BDBM50078117 (1R,2R,3R,4S,5R)-4-AMINO-5-(METHYLTHIO)CYCLOPENTANE-1,2,3-TRIOL::(1R,2R,3R,4S,5R)-4-Amino-5-methylsulfanyl-cyclopentane-1,2,3-triol::CHEMBL9623::Mannostatin A, 1::Mannostatin A, 1a

SMILES: CS[C@@H]1[C@@H](N)[C@@H](O)[C@@H](O)[C@H]1O

InChI Key: InChIKey=BLOFGONIVNXZME-YDMGZANHSA-N

Data: 3 KI  1 IC50

PDB links: 2 PDB IDs match this monomer.

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 4 hits for monomerid = 50078117   

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
Golgi alpha-mannosidase II (Drosophila melanogaster (Fruit fly))	BDBM50078117 ((1R,2R,3R,4S,5R)-4-AMINO-5-(METHYLTHIO)CYCLOPENTAN...) Show SMILES CS[C@@H]1[C@@H](N)[C@@H](O)[C@@H](O)[C@H]1O Show InChI InChI=1S/C6H13NO3S/c1-11-6-2(7)3(8)4(9)5(6)10/h2-6,8-10H,7H2,1H3/t2-,3+,4+,5+,6+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid PDB UniChem Similars	MMDB PDB Article PubMed	36	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Toronto					Assay Description The rate of hydrolysis catalyzed by drosophila golgi alpha-mannosidase II (dGMII)and in the presence of different concentration of inhibitor was meas...				Chembiochem 10: 268-77 (2009) Article DOI: 10.1002/cbic.200800538 BindingDB Entry DOI: 10.7270/Q2DZ06T7
					More data for this Ligand-Target Pair				3D Structure (crystal)
Golgi alpha-mannosidase II (Homo sapiens (Human))	BDBM50078117 ((1R,2R,3R,4S,5R)-4-AMINO-5-(METHYLTHIO)CYCLOPENTAN...) Show SMILES CS[C@@H]1[C@@H](N)[C@@H](O)[C@@H](O)[C@H]1O Show InChI InChI=1S/C6H13NO3S/c1-11-6-2(7)3(8)4(9)5(6)10/h2-6,8-10H,7H2,1H3/t2-,3+,4+,5+,6+/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid PDB UniChem Similars	Article PubMed	90	-9.99	n/a	n/a	n/a	n/a	n/a	5.6	37
University of Georgia									Chembiochem 5: 1220-7 (2004) Article DOI: 10.1002/cbic.200300842 BindingDB Entry DOI: 10.7270/Q2ZW1JF3
					More data for this Ligand-Target Pair
Golgi alpha-mannosidase II (Homo sapiens (Human))	BDBM50078117 ((1R,2R,3R,4S,5R)-4-AMINO-5-(METHYLTHIO)CYCLOPENTAN...) Show SMILES CS[C@@H]1[C@@H](N)[C@@H](O)[C@@H](O)[C@H]1O Show InChI InChI=1S/C6H13NO3S/c1-11-6-2(7)3(8)4(9)5(6)10/h2-6,8-10H,7H2,1H3/t2-,3+,4+,5+,6+/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid PDB UniChem Similars	Article PubMed	210	-9.47	n/a	n/a	n/a	n/a	n/a	5.6	37
University of Georgia									Chembiochem 5: 1220-7 (2004) Article DOI: 10.1002/cbic.200300842 BindingDB Entry DOI: 10.7270/Q2ZW1JF3
					More data for this Ligand-Target Pair
Mannosyl-oligosaccharide alpha-1,2-mannosidase isoform B (Drosophila melanogaster)	BDBM50078117 ((1R,2R,3R,4S,5R)-4-AMINO-5-(METHYLTHIO)CYCLOPENTAN...) Show SMILES CS[C@@H]1[C@@H](N)[C@@H](O)[C@@H](O)[C@H]1O Show InChI InChI=1S/C6H13NO3S/c1-11-6-2(7)3(8)4(9)5(6)10/h2-6,8-10H,7H2,1H3/t2-,3+,4+,5+,6+/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	150	n/a	n/a	n/a	n/a	n/a	n/a
Slovak Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of Drosophila melanogaster GM2b by spectrophotometry				Eur J Med Chem 46: 944-52 (2011) Article DOI: 10.1016/j.ejmech.2011.01.012 BindingDB Entry DOI: 10.7270/Q2MS3TQM
					More data for this Ligand-Target Pair