Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sialidase-1' and Ligand = 'BDBM50465988'   

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))	BDBM50465988 (CHEMBL4291733) Show SMILES [H][C@]1(OC(=C[C@H](O)[C@H]1NC(=O)C1CC1)C(O)=O)[C@H](O)[C@H](O)CO |r,c:3| Show InChI InChI=1S/C13H19NO8/c15-4-7(17)10(18)11-9(14-12(19)5-1-2-5)6(16)3-8(22-11)13(20)21/h3,5-7,9-11,15-18H,1-2,4H2,(H,14,19)(H,20,21)/t6-,7+,9+,10+,11+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.90E+3	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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