BDBM190509 US9181182, 41(b)

SMILES: CC(C)(C)OC(=O)NC(CO)(CO)CN1CCc2c1cccc2OCc1cc2c(Cl)cc(Cl)cc2o1

InChI Key: InChIKey=IIMXSXPITVQMSR-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 = 190509   

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))	BDBM190509 (US9181182, 41(b)) Show SMILES CC(C)(C)OC(=O)NC(CO)(CO)CN1CCc2c1cccc2OCc1cc2c(Cl)cc(Cl)cc2o1 Show InChI InChI=1S/C26H30Cl2N2O6/c1-25(2,3)36-24(33)29-26(14-31,15-32)13-30-8-7-18-21(30)5-4-6-22(18)34-12-17-11-19-20(28)9-16(27)10-23(19)35-17/h4-6,9-11,31-32H,7-8,12-15H2,1-3H3,(H,29,33)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	n/a	n/a	>2.90E+4	n/a	n/a	n/a	30
Akaal Pharma PTY LTD US Patent					Assay Description Selected Compounds of the Examples were evaluated at Millipore Corporation, USA, using S1P1 receptor; [35S]-GTPgamaS binding assay. A [35S]-GTPgamaS ...				US Patent US9181182 (2015) BindingDB Entry DOI: 10.7270/Q2XW4HMR
					More data for this Ligand-Target Pair