Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cyclin-dependent kinase/G2/mitotic-specific cyclin- 1' and Ligand = 'BDBM50423760'   

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/G2/mitotic-specific cyclin- 1 (Homo sapiens (Human))	BDBM50423760 (CHEMBL599804) Show SMILES Nc1nc2CCc3cnc(Nc4ccccc4)nc3-c2s1 Show InChI InChI=1S/C15H13N5S/c16-14-19-11-7-6-9-8-17-15(20-12(9)13(11)21-14)18-10-4-2-1-3-5-10/h1-5,8H,6-7H2,(H2,16,19)(H,17,18,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	630	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of St. Andrews Curated by ChEMBL					Assay Description inhibition of CDK1/Cyclin B				J Med Chem 53: 2136-45 (2010) Article DOI: 10.1021/jm901660c BindingDB Entry DOI: 10.7270/Q2377B0R
					More data for this Ligand-Target Pair