BDBM50354046 CHEMBL1836312

SMILES: O[C@H](CNC(=O)c1ccccc1)[C@@H](O)[C@@H]1O[C@@](C[C@H](O)[C@H]1NC(=O)CF)(OCc1cccc(F)c1F)C([O-])=O

InChI Key: InChIKey=UEVJIUKQSSBILI-XJQROWKISA-M

Data: 1 Kd

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50354046   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Myelin-associated glycoprotein (Homo sapiens (Human))	BDBM50354046 (CHEMBL1836312) Show SMILES O[C@H](CNC(=O)c1ccccc1)[C@@H](O)[C@@H]1O[C@@](C[C@H](O)[C@H]1NC(=O)CF)(OCc1cccc(F)c1F)C([O-])=O |r| Show InChI InChI=1S/C25H27F3N2O9/c26-10-18(33)30-20-16(31)9-25(24(36)37,38-12-14-7-4-8-15(27)19(14)28)39-22(20)21(34)17(32)11-29-23(35)13-5-2-1-3-6-13/h1-8,16-17,20-22,31-32,34H,9-12H2,(H,29,35)(H,30,33)(H,36,37)/p-1/t16-,17+,20+,21+,22+,25+/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	500	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
					More data for this Ligand-Target Pair