Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Casein kinase II subunit beta' and Ligand = 'BDBM219752'   

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
Casein kinase II subunit beta (Homo sapiens (Human))	BDBM219752 (US9303033, B48, Table 58A, Compound 25 | US9303033...) Show SMILES CC(C)N1CCN(CC1)c1ccc(Oc2nc(NC3CC3)n3ncc(\C=C4/NC(=O)NC4=O)c3n2)cc1 Show InChI InChI=1S/C25H29N9O3/c1-15(2)32-9-11-33(12-10-32)18-5-7-19(8-6-18)37-25-29-21-16(13-20-22(35)30-24(36)28-20)14-26-34(21)23(31-25)27-17-3-4-17/h5-8,13-15,17H,3-4,9-12H2,1-2H3,(H,27,29,31)(H2,28,30,35,36)/b20-13-	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	7.0	n/a
SENHWA BIOSCIENCES, INC. US Patent					Assay Description Test compounds dissolved and diluted in DMSO (2 μl) were added to a reaction mixture comprising 10 μl of 5× Reaction Buffer (40 mM MOPS pH ...				US Patent US9303033 (2016) BindingDB Entry DOI: 10.7270/Q2CN72RX
					More data for this Ligand-Target Pair
Casein kinase II subunit beta (Homo sapiens (Human))	BDBM219752 (US9303033, B48, Table 58A, Compound 25 | US9303033...) Show SMILES CC(C)N1CCN(CC1)c1ccc(Oc2nc(NC3CC3)n3ncc(\C=C4/NC(=O)NC4=O)c3n2)cc1 Show InChI InChI=1S/C25H29N9O3/c1-15(2)32-9-11-33(12-10-32)18-5-7-19(8-6-18)37-25-29-21-16(13-20-22(35)30-24(36)28-20)14-26-34(21)23(31-25)27-17-3-4-17/h5-8,13-15,17H,3-4,9-12H2,1-2H3,(H,27,29,31)(H2,28,30,35,36)/b20-13-	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	6.52E+4	n/a	n/a	n/a	n/a	7.0	n/a
SENHWA BIOSCIENCES, INC. US Patent					Assay Description Test compounds dissolved and diluted in DMSO (2 μl) were added to a reaction mixture comprising 10 μl of 5× Reaction Buffer (40 mM MOPS pH ...				US Patent US9303033 (2016) BindingDB Entry DOI: 10.7270/Q2CN72RX
					More data for this Ligand-Target Pair