Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Maternal embryonic leucine zipper kinase' and Ligand = 'BDBM177239'   

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
Maternal embryonic leucine zipper kinase (Homo sapiens (Human))	BDBM177239 (US9120749, 605) Show SMILES CCCC(=O)c1cnc2ccc(cc2c1N[C@H]1CC[C@H](CN(C)C)CC1)-c1cc(Cl)c(O)c(Cl)c1 |r,wU:19.21,wD:16.17,(8,-3.33,;6.67,-2.56,;5.33,-3.33,;4,-2.56,;4,-1.02,;2.67,-3.33,;2.67,-4.87,;1.33,-5.64,;,-4.87,;-1.33,-5.64,;-2.67,-4.87,;-2.67,-3.33,;-1.33,-2.56,;,-3.33,;1.33,-2.56,;1.33,-1.02,;.24,.07,;.64,1.55,;-.45,2.64,;-1.93,2.24,;-3.02,3.33,;-3.02,4.87,;-1.69,5.64,;-4.36,5.64,;-2.33,.76,;-1.24,-.33,;-4,-2.56,;-5.33,-3.33,;-6.67,-2.56,;-8,-3.33,;-6.67,-1.02,;-8,-.25,;-5.33,-.25,;-5.33,1.29,;-4,-1.02,)| Show InChI InChI=1S/C28H33Cl2N3O2/c1-4-5-26(34)22-15-31-25-11-8-18(19-13-23(29)28(35)24(30)14-19)12-21(25)27(22)32-20-9-6-17(7-10-20)16-33(2)3/h8,11-15,17,20,35H,4-7,9-10,16H2,1-3H3,(H,31,32)/t17-,20-	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	2	n/a	n/a	n/a	n/a	7.4	25
ONCOTHERAPY SCIENCE, INC. US Patent					Assay Description MELK activity was determined in the presence or absence of compounds using fluorescein isothiocyanate-labeled (FITC-labeled) histone H3 peptide as a ...				US Patent US9120749 (2015) BindingDB Entry DOI: 10.7270/Q2FX7872
					More data for this Ligand-Target Pair