BDBM50198839 CHEMBL228137::[3-hydroxy-4-(4-octylphenoxy)-butyl]-phosphonic acid

SMILES: CCCCCCCCc1ccc(OC[C@@H](O)CCP(O)(O)=O)cc1

InChI Key: InChIKey=NQXUTXXSTGLUHU-KRWDZBQOSA-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 = 50198839   

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 4 (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	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	4.40E+5	n/a	n/a	n/a	n/a
University of Virginia Curated by ChEMBL					Assay Description Activity at human S1P4 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
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