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BDBM50469238 CHEMBL4288931

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

InChI Key: InChIKey=FAUJNJKIHJSYDO-YJNKXOJESA-N

Data: 3 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 3 hits for monomerid = 50469238   
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
Beta-galactosidase


(Homo sapiens (Human))
BDBM50469238
PNG
(CHEMBL4288931)
Show SMILES CCCCCCCCC[C@H]1NC[C@@H](O)[C@@H](O)[C@H]1CO |r|
Show InChI InChI=1S/C15H31NO3/c1-2-3-4-5-6-7-8-9-13-12(11-17)15(19)14(18)10-16-13/h12-19H,2-11H2,1H3/t12-,13+,14+,15-/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 0.400n/an/an/an/an/an/a



Universit£ d'Orl£ans & CNRS

Curated by ChEMBL


Assay Description
Inhibition of beta-galactosidase derived from human peripheral blood mononuclear cell lysate using 4-methylumbelliferyl beta-D-galactopyranoside as s...


Bioorg Med Chem 26: 5462-5469 (2018)


Article DOI: 10.1016/j.bmc.2018.09.023
BindingDB Entry DOI: 10.7270/Q2G73HFJ
More data for this
Ligand-Target Pair
Probable maltase-glucoamylase 2


(Homo sapiens)
BDBM50469238
PNG
(CHEMBL4288931)
Show SMILES CCCCCCCCC[C@H]1NC[C@@H](O)[C@@H](O)[C@H]1CO |r|
Show InChI InChI=1S/C15H31NO3/c1-2-3-4-5-6-7-8-9-13-12(11-17)15(19)14(18)10-16-13/h12-19H,2-11H2,1H3/t12-,13+,14+,15-/m0/s1
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Universit£ d'Orl£ans & CNRS

Curated by ChEMBL


Assay Description
Inhibition of alpha-glucosidase derived from human peripheral blood mononuclear cell lysate using 4-methylumbelliferyl alpha-D-glucopyranoside as sub...


Bioorg Med Chem 26: 5462-5469 (2018)


Article DOI: 10.1016/j.bmc.2018.09.023
BindingDB Entry DOI: 10.7270/Q2G73HFJ
More data for this
Ligand-Target Pair
Beta-glucosidase


(Homo sapiens (Human))
BDBM50469238
PNG
(CHEMBL4288931)
Show SMILES CCCCCCCCC[C@H]1NC[C@@H](O)[C@@H](O)[C@H]1CO |r|
Show InChI InChI=1S/C15H31NO3/c1-2-3-4-5-6-7-8-9-13-12(11-17)15(19)14(18)10-16-13/h12-19H,2-11H2,1H3/t12-,13+,14+,15-/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 40n/an/an/an/an/an/a



Universit£ d'Orl£ans & CNRS

Curated by ChEMBL


Assay Description
Inhibition of beta-glucosidase derived from human peripheral blood mononuclear cell lysate using 4-methylumbelliferyl beta-D-glucopyranoside as subst...


Bioorg Med Chem 26: 5462-5469 (2018)


Article DOI: 10.1016/j.bmc.2018.09.023
BindingDB Entry DOI: 10.7270/Q2G73HFJ
More data for this
Ligand-Target Pair