BDBM50166777 6-(4-Phenoxy-benzylamino)-cyclohex-4-ene-1,2,3-triol::CHEMBL372865

SMILES: OC1C=CC(NCc2ccc(Oc3ccccc3)cc2)C(O)C1O

InChI Key: InChIKey=YNNCSTZOAWTUPJ-UHFFFAOYSA-N

Data: 1 IC50

PDB links: 1 PDB ID matches 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 1 hit for monomerid = 50166777   

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 A (Caldocellum saccharolyticum)	BDBM50166777 (6-(4-Phenoxy-benzylamino)-cyclohex-4-ene-1,2,3-tri...) Show SMILES OC1C=CC(NCc2ccc(Oc3ccccc3)cc2)C(O)C1O |c:2| Show InChI InChI=1S/C19H21NO4/c21-17-11-10-16(18(22)19(17)23)20-12-13-6-8-15(9-7-13)24-14-4-2-1-3-5-14/h1-11,16-23H,12H2	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	5.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
Ecole Polytechnique Fédérale de Lausanne (EPFL) Curated by ChEMBL					Assay Description Inhibitory concentration against Beta Glucosidase from Caldocellum saccharolyticum				Bioorg Med Chem Lett 15: 3071-5 (2005) Article DOI: 10.1016/j.bmcl.2005.04.023 BindingDB Entry DOI: 10.7270/Q2222T86
					More data for this Ligand-Target Pair