Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Galectin-3' and Ligand = 'BDBM50272417'   

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
Galectin-3 (Homo sapiens (Human))	BDBM50272417 (CHEMBL522064 | Dimeric galactoside) Show SMILES OC[C@H]1O[C@@H](SCC#CC#CCS[C@H]2O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@H]1O |r| Show InChI InChI=1S/C18H26O10S2/c19-7-9-11(21)13(23)15(25)17(27-9)29-5-3-1-2-4-6-30-18-16(26)14(24)12(22)10(8-20)28-18/h9-26H,5-8H2/t9-,10+,11+,12-,13-,14-,15-,16+,17+,18-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ du Qu£bec£ Montr£al Curated by ChEMBL					Assay Description Inhibition of recombinant galectin 3 in human O type red blood cells by hemagglutination assay				Bioorg Med Chem 16: 7811-23 (2008) Article DOI: 10.1016/j.bmc.2008.06.044 BindingDB Entry DOI: 10.7270/Q2HQ40TS
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