BDBM50186415 3-(4-(5-(3-cyano-4-(1,3-difluoropropan-2-yloxy)phenyl)-1,3,4-thiadiazol-2-yl)-3-methylphenyl)propanoic acid::CHEMBL379310

SMILES: Cc1cc(CCC(O)=O)ccc1-c1nnc(s1)-c1ccc(OC(CF)CF)c(c1)C#N

InChI Key: InChIKey=DTLZAJHMLXWLGU-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 = 50186415   

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 1 (Homo sapiens (Human))	BDBM50186415 (3-(4-(5-(3-cyano-4-(1,3-difluoropropan-2-yloxy)phe...) Show SMILES Cc1cc(CCC(O)=O)ccc1-c1nnc(s1)-c1ccc(OC(CF)CF)c(c1)C#N Show InChI InChI=1S/C22H19F2N3O3S/c1-13-8-14(3-7-20(28)29)2-5-18(13)22-27-26-21(31-22)15-4-6-19(16(9-15)12-25)30-17(10-23)11-24/h2,4-6,8-9,17H,3,7,10-11H2,1H3,(H,28,29)	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	0.230	n/a	n/a	n/a	n/a
Merck & Co. Curated by ChEMBL					Assay Description Agonist activity at S1P1 receptor assessed as induction of [35S]GTPgammaS binding				Bioorg Med Chem Lett 16: 3684-7 (2006) Article DOI: 10.1016/j.bmcl.2006.04.064 BindingDB Entry DOI: 10.7270/Q2HD7V7J
					More data for this Ligand-Target Pair