Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cyclin-dependent kinase 1/G2/mitotic-specific cyclin-B' and Ligand = 'BDBM7469'   

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 1/G2/mitotic-specific cyclin-B (Marthasterias glacialis (starfish))	BDBM7469 (13-Amino-11H-dibenzo[f,h]pyrazolo[3,4-c]cinnoline ...) Show SMILES Nc1n[nH]c2nnc3c4ccccc4c4ccccc4c3c12 Show InChI InChI=1S/C17H11N5/c18-16-14-13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)15(13)19-21-17(14)22-20-16/h1-8H,(H3,18,20,21,22)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	7.2	30
Universidad San Pablo CEU					Assay Description Kinase activities were assayed in buffers containing substrate, enzyme, and inhibitor at 30 °C in the presence of 15 uM ATP/ [gamma-33P] ATP. 33...				J Med Chem 48: 6843-54 (2005) Article DOI: 10.1021/jm058013g BindingDB Entry DOI: 10.7270/Q2GH9G44
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