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SMILES: Cc1cc(ccc1OCc1ccccc1F)-c1nc2CN(CCCC(O)=O)CCc2o1

InChI Key: InChIKey=WSZMSLZXJCCJAA-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 196174   

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 5 (Homo sapiens (Human))	BDBM196174 (US9670220, 89) Show SMILES Cc1cc(ccc1OCc1ccccc1F)-c1nc2CN(CCCC(O)=O)CCc2o1 Show InChI InChI=1S/C24H25FN2O4/c1-16-13-17(8-9-21(16)30-15-18-5-2-3-6-19(18)25)24-26-20-14-27(11-4-7-23(28)29)12-10-22(20)31-24/h2-3,5-6,8-9,13H,4,7,10-12,14-15H2,1H3,(H,28,29)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	6.30	n/a	n/a	n/a	n/a
Abbvie B.V.; AbbiVie Inc. US Patent					Assay Description The CHO-human-S1P5-Aeqorin assay was bought from Euroscreen, Brussels (Euroscreen, Technical dossier, Human Lysophospholid S1P5 (Edg8) receptor, DNA ...				US Patent US9670220 (2017) BindingDB Entry DOI: 10.7270/Q2QJ7FHD
					More data for this Ligand-Target Pair
Sphingosine 1-phosphate receptor 3 (Homo sapiens (Human))	BDBM196174 (US9670220, 89) Show SMILES Cc1cc(ccc1OCc1ccccc1F)-c1nc2CN(CCCC(O)=O)CCc2o1 Show InChI InChI=1S/C24H25FN2O4/c1-16-13-17(8-9-21(16)30-15-18-5-2-3-6-19(18)25)24-26-20-14-27(11-4-7-23(28)29)12-10-22(20)31-24/h2-3,5-6,8-9,13H,4,7,10-12,14-15H2,1H3,(H,28,29)	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	>1.00E+4	n/a	n/a	n/a	n/a
Abbvie B.V.; AbbiVie Inc. US Patent					Assay Description The CHO-human-S1P3-Aeqorin assay (CHO/Gα16/AEQ/h-S1P3) was established at Solvay Pharmaceuticals. The plasmid DNA coding for the S1P3 receptor (...				US Patent US9670220 (2017) BindingDB Entry DOI: 10.7270/Q2QJ7FHD
					More data for this Ligand-Target Pair
Sphingosine 1-phosphate receptor 1 (Homo sapiens (Human))	BDBM196174 (US9670220, 89) Show SMILES Cc1cc(ccc1OCc1ccccc1F)-c1nc2CN(CCCC(O)=O)CCc2o1 Show InChI InChI=1S/C24H25FN2O4/c1-16-13-17(8-9-21(16)30-15-18-5-2-3-6-19(18)25)24-26-20-14-27(11-4-7-23(28)29)12-10-22(20)31-24/h2-3,5-6,8-9,13H,4,7,10-12,14-15H2,1H3,(H,28,29)	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	1.30E+3	n/a	n/a	n/a	25
Abbvie B.V.; AbbiVie Inc. US Patent					Assay Description The CHO-K1-Human S1P1-c-AMP assay was performed at Euroscreenfast, Brussels (Euroscreen, Human S1P1 coupling Gi/0, (Edg1) receptor, catalog no: FAST-...				US Patent US9670220 (2017) BindingDB Entry DOI: 10.7270/Q2QJ7FHD
					More data for this Ligand-Target Pair