BDBM50442337 CHEMBL2442774

SMILES: C[C@@H]1N[C@H](CC(=O)Nc2c(F)cc(F)cc2F)[C@@H](O)[C@H](O)[C@@H]1O

InChI Key: InChIKey=USDWHJYRVIFTFL-WXGVOPGSSA-N

Data: 3 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 3 hits for monomerid = 50442337   

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-L-fucosidase I (Homo sapiens (Human))	BDBM50442337 (CHEMBL2442774) Show SMILES C[C@@H]1N[C@H](CC(=O)Nc2c(F)cc(F)cc2F)[C@@H](O)[C@H](O)[C@@H]1O |r| Show InChI InChI=1S/C14H17F3N2O4/c1-5-12(21)14(23)13(22)9(18-5)4-10(20)19-11-7(16)2-6(15)3-8(11)17/h2-3,5,9,12-14,18,21-23H,4H2,1H3,(H,19,20)/t5-,9+,12+,13+,14+/m0/s1	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	180	n/a	n/a	n/a	n/a	n/a	n/a
University of Toyama Curated by ChEMBL					Assay Description Inhibition of human lysosome alpha-L-fucosidase using 4-methylumbelliferyl-alpha-L-fucopyranoside by spectrophotometry				Bioorg Med Chem 21: 6565-73 (2013) Article DOI: 10.1016/j.bmc.2013.08.028 BindingDB Entry DOI: 10.7270/Q2G73G5J
					More data for this Ligand-Target Pair
Alpha-L-fucosidase 1 (Bos taurus)	BDBM50442337 (CHEMBL2442774) Show SMILES C[C@@H]1N[C@H](CC(=O)Nc2c(F)cc(F)cc2F)[C@@H](O)[C@H](O)[C@@H]1O |r| Show InChI InChI=1S/C14H17F3N2O4/c1-5-12(21)14(23)13(22)9(18-5)4-10(20)19-11-7(16)2-6(15)3-8(11)17/h2-3,5,9,12-14,18,21-23H,4H2,1H3,(H,19,20)/t5-,9+,12+,13+,14+/m0/s1	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	230	n/a	n/a	n/a	n/a	n/a	n/a
University of Toyama Curated by ChEMBL					Assay Description Inhibition of bovine kidney alpha-L-fucosidase assessed as inhibition of release of p-nitrophenol by spectrophotometry				Bioorg Med Chem 21: 6565-73 (2013) Article DOI: 10.1016/j.bmc.2013.08.028 BindingDB Entry DOI: 10.7270/Q2G73G5J
					More data for this Ligand-Target Pair
Alpha-L-fucosidase I (Rattus norvegicus)	BDBM50442337 (CHEMBL2442774) Show SMILES C[C@@H]1N[C@H](CC(=O)Nc2c(F)cc(F)cc2F)[C@@H](O)[C@H](O)[C@@H]1O |r| Show InChI InChI=1S/C14H17F3N2O4/c1-5-12(21)14(23)13(22)9(18-5)4-10(20)19-11-7(16)2-6(15)3-8(11)17/h2-3,5,9,12-14,18,21-23H,4H2,1H3,(H,19,20)/t5-,9+,12+,13+,14+/m0/s1	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Toyama Curated by ChEMBL					Assay Description Inhibition of rat epididymis alpha-L-fucosidase assessed as inhibition of release of p-nitrophenol by spectrophotometry				Bioorg Med Chem 21: 6565-73 (2013) Article DOI: 10.1016/j.bmc.2013.08.028 BindingDB Entry DOI: 10.7270/Q2G73G5J
					More data for this Ligand-Target Pair