BDBM50341335 CHEMBL1766474::rel-(1R,2S,4R,5S)-6-[[1-(4-Cyclohexylbutyl)-1H-1,2,3-triazol-4-yl]methylamino]cyclohexane-1,2,3,4,5-pentaol

SMILES: O[C@H]1[C@H](O)[C@@H](O)[C@H](NCc2cn(CCCCC3CCCCC3)nn2)[C@@H](O)[C@@H]1O

InChI Key: InChIKey=SCLOQUUDNGPMRM-OXHPVDPFSA-N

Data: 1 KI  6 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 7 hits for monomerid = 50341335   

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))	BDBM50341335 (CHEMBL1766474 | rel-(1R,2S,4R,5S)-6-[[1-(4-Cyclohe...) Show SMILES O[C@H]1[C@H](O)[C@@H](O)[C@H](NCc2cn(CCCCC3CCCCC3)nn2)[C@@H](O)[C@@H]1O |r| Show InChI InChI=1S/C19H34N4O5/c24-15-14(16(25)18(27)19(28)17(15)26)20-10-13-11-23(22-21-13)9-5-4-8-12-6-2-1-3-7-12/h11-12,14-20,24-28H,1-10H2/t14-,15-,16+,17+,18-,19-	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	290	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Spanish National Research Council (Consejo Superior de Investigaciones Cienti£?ficas) Curated by ChEMBL					Assay Description Competitive inhibition of recombinant glucocerebrosidase				J Med Chem 54: 2069-79 (2011) Article DOI: 10.1021/jm101204u BindingDB Entry DOI: 10.7270/Q24F1R18
					More data for this Ligand-Target Pair
α-glucosidase (Saccharomyces cerevisiae S288c (Baker's yeast))	BDBM50341335 (CHEMBL1766474 | rel-(1R,2S,4R,5S)-6-[[1-(4-Cyclohe...) Show SMILES O[C@H]1[C@H](O)[C@@H](O)[C@H](NCc2cn(CCCCC3CCCCC3)nn2)[C@@H](O)[C@@H]1O |r| Show InChI InChI=1S/C19H34N4O5/c24-15-14(16(25)18(27)19(28)17(15)26)20-10-13-11-23(22-21-13)9-5-4-8-12-6-2-1-3-7-12/h11-12,14-20,24-28H,1-10H2/t14-,15-,16+,17+,18-,19-	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Spanish National Research Council (Consejo Superior de Investigaciones Cienti£?ficas) Curated by ChEMBL					Assay Description Inhibition of yeast alpha-glucosidase				J Med Chem 54: 2069-79 (2011) Article DOI: 10.1021/jm101204u BindingDB Entry DOI: 10.7270/Q24F1R18
					More data for this Ligand-Target Pair
Lysosomal acid glucosylceramidase (Homo sapiens (Human))	BDBM50341335 (CHEMBL1766474 | rel-(1R,2S,4R,5S)-6-[[1-(4-Cyclohe...) Show SMILES O[C@H]1[C@H](O)[C@@H](O)[C@H](NCc2cn(CCCCC3CCCCC3)nn2)[C@@H](O)[C@@H]1O |r| Show InChI InChI=1S/C19H34N4O5/c24-15-14(16(25)18(27)19(28)17(15)26)20-10-13-11-23(22-21-13)9-5-4-8-12-6-2-1-3-7-12/h11-12,14-20,24-28H,1-10H2/t14-,15-,16+,17+,18-,19-	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.50E+3	n/a	n/a	n/a	n/a	5.2	n/a
Spanish National Research Council (Consejo Superior de Investigaciones Cienti£?ficas) Curated by ChEMBL					Assay Description Inhibition of recombinant glucocerebrosidase in McIlvaine buffer at pH 5.2 after 10 mins by fluorometric analysis				J Med Chem 54: 2069-79 (2011) Article DOI: 10.1021/jm101204u BindingDB Entry DOI: 10.7270/Q24F1R18
					More data for this Ligand-Target Pair
α-galactosidase (Coffea arabica (Coffee beans))	BDBM50341335 (CHEMBL1766474 | rel-(1R,2S,4R,5S)-6-[[1-(4-Cyclohe...) Show SMILES O[C@H]1[C@H](O)[C@@H](O)[C@H](NCc2cn(CCCCC3CCCCC3)nn2)[C@@H](O)[C@@H]1O |r| Show InChI InChI=1S/C19H34N4O5/c24-15-14(16(25)18(27)19(28)17(15)26)20-10-13-11-23(22-21-13)9-5-4-8-12-6-2-1-3-7-12/h11-12,14-20,24-28H,1-10H2/t14-,15-,16+,17+,18-,19-	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Spanish National Research Council (Consejo Superior de Investigaciones Cienti£?ficas) Curated by ChEMBL					Assay Description Inhibition of alpha-galactosidase from coffee beans				J Med Chem 54: 2069-79 (2011) Article DOI: 10.1021/jm101204u BindingDB Entry DOI: 10.7270/Q24F1R18
					More data for this Ligand-Target Pair
β-galactosidase (Bos taurus (Bovine))	BDBM50341335 (CHEMBL1766474 | rel-(1R,2S,4R,5S)-6-[[1-(4-Cyclohe...) Show SMILES O[C@H]1[C@H](O)[C@@H](O)[C@H](NCc2cn(CCCCC3CCCCC3)nn2)[C@@H](O)[C@@H]1O |r| Show InChI InChI=1S/C19H34N4O5/c24-15-14(16(25)18(27)19(28)17(15)26)20-10-13-11-23(22-21-13)9-5-4-8-12-6-2-1-3-7-12/h11-12,14-20,24-28H,1-10H2/t14-,15-,16+,17+,18-,19-	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Spanish National Research Council (Consejo Superior de Investigaciones Cienti£?ficas) Curated by ChEMBL					Assay Description Inhibition of bovine liver beta-galactosidase				J Med Chem 54: 2069-79 (2011) Article DOI: 10.1021/jm101204u BindingDB Entry DOI: 10.7270/Q24F1R18
					More data for this Ligand-Target Pair
Lysosomal acid glucosylceramidase (Homo sapiens (Human))	BDBM50341335 (CHEMBL1766474 | rel-(1R,2S,4R,5S)-6-[[1-(4-Cyclohe...) Show SMILES O[C@H]1[C@H](O)[C@@H](O)[C@H](NCc2cn(CCCCC3CCCCC3)nn2)[C@@H](O)[C@@H]1O |r| Show InChI InChI=1S/C19H34N4O5/c24-15-14(16(25)18(27)19(28)17(15)26)20-10-13-11-23(22-21-13)9-5-4-8-12-6-2-1-3-7-12/h11-12,14-20,24-28H,1-10H2/t14-,15-,16+,17+,18-,19-	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	300	n/a	n/a	n/a	n/a	7.4	n/a
Spanish National Research Council (Consejo Superior de Investigaciones Cienti£?ficas) Curated by ChEMBL					Assay Description Inhibition of recombinant glucocerebrosidase in McIlvaine buffer at pH 7.4 after 10 mins by fluorometric analysis				J Med Chem 54: 2069-79 (2011) Article DOI: 10.1021/jm101204u BindingDB Entry DOI: 10.7270/Q24F1R18
					More data for this Ligand-Target Pair
Probable alpha-glucosidase Os06g0675700 (Oryza sativa subsp. japonica)	BDBM50341335 (CHEMBL1766474 | rel-(1R,2S,4R,5S)-6-[[1-(4-Cyclohe...) Show SMILES O[C@H]1[C@H](O)[C@@H](O)[C@H](NCc2cn(CCCCC3CCCCC3)nn2)[C@@H](O)[C@@H]1O |r| Show InChI InChI=1S/C19H34N4O5/c24-15-14(16(25)18(27)19(28)17(15)26)20-10-13-11-23(22-21-13)9-5-4-8-12-6-2-1-3-7-12/h11-12,14-20,24-28H,1-10H2/t14-,15-,16+,17+,18-,19-	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Spanish National Research Council (Consejo Superior de Investigaciones Cienti£?ficas) Curated by ChEMBL					Assay Description Inhibition of rice alpha-glucosidase				J Med Chem 54: 2069-79 (2011) Article DOI: 10.1021/jm101204u BindingDB Entry DOI: 10.7270/Q24F1R18
					More data for this Ligand-Target Pair