C)c1 |r| Show InChI InChI=1S/C24H31ClN2O2/c1-4-17-6-8-21(13-20(17)15-27-11-10-19(14-27)24(28)29)26-23(5-2)18-7-9-22(25)16(3)12-18/h6-9,12-13,19,23,26H,4-5,10-11,14-15H2,1-3H3,(H,28,29)/t19-,23-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	3.70	n/a	n/a	n/a	n/a	n/a	37
Novartis AG US Patent					Assay Description The assay measures intracellular changes of Ca2+ mediated by the synthetic probing agonist 3-{[2-(2-Trifluoromethyl-biphenyl-4-yl)-benzo[b]thiophen-5...				US Patent US8791100 (2014) BindingDB Entry DOI: 10.7270/Q2ZK5FCC
					More data for this Ligand-Target Pair