BDBM103990 LecB Inhibitor Amides 4a

SMILES: COC1O[C@H](CNC(C)=O)[C@@H](O)C(O)[C@@H]1O

InChI Key: InChIKey=STALKXWWDPBKMN-FPVFMCGLSA-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 = 103990   

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
Fucose-binding lectin PA-IIL (Pseudomonas aeruginosa)	BDBM103990 (LecB Inhibitor Amides 4a) Show SMILES COC1O[C@H](CNC(C)=O)[C@@H](O)C(O)[C@@H]1O |r| Show InChI InChI=1S/C9H17NO6/c1-4(11)10-3-5-6(12)7(13)8(14)9(15-2)16-5/h5-9,12-14H,3H2,1-2H3,(H,10,11)/t5-,6-,7?,8+,9?/m1/s1	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.81E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Konstanz									ACS Chem Biol 8: 1775-84 (2013) Article DOI: 10.1021/cb400371r BindingDB Entry DOI: 10.7270/Q21J98C3
					More data for this Ligand-Target Pair