BDBM50360531 CHEMBL1935682

SMILES: Cc1ccc(OCCOc2ccc(Br)cc2C(F)(F)F)c(n1)[N+]([O-])=O

InChI Key: InChIKey=JERCGDSEVKGARJ-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 50360531   

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))	BDBM50360531 (CHEMBL1935682) Show SMILES Cc1ccc(OCCOc2ccc(Br)cc2C(F)(F)F)c(n1)[N+]([O-])=O Show InChI InChI=1S/C15H12BrF3N2O4/c1-9-2-4-13(14(20-9)21(22)23)25-7-6-24-12-5-3-10(16)8-11(12)15(17,18)19/h2-5,8H,6-7H2,1H3	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	601	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Agonist activity at human S1P4R expressed in human U2OS cells containing EDG6 gene co-expressing GAL4-VP16 and beta-arrestin/TEV protease assessed as...				Bioorg Med Chem Lett 22: 537-42 (2011) Article DOI: 10.1016/j.bmcl.2011.10.096 BindingDB Entry DOI: 10.7270/Q2WD410R
					More data for this Ligand-Target Pair