Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Mitogen-activated protein kinase kinase kinase kinase 1' and Ligand = 'BDBM529606'   

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 kinase 1 (Homo sapiens (Human))	BDBM529606 (US11203591, Example 21) Show SMILES CC(C)n1cnc2cc(nc(Nc3ccc(C)c(c3)C(=O)NC(C)C(F)F)c12)-c1ccc2c(c1)N([C@H]1C[C@H](C1)N1CCCCC1)C(=O)C2(C)C |r,wU:35.38,37.43,(4.79,-.18,;5.88,.9,;7.37,.51,;5.48,2.39,;6.39,3.64,;5.48,4.88,;4.02,4.41,;2.69,5.18,;1.35,4.41,;1.35,2.87,;2.69,2.1,;2.69,.56,;1.35,-.21,;.02,.56,;-1.32,-.21,;-1.32,-1.75,;-2.65,-2.52,;.02,-2.52,;1.35,-1.75,;.02,-4.06,;1.35,-4.83,;-1.32,-4.83,;-1.32,-6.37,;.02,-7.14,;-2.65,-7.14,;-3.98,-6.37,;-2.65,-8.68,;4.02,2.87,;.02,5.18,;.02,6.72,;-1.32,7.49,;-2.65,6.72,;-2.65,5.18,;-1.32,4.41,;-4.11,4.7,;-4.51,3.21,;-3.74,1.88,;-5.08,1.11,;-5.85,2.44,;-5.48,-.38,;-6.96,-.77,;-7.37,-2.28,;-6.27,-3.38,;-4.77,-2.98,;-4.36,-1.48,;-5.02,5.95,;-6.56,5.95,;-4.11,7.19,;-5.45,7.96,;-3.72,8.68,)| Show InChI	PDB NCI pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.0500	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Ten nanoliters of test compounds dissolved in DMSO at various concentrations were dispensed into a 384-well ProxiPlate (PerkinElmer #6008289). Five m...				Citation and Details BindingDB Entry DOI: 10.7270/Q2833W6Q
					More data for this Ligand-Target Pair