BDBM50168993 (2R,3R,4S)-2-(Benzylamino-methyl)-pyrrolidine-3,4-diol::CHEMBL363475

SMILES: O[C@H]1CN[C@H](CNCc2ccccc2)[C@H]1O

InChI Key: InChIKey=SXQQUIDMNYCBEU-GRYCIOLGSA-N

Data: 3 KI  1 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 4 hits for monomerid = 50168993   

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
Alpha-mannosidase (Glycine max)	BDBM50168993 ((2R,3R,4S)-2-(Benzylamino-methyl)-pyrrolidine-3,4-...) Show SMILES O[C@H]1CN[C@H](CNCc2ccccc2)[C@H]1O Show InChI InChI=1S/C12H18N2O2/c15-11-8-14-10(12(11)16)7-13-6-9-4-2-1-3-5-9/h1-5,10-16H,6-8H2/t10-,11+,12-/m1/s1	KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	7.40E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Chemical Sciences and Engineering Curated by ChEMBL					Assay Description Binding affinity towards alpha-Mannosidase isolated from Jack bean				J Med Chem 48: 4237-46 (2005) Article DOI: 10.1021/jm0409019 BindingDB Entry DOI: 10.7270/Q24J0DNV
					More data for this Ligand-Target Pair
Endoplasmic reticulum mannosyl-oligosaccharide 1,2-alpha-mannosidase (Homo sapiens (Human))	BDBM50168993 ((2R,3R,4S)-2-(Benzylamino-methyl)-pyrrolidine-3,4-...) Show SMILES O[C@H]1CN[C@H](CNCc2ccccc2)[C@H]1O Show InChI InChI=1S/C12H18N2O2/c15-11-8-14-10(12(11)16)7-13-6-9-4-2-1-3-5-9/h1-5,10-16H,6-8H2/t10-,11+,12-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.50E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universidade do Porto 687 Curated by ChEMBL					Assay Description Inhibition of human ER alpha mannosidase 1				Bioorg Med Chem 20: 6945-59 (2012) Article DOI: 10.1016/j.bmc.2012.10.011 BindingDB Entry DOI: 10.7270/Q26T0NTC
					More data for this Ligand-Target Pair
Golgi alpha-mannosidase II (Homo sapiens (Human))	BDBM50168993 ((2R,3R,4S)-2-(Benzylamino-methyl)-pyrrolidine-3,4-...) Show SMILES O[C@H]1CN[C@H](CNCc2ccccc2)[C@H]1O Show InChI InChI=1S/C12H18N2O2/c15-11-8-14-10(12(11)16)7-13-6-9-4-2-1-3-5-9/h1-5,10-16H,6-8H2/t10-,11+,12-/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.52E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universidade do Porto 687 Curated by ChEMBL					Assay Description Inhibition of human golgi alpha mannosidase 2				Bioorg Med Chem 20: 6945-59 (2012) Article DOI: 10.1016/j.bmc.2012.10.011 BindingDB Entry DOI: 10.7270/Q26T0NTC
					More data for this Ligand-Target Pair
Alpha-mannosidase (Glycine max)	BDBM50168993 ((2R,3R,4S)-2-(Benzylamino-methyl)-pyrrolidine-3,4-...) Show SMILES O[C@H]1CN[C@H](CNCc2ccccc2)[C@H]1O Show InChI InChI=1S/C12H18N2O2/c15-11-8-14-10(12(11)16)7-13-6-9-4-2-1-3-5-9/h1-5,10-16H,6-8H2/t10-,11+,12-/m1/s1	KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Chemical Sciences and Engineering Curated by ChEMBL					Assay Description Concentration of compound inhibiting alpha-Mannosidase isolated from Jack bean				J Med Chem 48: 4237-46 (2005) Article DOI: 10.1021/jm0409019 BindingDB Entry DOI: 10.7270/Q24J0DNV
					More data for this Ligand-Target Pair