Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'cAMP-dependent protein kinase catalytic subunit alpha' and Ligand = 'BDBM4116'   

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
cAMP-dependent protein kinase catalytic subunit alpha (Bos taurus (bovine))	BDBM4116 (4-bromo-9-[(4-methanesulfonylphenyl)carbonyl]-9H-c...) Show SMILES CS(=O)(=O)c1ccc(cc1)C(=O)n1c2cc(O)c(O)cc2c2c(Br)cc(O)c(O)c12 Show InChI InChI=1S/C20H14BrNO7S/c1-30(28,29)10-4-2-9(3-5-10)20(27)22-13-8-15(24)14(23)6-11(13)17-12(21)7-16(25)19(26)18(17)22/h2-8,23-26H,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	4.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer					Assay Description IC50 is the inhibitor concentration, which inhibits 50% of PKA activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] label...				J Med Chem 37: 2224-31 (1994) Article DOI: 10.1021/jm00040a015 BindingDB Entry DOI: 10.7270/Q27M0648
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