Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'ALK tyrosine kinase receptor' and Ligand = 'BDBM175243'   

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
ALK tyrosine kinase receptor (Homo sapiens (Human))	BDBM175243 (US9115140, I-7) Show SMILES COc1cc(ccc1Nc1ncc2sc(C(N)=O)c(-c3ccccc3)c2n1)N1CCN(CC1)C(C)C Show InChI InChI=1S/C27H30N6O2S/c1-17(2)32-11-13-33(14-12-32)19-9-10-20(21(15-19)35-3)30-27-29-16-22-24(31-27)23(25(36-22)26(28)34)18-7-5-4-6-8-18/h4-10,15-17H,11-14H2,1-3H3,(H2,28,34)(H,29,30,31)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	28	n/a	n/a	n/a	n/a	n/a	n/a
SANOFI US Patent					Assay Description The reagents used have the following composition: Enzyme buffer (EB): 50 mM HEPES (pH: 7.0) (Sigma H7523), 100 mM NaCl (Sigma S7653), NaN.sub.3 at 0....				US Patent US9115140 (2015) BindingDB Entry DOI: 10.7270/Q2HX1BFX
					More data for this Ligand-Target Pair