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 = 'BDBM490088'   

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))	BDBM490088 (US10968199, Example 11) Show SMILES CC(C)n1cnnc1-c1cccc(NC(=O)c2cc(C3CC3NS(=O)(=O)C3CC3)c(C)cc2F)n1 Show InChI InChI=1S/C24H27FN6O3S/c1-13(2)31-12-26-29-23(31)20-5-4-6-22(27-20)28-24(32)18-10-16(14(3)9-19(18)25)17-11-21(17)30-35(33,34)15-7-8-15/h4-6,9-10,12-13,15,17,21,30H,7-8,11H2,1-3H3,(H,27,28,32)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	5.5	n/a	n/a	n/a	n/a	n/a	n/a
Enanta Pharmaceuticals, Inc. US Patent					Assay Description ASK1 was purchased from Thermofisher (Catalogue #PV4011), ATP was purchased from Sigma (Catalogue #A7699), HTRF® KinEASE™ Assay System was obtained f...				US Patent US10968199 (2021) BindingDB Entry DOI: 10.7270/Q28W3HDS
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