Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sialidase-1' and Ligand = 'BDBM50465964'   

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
Sialidase-1 (Homo sapiens (Human))	BDBM50465964 (CHEMBL4279593) Show SMILES [H][C@]1(OC(=C[C@H](O)[C@H]1NC(=O)CCCC)C(O)=O)[C@H](O)[C@H](O)CNC(C)=O |r,c:3| Show InChI InChI=1S/C16H26N2O8/c1-3-4-5-12(22)18-13-9(20)6-11(16(24)25)26-15(13)14(23)10(21)7-17-8(2)19/h6,9-10,13-15,20-21,23H,3-5,7H2,1-2H3,(H,17,19)(H,18,22)(H,24,25)/t9-,10+,13+,14+,15+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	350	n/a	n/a	n/a	n/a	n/a	n/a
University of Alberta Curated by ChEMBL					Assay Description Inhibition of human His6-tagged NEU1 expressed in HEK293 cells using 4MU-NANA as substrate preincubated for 15 mins followed by substrate addition an...				J Med Chem 61: 11261-11279 (2018) Article DOI: 10.1021/acs.jmedchem.8b01411 BindingDB Entry DOI: 10.7270/Q2GF0X5V
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