BDBM50168992 3-Bromo-N-{2-[((2R,3R,4S)-3,4-dihydroxy-pyrrolidin-2-ylmethyl)-amino]-2-phenyl-ethyl}-benzamide::CHEMBL193028

SMILES: O[C@H]1CN[C@H](CNC(CNC(=O)c2cccc(Br)c2)c2ccccc2)[C@H]1O

InChI Key: InChIKey=SKFWLOWKPLIHHW-XVLXNVKGSA-N

Data: 1 IC50

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 = 50168992   

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
Alpha-mannosidase (Glycine max)	BDBM50168992 (3-Bromo-N-{2-[((2R,3R,4S)-3,4-dihydroxy-pyrrolidin...) Show SMILES O[C@H]1CN[C@H](CNC(CNC(=O)c2cccc(Br)c2)c2ccccc2)[C@H]1O Show InChI InChI=1S/C20H24BrN3O3/c21-15-8-4-7-14(9-15)20(27)24-10-16(13-5-2-1-3-6-13)22-11-17-19(26)18(25)12-23-17/h1-9,16-19,22-23,25-26H,10-12H2,(H,24,27)/t16?,17-,18+,19-/m1/s1	KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.90E+4	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Chemical Sciences and Engineering Curated by ChEMBL					Assay Description Concentration of compound inhibiting alpha-Mannosidase isolated from Jack bean				J Med Chem 48: 4237-46 (2005) Article DOI: 10.1021/jm0409019 BindingDB Entry DOI: 10.7270/Q24J0DNV
					More data for this Ligand-Target Pair