Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Maternal embryonic leucine zipper kinase' and Ligand = 'BDBM50538824'   

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))	BDBM50538824 (CHEMBL4647416) Show SMILES CCOC(=O)c1cnc2ccc(nc2c1N[C@H]1CC[C@H](CN(C)C)CC1)-c1cc(Cl)c(O)c(Cl)c1 |r,wU:16.17,wD:19.21,(38.56,-10.48,;37.23,-9.73,;35.9,-10.5,;34.57,-9.75,;34.56,-8.21,;33.24,-10.53,;33.25,-12.08,;31.92,-12.85,;30.58,-12.08,;29.24,-12.86,;27.92,-12.09,;27.92,-10.55,;29.24,-9.77,;30.58,-10.54,;31.9,-9.76,;31.9,-8.22,;30.56,-7.47,;29.23,-8.24,;27.9,-7.48,;27.89,-5.94,;26.55,-5.17,;26.54,-3.64,;25.2,-2.88,;27.87,-2.87,;29.21,-5.16,;30.55,-5.93,;26.59,-9.77,;26.59,-8.23,;25.26,-7.47,;25.26,-5.93,;23.92,-8.23,;22.58,-7.47,;23.93,-9.78,;22.59,-10.56,;25.26,-10.55,)| Show InChI InChI=1S/C26H30Cl2N4O3/c1-4-35-26(34)18-13-29-22-10-9-21(16-11-19(27)25(33)20(28)12-16)31-24(22)23(18)30-17-7-5-15(6-8-17)14-32(2)3/h9-13,15,17,33H,4-8,14H2,1-3H3,(H,29,30)/t15-,17-	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	11	n/a	n/a	n/a	n/a	n/a
Stanford University Curated by ChEMBL					Assay Description Binding affinity to wild-type human full length MELK (M1 to V651 residues) expressed in bacterial expression system by Kinomescan method				Bioorg Med Chem 28: (2020) Article DOI: 10.1016/j.bmc.2019.115193 BindingDB Entry DOI: 10.7270/Q2ZC86FF
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