BindingDB PrimarySearch

BDBM50182798 (3R,4r,5S)-piperidine-3,4,5-triol::1,5-Dideoxy-1,5-imino-D-xylitol::CHEMBL110830::PIPERIDINE-3,4,5-TRIOL

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

InChI Key: InChIKey=RMCNETIHECSPMZ-SCDXWVJYSA-N

Data: 4 KI 7 IC50

PDB links: 3 PDB IDs match this monomer.

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 11 hits for monomerid = 50182798
Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	k_off s^-1	k_on M^-1s^-1	pH	Temp °C
Lysosomal acid glucosylceramidase (Homo sapiens (Human))	BDBM50182798 ((3R,4r,5S)-piperidine-3,4,5-triol \| 1,5-Dideoxy-1,...) Show SMILES O[C@H]1CNC[C@@H](O)[C@@H]1O \|r\| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	1.30E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Technical University Graz Curated by ChEMBL					Assay Description Inhibition of human lysosomal beta-glucocerebrosidase				Bioorg Med Chem Lett 24: 2777-80 (2014) Article DOI: 10.1016/j.bmcl.2014.03.069 BindingDB Entry DOI: 10.7270/Q2RV0Q8B
Technical University Graz Curated by ChEMBL					More data for this Ligand-Target Pair
Lysosomal acid glucosylceramidase (Homo sapiens (Human))	BDBM50182798 ((3R,4r,5S)-piperidine-3,4,5-triol \| 1,5-Dideoxy-1,...) Show SMILES O[C@H]1CNC[C@@H](O)[C@@H]1O \|r\| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	2.80E+3	n/a	n/a	n/a	n/a	n/a	n/a	5.0	n/a
University of British Columbia Curated by ChEMBL					Assay Description Competitive inhibition of wild type human glucocerebrosidase using 2,4-dinitrophenyl beta-D-glucopyranoside as substrate after 3 mins by Dixon and Li...				J Med Chem 55: 2737-45 (2012) Article DOI: 10.1021/jm201633y BindingDB Entry DOI: 10.7270/Q2639QSX
University of British Columbia Curated by ChEMBL					More data for this Ligand-Target Pair
Beta-glucosidase (Agrobacterium tumefaciens)	BDBM50182798 ((3R,4r,5S)-piperidine-3,4,5-triol \| 1,5-Dideoxy-1,...) Show SMILES O[C@H]1CNC[C@@H](O)[C@@H]1O \|r\| Show InChI	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Technical University Graz Curated by ChEMBL					Assay Description Inhibition of Agrobacterium sp. beta glucosidase				Bioorg Med Chem Lett 24: 2777-80 (2014) Article DOI: 10.1016/j.bmcl.2014.03.069 BindingDB Entry DOI: 10.7270/Q2RV0Q8B
Technical University Graz Curated by ChEMBL					More data for this Ligand-Target Pair
Beta-xylosidase (Thermoanaerobacter saccharolyticum)	BDBM50182798 ((3R,4r,5S)-piperidine-3,4,5-triol \| 1,5-Dideoxy-1,...) Show SMILES O[C@H]1CNC[C@@H](O)[C@@H]1O \|r\| Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	2.06E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Technische Universität Graz Curated by ChEMBL					Assay Description Inhibition of Thermoanaerobacterium saccharolyticum beta-xylosidase				Bioorg Med Chem Lett 16: 2067-70 (2006) Article DOI: 10.1016/j.bmcl.2006.01.095 BindingDB Entry DOI: 10.7270/Q26Q1WV2
Technische Universität Graz Curated by ChEMBL					More data for this Ligand-Target Pair
Alpha-L-fucosidase I (Homo sapiens (Human))	BDBM50182798 ((3R,4r,5S)-piperidine-3,4,5-triol \| 1,5-Dideoxy-1,...) Show SMILES O[C@H]1CNC[C@@H](O)[C@@H]1O \|r\| Show InChI	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid PDB UniChem Patents Similars	Article	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was evaluated for inhibition of alpha-fucosidase from bovine kidney(sigma F 5884).				Bioorg Med Chem Lett 6: 553-558 (1996) Article DOI: 10.1016/0960-894X(96)00068-6 BindingDB Entry DOI: 10.7270/Q2ZS2WHG
TBA Curated by ChEMBL					More data for this Ligand-Target Pair
Lysosomal acid glucosylceramidase (Homo sapiens (Human))	BDBM50182798 ((3R,4r,5S)-piperidine-3,4,5-triol \| 1,5-Dideoxy-1,...) Show SMILES O[C@H]1CNC[C@@H](O)[C@@H]1O \|r\| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	2.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Hokuriku University Curated by ChEMBL					Assay Description Inhibition of human lysosomal beta-glucosidase				Bioorg Med Chem 16: 7330-6 (2008) Article DOI: 10.1016/j.bmc.2008.06.026 BindingDB Entry DOI: 10.7270/Q27D2W2B
Hokuriku University Curated by ChEMBL					More data for this Ligand-Target Pair
Beta-galactosidase (Homo sapiens (Human))	BDBM50182798 ((3R,4r,5S)-piperidine-3,4,5-triol \| 1,5-Dideoxy-1,...) Show SMILES O[C@H]1CNC[C@@H](O)[C@@H]1O \|r\| Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid PDB UniChem Patents Similars	Article	n/a	n/a	4.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was evaluated for inhibition of beta-galactosidase from aspergillus oryzae (sigma G 7256).				Bioorg Med Chem Lett 6: 553-558 (1996) Article DOI: 10.1016/0960-894X(96)00068-6 BindingDB Entry DOI: 10.7270/Q2ZS2WHG
TBA Curated by ChEMBL					More data for this Ligand-Target Pair
Lysosomal acid glucosylceramidase (Homo sapiens (Human))	BDBM50182798 ((3R,4r,5S)-piperidine-3,4,5-triol \| 1,5-Dideoxy-1,...) Show SMILES O[C@H]1CNC[C@@H](O)[C@@H]1O \|r\| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid PDB UniChem Patents Similars	Article	n/a	n/a	8.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was evaluated for inhibition of beta-glucosidase from almonds(sigma G 4511).				Bioorg Med Chem Lett 6: 553-558 (1996) Article DOI: 10.1016/0960-894X(96)00068-6 BindingDB Entry DOI: 10.7270/Q2ZS2WHG
TBA Curated by ChEMBL					More data for this Ligand-Target Pair
Alpha-mannosidase (Glycine max)	BDBM50182798 ((3R,4r,5S)-piperidine-3,4,5-triol \| 1,5-Dideoxy-1,...) Show SMILES O[C@H]1CNC[C@@H](O)[C@@H]1O \|r\| Show InChI	KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid PDB UniChem Patents Similars	Article	n/a	n/a	3.60E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of jack bean alpha-mannosidase				Bioorg Med Chem Lett 6: 553-558 (1996) Article DOI: 10.1016/0960-894X(96)00068-6 BindingDB Entry DOI: 10.7270/Q2ZS2WHG
TBA Curated by ChEMBL					More data for this Ligand-Target Pair
Lysosomal alpha-glucosidase (Homo sapiens (Human))	BDBM50182798 ((3R,4r,5S)-piperidine-3,4,5-triol \| 1,5-Dideoxy-1,...) Show SMILES O[C@H]1CNC[C@@H](O)[C@@H]1O \|r\| Show InChI	PDB NCI pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid PDB UniChem Patents Similars	Article	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was evaluated for inhibition of alpha-glucosidase from yeast(sigma G 7256).				Bioorg Med Chem Lett 6: 553-558 (1996) Article DOI: 10.1016/0960-894X(96)00068-6 BindingDB Entry DOI: 10.7270/Q2ZS2WHG
TBA Curated by ChEMBL					More data for this Ligand-Target Pair
Alpha-glucosidase A (α-Gal A) (Homo sapiens (Human))	BDBM50182798 ((3R,4r,5S)-piperidine-3,4,5-triol \| 1,5-Dideoxy-1,...) Show SMILES O[C@H]1CNC[C@@H](O)[C@@H]1O \|r\| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid PDB UniChem Patents Similars	Article	n/a	n/a	4.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was evaluated for inhibition of alpha-galactosidase from green coffee beans (sigma G 8507).				Bioorg Med Chem Lett 6: 553-558 (1996) Article DOI: 10.1016/0960-894X(96)00068-6 BindingDB Entry DOI: 10.7270/Q2ZS2WHG
TBA Curated by ChEMBL					More data for this Ligand-Target Pair