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SMILES: COCCOc1ccc(cc1)-c1nnc(o1)-c1ccc2CCC(N)(CO)Cc2c1

InChI Key: InChIKey=BNQFDYZDXGMLQB-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 221913   

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 (Mus musculus (Mouse))	BDBM221913 (US9315492, 10) Show SMILES COCCOc1ccc(cc1)-c1nnc(o1)-c1ccc2CCC(N)(CO)Cc2c1 Show InChI InChI=1S/C22H25N3O4/c1-27-10-11-28-19-6-4-16(5-7-19)20-24-25-21(29-20)17-3-2-15-8-9-22(23,14-26)13-18(15)12-17/h2-7,12,26H,8-11,13-14,23H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	77	n/a	n/a	n/a	25
Beijing Foreland Biopharma Co., Ltd. US Patent					Assay Description Assay procedures: OCC culture solution was preheated in water tank at 37° C. Cells were taken out from liquor nitrogen tank, left on the dry-ice, and...				US Patent US9315492 (2016) BindingDB Entry DOI: 10.7270/Q2154FW6
					More data for this Ligand-Target Pair
Sphingosine 1-phosphate receptor 1 (Homo sapiens (Human))	BDBM221913 (US9315492, 10) Show SMILES COCCOc1ccc(cc1)-c1nnc(o1)-c1ccc2CCC(N)(CO)Cc2c1 Show InChI InChI=1S/C22H25N3O4/c1-27-10-11-28-19-6-4-16(5-7-19)20-24-25-21(29-20)17-3-2-15-8-9-22(23,14-26)13-18(15)12-17/h2-7,12,26H,8-11,13-14,23H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	31.7	n/a	n/a	n/a	n/a	7.4	n/a
Beijing Foreland Biopharma Co., Ltd. US Patent					Assay Description Test method: wetting membranes by saponin solution, and preparing [35S]-GTPγS in binding solution (4×). The test compound was prepared as 4× of ...				US Patent US9315492 (2016) BindingDB Entry DOI: 10.7270/Q2154FW6
					More data for this Ligand-Target Pair