BDBM190514 US9181182, 50

SMILES: CCCOc1ccc(cc1Cl)-c1nc(no1)-c1cccc2N(CC(N)(CO)CO)CCc12

InChI Key: InChIKey=KDOFSSBIFRVQGW-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 = 190514   

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))	BDBM190514 (US9181182, 50) Show SMILES CCCOc1ccc(cc1Cl)-c1nc(no1)-c1cccc2N(CC(N)(CO)CO)CCc12 Show InChI InChI=1S/C23H27ClN4O4/c1-2-10-31-20-7-6-15(11-18(20)24)22-26-21(27-32-22)17-4-3-5-19-16(17)8-9-28(19)12-23(25,13-29)14-30/h3-7,11,29-30H,2,8-10,12-14,25H2,1H3	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	17.9	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