BDBM50279834 (2R,3S,4R,5S)-2-(hydroxymethyl)oxane-3,4,5-triol::1,5-anhydro-D-glucitol::CHEMBL344637

SMILES: OC[C@H]1OC[C@H](O)[C@@H](O)[C@@H]1O

InChI Key: InChIKey=MPCAJMNYNOGXPB-SLPGGIOYSA-N

Data: 2 KI

PDB links: 10 PDB IDs match this monomer.

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 2 hits for monomerid = 50279834   

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
Beta-glucosidase (Prunus avium)	BDBM50279834 ((2R,3S,4R,5S)-2-(hydroxymethyl)oxane-3,4,5-triol |...) Show SMILES OC[C@H]1OC[C@H](O)[C@@H](O)[C@@H]1O Show InChI InChI=1S/C6H12O5/c7-1-4-6(10)5(9)3(8)2-11-4/h3-10H,1-2H2/t3-,4+,5+,6+/m0/s1	UniProtKB/TrEMBL GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article	6.00E+7	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Binding affinity towards sweet almond Beta-glucosidase				Bioorg Med Chem Lett 1: 667-672 (1991) Article DOI: 10.1016/S0960-894X(01)81044-1 BindingDB Entry DOI: 10.7270/Q26W9BKM
					More data for this Ligand-Target Pair
Beta-galactosidase (Escherichia coli)	BDBM50279834 ((2R,3S,4R,5S)-2-(hydroxymethyl)oxane-3,4,5-triol |...) Show SMILES OC[C@H]1OC[C@H](O)[C@@H](O)[C@@H]1O Show InChI InChI=1S/C6H12O5/c7-1-4-6(10)5(9)3(8)2-11-4/h3-10H,1-2H2/t3-,4+,5+,6+/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article	7.10E+7	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity towards E-coli Beta-galactosidase				Bioorg Med Chem Lett 1: 667-672 (1991) Article DOI: 10.1016/S0960-894X(01)81044-1 BindingDB Entry DOI: 10.7270/Q26W9BKM
					More data for this Ligand-Target Pair