BDBM103609 US8563594, 158

SMILES: CCc1ccc(cc1)-c1ccc(CNCCP(O)(O)=O)nc1-c1ccncc1

InChI Key: InChIKey=NAGFVWPTKPOLDM-UHFFFAOYSA-N

Data: 1 IC50

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 = 103609   

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))	BDBM103609 (US8563594, 158) Show SMILES CCc1ccc(cc1)-c1ccc(CNCCP(O)(O)=O)nc1-c1ccncc1 Show InChI InChI=1S/C21H24N3O3P/c1-2-16-3-5-17(6-4-16)20-8-7-19(15-23-13-14-28(25,26)27)24-21(20)18-9-11-22-12-10-18/h3-12,23H,2,13-15H2,1H3,(H2,25,26,27)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Allergan, Inc. US Patent					Assay Description FLIPR assay using S1P3 receptor inhibitor.				US Patent US8563594 (2013) BindingDB Entry DOI: 10.7270/Q2765CZV
					More data for this Ligand-Target Pair