Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sphingosine kinase 1' and Ligand = 'BDBM241914'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Sphingosine kinase 1 (Homo sapiens (Human))	BDBM241914 (US9421177, VPC143081) Show SMILES CCCCCCCCCCCc1ccc(NC(=O)C2(CC2)C(\N)=N\O)cc1 Show InChI InChI=1S/C22H35N3O2/c1-2-3-4-5-6-7-8-9-10-11-18-12-14-19(15-13-18)24-21(26)22(16-17-22)20(23)25-27/h12-15,27H,2-11,16-17H2,1H3,(H2,23,25)(H,24,26)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	400	-38.0	n/a	n/a	n/a	n/a	n/a	n/a	37
University of Virginia Patent Foundation US Patent					Assay Description Sphingosine kinase activity was assessed as described previously (Kharel, Y., Lee, S., Snyder, A. H., Sheasley-O'Neill, S. L., Morris, M. A., Set...				US Patent US9421177 (2016) BindingDB Entry DOI: 10.7270/Q2FT8JZ4
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