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BDBM50204609 CHEMBL3985941

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

InChI Key: InChIKey=NJOZFAFEQVQFJI-MOJAZDJTSA-N

Data: 2 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50204609   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Alpha-galactosidase A


(Homo sapiens (Human))
BDBM50204609
PNG
(CHEMBL3985941)
Show SMILES NC[C@H]1N[C@@H](CO)[C@H](O)[C@@H]1O |r|
Show InChI InChI=1S/C6H14N2O3/c7-1-3-5(10)6(11)4(2-9)8-3/h3-6,8-11H,1-2,7H2/t3-,4+,5-,6+/m1/s1
PDB
MMDB

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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.40E+4n/an/an/an/a7.0n/a



National Cheng-Kung University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant lysosomal alpha GAL-A using 4-methylberiilyl alpha-D-galactopyranoside as substrate at pH 7 after 15 mins by fluoresc...


Eur J Med Chem 123: 14-20 (2016)


Article DOI: 10.1016/j.ejmech.2016.07.025
BindingDB Entry DOI: 10.7270/Q2RB76KN
More data for this
Ligand-Target Pair
Alpha-galactosidase A


(Homo sapiens (Human))
BDBM50204609
PNG
(CHEMBL3985941)
Show SMILES NC[C@H]1N[C@@H](CO)[C@H](O)[C@@H]1O |r|
Show InChI InChI=1S/C6H14N2O3/c7-1-3-5(10)6(11)4(2-9)8-3/h3-6,8-11H,1-2,7H2/t3-,4+,5-,6+/m1/s1
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/an/a 2.66E+5n/an/an/an/a4.6n/a



National Cheng-Kung University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant lysosomal alpha GAL-A using 4-methylberiilyl alpha-D-galactopyranoside as substrate at pH 4.6 after 10 mins by fluore...


Eur J Med Chem 123: 14-20 (2016)


Article DOI: 10.1016/j.ejmech.2016.07.025
BindingDB Entry DOI: 10.7270/Q2RB76KN
More data for this
Ligand-Target Pair