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BDBM113760 pF PhIM-DGJ

SMILES: O[C@H]1CN2C(CS\C2=N\c2ccc(F)cc2)[C@H](O)[C@@H]1O

InChI Key: InChIKey=MGLWTDDSOAWQQT-PWEZBQRCSA-N

Data: 2 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 2 hits for monomerid = 113760   
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-glucosidase A (α-Gal A)


(Homo sapiens (Human))
BDBM113760
PNG
(pF PhIM-DGJ)
Show SMILES O[C@H]1CN2C(CS\C2=N\c2ccc(F)cc2)[C@H](O)[C@@H]1O
Show InChI InChI=1S/C13H15FN2O3S/c14-7-1-3-8(4-2-7)15-13-16-5-10(17)12(19)11(18)9(16)6-20-13/h1-4,9-12,17-19H,5-6H2/b15-13+/t9?,10-,11-,12+/m0/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.18E+3n/an/an/an/a7.0n/a



Tottori University , Yonago 683-8503, Japan



Assay Description
For inhibition assay, 0.1% Triton X-100 extracts were mixed with 4-MU substrates ( 5 mM 4-MU α-ᴅ-galactopyranoside and 0.1 M N-acetyl-J...


ACS Chem Biol 9: 1460-9 (2014)


Article DOI: 10.1021/cb500143h
BindingDB Entry DOI: 10.7270/Q2XS5T16
More data for this
Ligand-Target Pair
Alpha-glucosidase A (α-Gal A)


(Homo sapiens (Human))
BDBM113760
PNG
(pF PhIM-DGJ)
Show SMILES O[C@H]1CN2C(CS\C2=N\c2ccc(F)cc2)[C@H](O)[C@@H]1O
Show InChI InChI=1S/C13H15FN2O3S/c14-7-1-3-8(4-2-7)15-13-16-5-10(17)12(19)11(18)9(16)6-20-13/h1-4,9-12,17-19H,5-6H2/b15-13+/t9?,10-,11-,12+/m0/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 9.67E+3n/an/an/an/a5.0n/a



Tottori University , Yonago 683-8503, Japan



Assay Description
For inhibition assay, 0.1% Triton X-100 extracts were mixed with 4-MU substrates ( 5 mM 4-MU α-ᴅ-galactopyranoside and 0.1 M N-acetyl-J...


ACS Chem Biol 9: 1460-9 (2014)


Article DOI: 10.1021/cb500143h
BindingDB Entry DOI: 10.7270/Q2XS5T16
More data for this
Ligand-Target Pair