Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Neuraminidase' and Ligand = 'BDBM50526913'   

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
Neuraminidase (Influenza A virus (strain A/Memphis/1/1971 H3N2))	BDBM50526913 (CHEMBL4456723) Show SMILES CCC(CC)O[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(=O)NCc1cn(Cc2ccc(cc2)C#N)nn1 |r,c:7| Show InChI InChI=1S/C25H33N7O3/c1-4-21(5-2)35-23-11-19(10-22(27)24(23)29-16(3)33)25(34)28-13-20-15-32(31-30-20)14-18-8-6-17(12-26)7-9-18/h6-9,11,15,21-24H,4-5,10,13-14,27H2,1-3H3,(H,28,34)(H,29,33)/t22-,23+,24+/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.96E+3	n/a	n/a	n/a	n/a	n/a	n/a
Shandong University Curated by ChEMBL					Assay Description Inhibition of Influenza A virus (A/Chicken/Hebei/LZF/2014(H5N2)) Neuraminidase N2 preincubated for 10 mins followed by MUNANA substrate addition and ...				Eur J Med Chem 187: (2020) Article DOI: 10.1016/j.ejmech.2019.111940 BindingDB Entry DOI: 10.7270/Q26Q21PV
					More data for this Ligand-Target Pair
Neuraminidase (Influenza A virus (A/Puerto Rico/8/34/Mount Sinai(...)	BDBM50526913 (CHEMBL4456723) Show SMILES CCC(CC)O[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(=O)NCc1cn(Cc2ccc(cc2)C#N)nn1 |r,c:7| Show InChI InChI=1S/C25H33N7O3/c1-4-21(5-2)35-23-11-19(10-22(27)24(23)29-16(3)33)25(34)28-13-20-15-32(31-30-20)14-18-8-6-17(12-26)7-9-18/h6-9,11,15,21-24H,4-5,10,13-14,27H2,1-3H3,(H,28,34)(H,29,33)/t22-,23+,24+/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.72E+3	n/a	n/a	n/a	n/a	n/a	n/a
Shandong University Curated by ChEMBL					Assay Description Inhibition of Influenza A virus (A/goose/Guangdong/SH7/2013(H5N1)) Neuraminidase N1 preincubated for 10 mins followed by MUNANA substrate addition an...				Eur J Med Chem 187: (2020) Article DOI: 10.1016/j.ejmech.2019.111940 BindingDB Entry DOI: 10.7270/Q26Q21PV
					More data for this Ligand-Target Pair