Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cyclin-G-associated kinase' and Ligand = 'BDBM50507728'   

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-G-associated kinase (Homo sapiens (Human))	BDBM50507728 (CHEMBL4451350) Show SMILES COc1ccc(cc1OC)-c1cnc2c(\C=C\c3ccccc3)snc2c1 Show InChI InChI=1S/C22H18N2O2S/c1-25-19-10-9-16(13-20(19)26-2)17-12-18-22(23-14-17)21(27-24-18)11-8-15-6-4-3-5-7-15/h3-14H,1-2H3/b11-8+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a
KU Leuven Curated by ChEMBL					Assay Description Binding affinity to wild type DNA-tagged human GAK (G13 to Y338 residues) expressed in bacterial expression system by quantitative PCR based KINOMEsc...				Eur J Med Chem 163: 256-265 (2019) Article DOI: 10.1016/j.ejmech.2018.11.065 BindingDB Entry DOI: 10.7270/Q20K2CV0
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