BDBM241914 US9421177, VPC143081

SMILES: CCCCCCCCCCCc1ccc(NC(=O)C2(CC2)C(\N)=N\O)cc1

InChI Key: InChIKey=NSZLUFRWHRPXHV-UHFFFAOYSA-N

Data: 2 KI

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 = 241914   

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 kinase 1 (SPHK1) (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 UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	400	-9.07	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
					More data for this Ligand-Target Pair
Sphingosine kinase 2 (SPHK2) (Mus musculus (Mouse))	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)	UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	5.00E+3	-7.52	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
					More data for this Ligand-Target Pair