Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Dual specificity protein kinase TTK' and Ligand = 'BDBM251784'   

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
Dual specificity protein kinase TTK (Homo sapiens (Human))	BDBM251784 (US9468642, 28A) Show SMILES O=C(NC1CC1)c1ccc(cc1)-c1cnc2c(nc(cn12)-c1ccccc1)[S@](=O)Cc1ccco1 Show InChI InChI=1S/C27H22N4O3S/c32-26(29-21-12-13-21)20-10-8-19(9-11-20)24-15-28-25-27(35(33)17-22-7-4-14-34-22)30-23(16-31(24)25)18-5-2-1-3-6-18/h1-11,14-16,21H,12-13,17H2,(H,29,32)/t35-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	16.9	n/a	n/a	n/a	n/a	7.7	22
BAYER INTELLECTUAL PROPERTY GMBH US Patent					Assay Description For the assay 50 nl of a 100-fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...				US Patent US9468642 (2016) BindingDB Entry DOI: 10.7270/Q2028QFV
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