Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cyclin-dependent kinase 2' and Ligand = 'BDBM106964'   

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
Cyclin-dependent kinase 2 (Homo sapiens (Human))	BDBM106964 (US8592581, 15) Show SMILES CC(C)n1cnc2c(NCc3cccnc3)nc(NCC(O)C(F)(F)F)nc12 Show InChI InChI=1S/C17H20F3N7O/c1-10(2)27-9-24-13-14(22-7-11-4-3-5-21-6-11)25-16(26-15(13)27)23-8-12(28)17(18,19)20/h3-6,9-10,12,28H,7-8H2,1-2H3,(H2,22,23,25,26)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	570	n/a	n/a	n/a	n/a	7.5	30
Cyclacel Limited; Cancer Research Technology Limited US Patent					Assay Description To evaluate the in-vitro kinase potency of the compounds, they were screened against CDK 2 and CDK9. Kinase assays were performed in 96-well plates u...				US Patent US8592581 (2013) BindingDB Entry DOI: 10.7270/Q25X27J9
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