Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Mitogen-activated protein kinase kinase kinase 5' and Ligand = 'BDBM128412'   

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 5 (Homo sapiens (Human))	BDBM128412 (US8802695, 28) Show SMILES CC(C)(CO)c1ccc(cc1)C(=O)Nc1cc2n(cc(Cl)c2cn1)C1CC1 Show InChI InChI=1S/C21H22ClN3O2/c1-21(2,12-26)14-5-3-13(4-6-14)20(27)24-19-9-18-16(10-23-19)17(22)11-25(18)15-7-8-15/h3-6,9-11,15,26H,7-8,12H2,1-2H3,(H,23,24,27)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	16	n/a	n/a	n/a	n/a	7.3	25
Takeda Pharmaceutical Company Limited US Patent					Assay Description The inhibitory properties of compounds to ASK1 may be determined using a white 384-well-plate format under the following reaction conditions: 25 nM A...				US Patent US8802695 (2014) BindingDB Entry DOI: 10.7270/Q27W69WD
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