BDBM50507942 CHEMBL4527281

SMILES: COc1ccc(O)cc1-c1ccccc1O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1NC(C)=O

InChI Key: InChIKey=DADHMTNJWRVFAB-YMQHIKHWSA-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 = 50507942   

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
Type 1 fimbrin D-mannose specific adhesin (Escherichia coli (strain K12))	BDBM50507942 (CHEMBL4527281) Show SMILES COc1ccc(O)cc1-c1ccccc1O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1NC(C)=O |r| Show InChI InChI=1S/C21H25NO8/c1-11(24)22-18-20(27)19(26)17(10-23)30-21(18)29-16-6-4-3-5-13(16)14-9-12(25)7-8-15(14)28-2/h3-9,17-21,23,25-27H,10H2,1-2H3,(H,22,24)/t17-,18-,19+,20-,21-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	510	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Inhibition of Escherichia coli C-terminal 6x-His-tagged biotinylated FmlH lectin domain expressed in Escherichia coli periplasm assessed as reduction...				J Med Chem 62: 467-479 (2019) Article DOI: 10.1021/acs.jmedchem.8b01561
					More data for this Ligand-Target Pair