null

SMILES: CCC(=O)c1cnc2ccc(cc2c1N[C@H]1CC[C@H](CN2CCCC2)CC1)-c1cc(F)c(O)c(Cl)c1

InChI Key: InChIKey=VGEVVJRLSYQMSB-XGAFWQRZSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 177480   

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
Maternal embryonic leucine zipper kinase (Homo sapiens (Human))	BDBM177480 (US9120749, 846) Show SMILES CCC(=O)c1cnc2ccc(cc2c1N[C@H]1CC[C@H](CN2CCCC2)CC1)-c1cc(F)c(O)c(Cl)c1 |r,wU:15.16,wD:18.20,(7.34,-2.71,;6,-3.48,;4.67,-2.71,;4.67,-1.17,;3.33,-3.48,;3.33,-5.02,;2,-5.79,;.67,-5.02,;-.67,-5.79,;-2,-5.02,;-2,-3.48,;-.67,-2.71,;.67,-3.48,;2,-2.71,;2,-1.2,;.67,-.43,;-.67,-1.2,;-2,-.43,;-2,1.11,;-3.33,1.88,;-3.33,3.42,;-2.09,4.33,;-2.56,5.79,;-4.1,5.79,;-4.58,4.33,;-.67,1.88,;.67,1.11,;-3.33,-2.71,;-3.33,-1.17,;-4.67,-.4,;-4.67,.94,;-6,-1.17,;-7.34,-.4,;-6,-2.71,;-7.34,-3.48,;-4.67,-3.48,)| Show InChI InChI=1S/C29H33ClFN3O2/c1-2-27(35)23-16-32-26-10-7-19(20-14-24(30)29(36)25(31)15-20)13-22(26)28(23)33-21-8-5-18(6-9-21)17-34-11-3-4-12-34/h7,10,13-16,18,21,36H,2-6,8-9,11-12,17H2,1H3,(H,32,33)/t18-,21-	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	2.30	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