BDBM192141 US9187437, 16

SMILES: FC(F)(F)Oc1ccc(cc1)-c1noc(CCC2(CCCCC2)c2ccccc2)n1

InChI Key: InChIKey=IDFODUDVOBTNEG-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 192141   

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))	BDBM192141 (US9187437, 16) Show SMILES FC(F)(F)Oc1ccc(cc1)-c1noc(CCC2(CCCCC2)c2ccccc2)n1 Show InChI InChI=1S/C23H23F3N2O2/c24-23(25,26)29-19-11-9-17(10-12-19)21-27-20(30-28-21)13-16-22(14-5-2-6-15-22)18-7-3-1-4-8-18/h1,3-4,7-12H,2,5-6,13-16H2	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	>6.20E+4	n/a	n/a	n/a	60
BRISTOL-MYERS SQUIBB COMPANY US Patent					Assay Description Compounds were loaded in a 384 Falcon v-bottom plate (0.5 ul/well in a 11 point, 3-fold dilution). Membranes prepared from S1P1/CHO cells or EDG3-G...				US Patent US9187437 (2015) BindingDB Entry DOI: 10.7270/Q2JH3K0X
					More data for this Ligand-Target Pair
Sphingosine 1-phosphate receptor 1 (Homo sapiens (Human))	BDBM192141 (US9187437, 16) Show SMILES FC(F)(F)Oc1ccc(cc1)-c1noc(CCC2(CCCCC2)c2ccccc2)n1 Show InChI InChI=1S/C23H23F3N2O2/c24-23(25,26)29-19-11-9-17(10-12-19)21-27-20(30-28-21)13-16-22(14-5-2-6-15-22)18-7-3-1-4-8-18/h1,3-4,7-12H,2,5-6,13-16H2	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	5.70E+3	n/a	n/a	n/a	60
BRISTOL-MYERS SQUIBB COMPANY US Patent					Assay Description Compounds were loaded in a 384 Falcon v-bottom plate (0.5 ul/well in a 11 point, 3-fold dilution). Membranes prepared from S1P1/CHO cells or EDG3-G...				US Patent US9187437 (2015) BindingDB Entry DOI: 10.7270/Q2JH3K0X
					More data for this Ligand-Target Pair