BDBM50315817 2-Amino-4-[2'-fluoro-4'-(4-methylphenylthio)biphenyl-4-yl]-2-(phosphoryloxymethyl)butanol::CHEMBL1089475

SMILES: Cc1ccc(Sc2ccc(c(F)c2)-c2ccc(CCC(N)(CO)COP(O)(O)=O)cc2)cc1

InChI Key: InChIKey=XLSUBSWAZGYKFU-UHFFFAOYSA-N

Data: 2 EC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50315817   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Sphingosine 1-phosphate receptor 3 (Homo sapiens (Human))	BDBM50315817 (2-Amino-4-[2'-fluoro-4'-(4-methylphenylthio)biphen...) Show SMILES Cc1ccc(Sc2ccc(c(F)c2)-c2ccc(CCC(N)(CO)COP(O)(O)=O)cc2)cc1 Show InChI InChI=1S/C24H27FNO5PS/c1-17-2-8-20(9-3-17)33-21-10-11-22(23(25)14-21)19-6-4-18(5-7-19)12-13-24(26,15-27)16-31-32(28,29)30/h2-11,14,27H,12-13,15-16,26H2,1H3,(H2,28,29,30)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a
Mitsubishi Tanabe Pharma Corporation Curated by ChEMBL					Assay Description Agonist activity at human S1P3 receptor expressed in CHO cells assessed as intracellular calcium mobilization				J Med Chem 53: 3154-68 (2010) Article DOI: 10.1021/jm901776q BindingDB Entry DOI: 10.7270/Q2HH6K7W
					More data for this Ligand-Target Pair
Sphingosine 1-phosphate receptor 1 (Homo sapiens (Human))	BDBM50315817 (2-Amino-4-[2'-fluoro-4'-(4-methylphenylthio)biphen...) Show SMILES Cc1ccc(Sc2ccc(c(F)c2)-c2ccc(CCC(N)(CO)COP(O)(O)=O)cc2)cc1 Show InChI InChI=1S/C24H27FNO5PS/c1-17-2-8-20(9-3-17)33-21-10-11-22(23(25)14-21)19-6-4-18(5-7-19)12-13-24(26,15-27)16-31-32(28,29)30/h2-11,14,27H,12-13,15-16,26H2,1H3,(H2,28,29,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	3	n/a	n/a	n/a	n/a
Mitsubishi Tanabe Pharma Corporation Curated by ChEMBL					Assay Description Agonist activity at human S1P1 receptor expressed in human Chem1 cells assessed as intracellular calcium mobilization				J Med Chem 53: 3154-68 (2010) Article DOI: 10.1021/jm901776q BindingDB Entry DOI: 10.7270/Q2HH6K7W
					More data for this Ligand-Target Pair