BDBM50100428 6-(5-Dimethylamino-naphthalene-1-sulfonylamino)-hexanoic acid ((3S,4S,5R)-3,4-dihydroxy-5-hydroxymethyl-pyrrolidin-2-ylmethyl)-amide::CHEMBL27760::CHEMBL3349997

SMILES: CN(C)c1cccc2c(cccc12)S(=O)(=O)NCCCCCC(=O)NC[C@H]1N[C@H](CO)[C@H](O)[C@@H]1O

InChI Key: InChIKey=BPGCXGNVVKXISM-RJXMBQSPSA-N

Data: 1 KI

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 = 50100428   

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))	BDBM50100428 (6-(5-Dimethylamino-naphthalene-1-sulfonylamino)-he...) Show SMILES CN(C)c1cccc2c(cccc12)S(=O)(=O)NCCCCCC(=O)NC[C@H]1N[C@H](CO)[C@H](O)[C@@H]1O Show InChI InChI=1S/C24H36N4O6S/c1-28(2)20-10-6-9-17-16(20)8-7-11-21(17)35(33,34)26-13-5-3-4-12-22(30)25-14-18-23(31)24(32)19(15-29)27-18/h6-11,18-19,23-24,26-27,29,31-32H,3-5,12-15H2,1-2H3,(H,25,30)/t18-,19-,23?,24+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2.10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institut für Biochemie der Technischen Universität Graz Curated by ChEMBL					Assay Description Inhibitory activity against Agrobacterium sp. Beta-glucosidase employing fluorescence spectrometric method				Bioorg Med Chem Lett 11: 1339-42 (2001) BindingDB Entry DOI: 10.7270/Q2JQ1097
					More data for this Ligand-Target Pair