Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cyclin-G-associated kinase' and Ligand = 'BDBM50538883'   

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))	BDBM50538883 (CHEMBL4634338) Show SMILES COc1cc(Nc2cnc3c(snc3c2)N2C[C@H](C)O[C@H](C)C2)cc(OC)c1OC |r| Show InChI InChI=1S/C21H26N4O4S/c1-12-10-25(11-13(2)29-12)21-19-16(24-30-21)6-15(9-22-19)23-14-7-17(26-3)20(28-5)18(8-14)27-4/h6-9,12-13,23H,10-11H2,1-5H3/t12-,13+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	458	n/a	n/a	n/a	n/a	n/a	n/a
KU Leuven Curated by ChEMBL					Assay Description Inhibition of tracer 222 binding to recombinant human GST-tagged GAK (1 to 329 residues) expressed in insect cells incubated for 1 hr by Lanthascreen...				Bioorg Med Chem 28: (2020) Article DOI: 10.1016/j.bmc.2019.115188 BindingDB Entry DOI: 10.7270/Q2TM7FNT
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