null

SMILES: CC(C)n1cnc2cc(nc(Nc3ccc(C)c(c3)C(=O)NC3(CC3)C(F)F)c12)-c1ccc2c(c1)N([C@H]1C[C@H](C1)N1CCCCC1)C(=O)C2(C)C

InChI Key:

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 529614   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/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))	BDBM529614 (US11203591, Example 27) Show SMILES CC(C)n1cnc2cc(nc(Nc3ccc(C)c(c3)C(=O)NC3(CC3)C(F)F)c12)-c1ccc2c(c1)N([C@H]1C[C@H](C1)N1CCCCC1)C(=O)C2(C)C |r,wU:36.40,38.45,(4.79,-1.34,;5.88,-.25,;7.37,-.65,;5.48,1.24,;6.39,2.48,;5.48,3.73,;4.02,3.25,;2.69,4.02,;1.35,3.25,;1.35,1.71,;2.69,.94,;2.69,-.6,;1.35,-1.37,;.02,-.6,;-1.32,-1.37,;-1.32,-2.91,;-2.65,-3.68,;.02,-3.68,;1.35,-2.91,;.02,-5.22,;-1.32,-5.99,;1.35,-5.99,;2.69,-5.22,;1.92,-3.88,;3.46,-3.88,;4.02,-5.99,;4.02,-7.53,;5.35,-5.22,;4.02,1.71,;.02,4.02,;.02,5.56,;-1.32,6.33,;-2.65,5.56,;-2.65,4.02,;-1.32,3.25,;-4.11,3.55,;-4.51,2.06,;-3.74,.73,;-5.08,-.04,;-5.85,1.29,;-5.48,-1.53,;-6.96,-1.93,;-7.37,-3.43,;-6.27,-4.54,;-4.77,-4.14,;-4.36,-2.63,;-5.02,4.79,;-6.56,4.79,;-4.11,6.04,;-3.72,7.53,;-5.45,6.81,)| Show InChI	PDB NCI pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.0700	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