Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Myelin-associated glycoprotein' and Ligand = 'BDBM50378597'   

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 (Mus musculus)	BDBM50378597 (CHEMBL239255) Show SMILES CC(=O)N[C@@H]1[C@@H](O)C[C@](OCc2ccccc2)(O[C@H]1[C@H](O)[C@H](O)CNC(=O)c1ccc(Cl)cc1)C([O-])=O |r| Show InChI InChI=1S/C25H29ClN2O9/c1-14(29)28-20-18(30)11-25(24(34)35,36-13-15-5-3-2-4-6-15)37-22(20)21(32)19(31)12-27-23(33)16-7-9-17(26)10-8-16/h2-10,18-22,30-32H,11-13H2,1H3,(H,27,33)(H,28,29)(H,34,35)/p-1/t18-,19+,20+,21+,22+,25-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	1.70E+4	n/a	n/a	n/a	n/a	n/a
University of Basel Curated by ChEMBL					Assay Description Binding affinity to mouse MAGd1-3Fc expressed in CHO-Lec 3.2.8.1 cells by SPR analysis				J Med Chem 53: 1597-615 (2010) Article DOI: 10.1021/jm901517k BindingDB Entry DOI: 10.7270/Q2V69KHM
					More data for this Ligand-Target Pair