BDBM108417 US8604206, 6

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

InChI Key: InChIKey=QSMPJEGWIQSKCL-VPENINKCSA-N

Data: 2 KI  2 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 2 hits for monomerid = 108417   

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
Lysosomal acid glucosylceramidase (Homo sapiens (Human))	BDBM108417 (US8604206, 6) Show SMILES O[C@@H]1CNC[C@H](C(F)F)[C@H]1O Show InChI InChI=1S/C6H11F2NO2/c7-6(8)3-1-9-2-4(10)5(3)11/h3-6,9-11H,1-2H2/t3-,4+,5+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	3.06	n/a	5.80	n/a	n/a	n/a	n/a	7.0	n/a
Amicus Therapeutics, Inc. US Patent					Assay Description The enzyme inhibition assays used monitored the ability of a test compound to bind and prevent the hydrolysis of a fluorogenic substrate in a concent...				US Patent US8604206 (2013) BindingDB Entry DOI: 10.7270/Q2MS3RDR
					More data for this Ligand-Target Pair
Lysosomal acid glucosylceramidase (Homo sapiens (Human))	BDBM108417 (US8604206, 6) Show SMILES O[C@@H]1CNC[C@H](C(F)F)[C@H]1O Show InChI InChI=1S/C6H11F2NO2/c7-6(8)3-1-9-2-4(10)5(3)11/h3-6,9-11H,1-2H2/t3-,4+,5+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	13.6	n/a	25.9	n/a	n/a	n/a	n/a	5.2	n/a
Amicus Therapeutics, Inc. US Patent					Assay Description The enzyme inhibition assays used monitored the ability of a test compound to bind and prevent the hydrolysis of a fluorogenic substrate in a concent...				US Patent US8604206 (2013) BindingDB Entry DOI: 10.7270/Q2MS3RDR
					More data for this Ligand-Target Pair