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 = 'BDBM4112'   

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))	BDBM4112 (4-bromo-9-{[4-(trifluoromethyl)phenyl]carbonyl}-9H...) Show SMILES Oc1cc2n(C(=O)c3ccc(cc3)C(F)(F)F)c3c(O)c(O)cc(Br)c3c2cc1O Show InChI InChI=1S/C20H11BrF3NO5/c21-11-6-15(28)18(29)17-16(11)10-5-13(26)14(27)7-12(10)25(17)19(30)8-1-3-9(4-2-8)20(22,23)24/h1-7,26-29H	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	7.00E+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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