Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Myelin-associated glycoprotein' and Ligand = 'BDBM50354048'   

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
Myelin-associated glycoprotein (Homo sapiens (Human))	BDBM50354048 (CHEMBL1836307) Show SMILES CC(=O)N[C@@H]1[C@@H](O)C[C@@](O[C@H]2[C@@H](O)[C@@H](CO)O[C@@H](O[C@H]3[C@@H](O)[C@@H](CO)O[C@@H](OCC[Si](C)(C)C)[C@@H]3NC(C)=O)[C@@H]2O)(O[C@H]1[C@H](O)[C@H](O)CO)C([O-])=O |r| Show InChI InChI=1S/C30H54N2O19Si/c1-12(36)31-18-14(38)8-30(29(44)45,50-25(18)20(40)15(39)9-33)51-26-22(42)17(11-35)48-28(23(26)43)49-24-19(32-13(2)37)27(46-6-7-52(3,4)5)47-16(10-34)21(24)41/h14-28,33-35,38-43H,6-11H2,1-5H3,(H,31,36)(H,32,37)(H,44,45)/p-1/t14-,15+,16+,17+,18+,19+,20+,21-,22-,23+,24+,25+,26-,27+,28-,30-/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	1.80E+5	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Binding affinity to MAG				Bioorg Med Chem Lett 21: 5045-9 (2011) Article DOI: 10.1016/j.bmcl.2011.04.068 BindingDB Entry DOI: 10.7270/Q2WD40ZW
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