Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Alpha-synuclein' and Ligand = 'BDBM170565'   

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
Alpha-synuclein (Homo sapiens (Human))	BDBM170565 (US9085549, 83) Show SMILES CC(=O)Oc1ccc(cc1OC(C)=O)-c1nnc(s1)-c1cc(OC(C)=O)c(OC(C)=O)cc1I Show InChI InChI=1S/C22H17IN2O8S/c1-10(26)30-17-6-5-14(7-18(17)31-11(2)27)21-24-25-22(34-21)15-8-19(32-12(3)28)20(9-16(15)23)33-13(4)29/h5-9H,1-4H3	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	330	n/a	n/a	n/a	n/a	n/a	n/a	7.4	n/a
PROTEOTECH INC US Patent					Assay Description The compounds prepared in the preceding examples were found to bind with high affinity to α-synuclein aggregates/fibrils that are found in the h...				US Patent US9085549 (2015) BindingDB Entry DOI: 10.7270/Q2WD3Z9K
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