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 = 'BDBM490107'   

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))	BDBM490107 (US10968199, Example 24) Show SMILES C[C@H](CO)n1cnnc1-c1cccc(NC(=O)c2cc(C3CC3C(=O)N3CCC(F)(F)C3)c(C)cc2F)n1 |r| Show InChI InChI=1S/C26H27F3N6O3/c1-14-8-20(27)19(9-16(14)17-10-18(17)25(38)34-7-6-26(28,29)12-34)24(37)32-22-5-3-4-21(31-22)23-33-30-13-35(23)15(2)11-36/h3-5,8-9,13,15,17-18,36H,6-7,10-12H2,1-2H3,(H,31,32,37)/t15-,17?,18?/m1/s1	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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