Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Mitogen-activated protein kinase kinase kinase 9' and Ligand = 'BDBM24958'   

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
Mitogen-activated protein kinase kinase kinase 9 (Homo sapiens (Human))	BDBM24958 (2-{[3-(2-hydroxyethyl)-14-oxo-3,13-diazahexacyclo[...) Show SMILES OCCn1c2ccccc2c2c3CNC(=O)c3c-3c(CCc4cc(OCC#N)ccc-34)c12 Show InChI InChI=1S/C26H21N3O3/c27-9-12-32-16-6-8-17-15(13-16)5-7-19-22(17)24-20(14-28-26(24)31)23-18-3-1-2-4-21(18)29(10-11-30)25(19)23/h1-4,6,8,13,30H,5,7,10-12,14H2,(H,28,31)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	n/a	n/a	n/a	7.2	37
Cephalon					Assay Description The MLK kinase assays were performed by using the Millipore multiscreen trichloroacetic acid (TCA) in-plate format. The inhibition curves were genera...				J Med Chem 51: 5680-9 (2008) Article DOI: 10.1021/jm8005838 BindingDB Entry DOI: 10.7270/Q2TH8K09
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