null

SMILES: COc1ccc(CCCCOc2ccc(NC(=O)[C@@](C)(N)COP(O)(O)=O)cc2)cc1

InChI Key: InChIKey=WUXNTVXUIHVAQN-NRFANRHFSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50249151   

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))	BDBM50249151 ((S)-2-amino-3-(4-(4-(4-methoxyphenyl)butoxy)phenyl...) Show SMILES COc1ccc(CCCCOc2ccc(NC(=O)[C@@](C)(N)COP(O)(O)=O)cc2)cc1 |r| Show InChI InChI=1S/C21H29N2O7P/c1-21(22,15-30-31(25,26)27)20(24)23-17-8-12-19(13-9-17)29-14-4-3-5-16-6-10-18(28-2)11-7-16/h6-13H,3-5,14-15,22H2,1-2H3,(H,23,24)(H2,25,26,27)/t21-/m0/s1	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	100	n/a	n/a	n/a	n/a	n/a	n/a
Praecis Pharmaceuticals Inc Curated by ChEMBL					Assay Description Displacement of [33P]sphingosine-1-phosphate from human S1P3 receptor				Bioorg Med Chem Lett 19: 2315-9 (2009) Article DOI: 10.1016/j.bmcl.2009.02.073 BindingDB Entry DOI: 10.7270/Q2XD11KJ
					More data for this Ligand-Target Pair
Sphingosine 1-phosphate receptor 1 (Homo sapiens (Human))	BDBM50249151 ((S)-2-amino-3-(4-(4-(4-methoxyphenyl)butoxy)phenyl...) Show SMILES COc1ccc(CCCCOc2ccc(NC(=O)[C@@](C)(N)COP(O)(O)=O)cc2)cc1 |r| Show InChI InChI=1S/C21H29N2O7P/c1-21(22,15-30-31(25,26)27)20(24)23-17-8-12-19(13-9-17)29-14-4-3-5-16-6-10-18(28-2)11-7-16/h6-13H,3-5,14-15,22H2,1-2H3,(H,23,24)(H2,25,26,27)/t21-/m0/s1	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	4.75	n/a	n/a	n/a	n/a	n/a	n/a
Praecis Pharmaceuticals Inc Curated by ChEMBL					Assay Description Displacement of [33P]sphingosine-1-phosphate from human S1P1 receptor				Bioorg Med Chem Lett 19: 2315-9 (2009) Article DOI: 10.1016/j.bmcl.2009.02.073 BindingDB Entry DOI: 10.7270/Q2XD11KJ
					More data for this Ligand-Target Pair