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Compile Data Set for Download or QSAR

Found 8 hits Enz. Inhib. hit(s) with all data for entry = 50043216   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Alpha-L-fucosidase 1


(Bos taurus)
BDBM50437446
PNG
(CHEMBL2409341)
Show SMILES O[C@H]1CNC[C@@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C6H13NO4/c8-3-1-7-2-4(9)6(11)5(3)10/h3-11H,1-2H2/t3-,4+,5-,6-/m1/s1
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
4.60E+3n/an/an/an/an/an/an/an/a



Universit£ de Poitiers

Curated by ChEMBL


Assay Description
Inhibition of bovine kidney alpha-L-fucosidase


Bioorg Med Chem 21: 4803-12 (2013)


Article DOI: 10.1016/j.bmc.2013.03.035
BindingDB Entry DOI: 10.7270/Q2GQ7053
More data for this
Ligand-Target Pair
α-galactosidase


(Coffea arabica (Coffee beans))
BDBM50437446
PNG
(CHEMBL2409341)
Show SMILES O[C@H]1CNC[C@@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C6H13NO4/c8-3-1-7-2-4(9)6(11)5(3)10/h3-11H,1-2H2/t3-,4+,5-,6-/m1/s1
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
5.40E+4n/an/an/an/an/an/an/an/a



Universit£ de Poitiers

Curated by ChEMBL


Assay Description
Inhibition of coffee bean alpha-galactosidase


Bioorg Med Chem 21: 4803-12 (2013)


Article DOI: 10.1016/j.bmc.2013.03.035
BindingDB Entry DOI: 10.7270/Q2GQ7053
More data for this
Ligand-Target Pair
Alpha-L-fucosidase 1


(Bos taurus)
BDBM50437448
PNG
(CHEMBL2409344)
Show SMILES CC[C@@H]1N[C@@H](CO)[C@@H](O)[C@H](O)[C@H]1O
Show InChI InChI=1S/C8H17NO4/c1-2-4-6(11)8(13)7(12)5(3-10)9-4/h4-13H,2-3H2,1H3/t4-,5-,6-,7+,8+/m0/s1
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 7.20E+4n/an/an/an/an/an/a



Universit£ de Poitiers

Curated by ChEMBL


Assay Description
Inhibition of bovine kidney alpha-L-fucosidase


Bioorg Med Chem 21: 4803-12 (2013)


Article DOI: 10.1016/j.bmc.2013.03.035
BindingDB Entry DOI: 10.7270/Q2GQ7053
More data for this
Ligand-Target Pair
Alpha-L-fucosidase 1


(Bos taurus)
BDBM50437447
PNG
(CHEMBL2409343)
Show SMILES CC[C@H]1N[C@@H](CO)[C@@H](O)[C@H](O)[C@H]1O
Show InChI InChI=1S/C8H17NO4/c1-2-4-6(11)8(13)7(12)5(3-10)9-4/h4-13H,2-3H2,1H3/t4-,5+,6+,7-,8-/m1/s1
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.08E+5n/an/an/an/an/an/a



Universit£ de Poitiers

Curated by ChEMBL


Assay Description
Inhibition of bovine kidney alpha-L-fucosidase


Bioorg Med Chem 21: 4803-12 (2013)


Article DOI: 10.1016/j.bmc.2013.03.035
BindingDB Entry DOI: 10.7270/Q2GQ7053
More data for this
Ligand-Target Pair
Glucosylceramidase


(Bos taurus)
BDBM50437451
PNG
(CHEMBL2409348)
Show SMILES CC[C@@H]1NC[C@@H](O)[C@@H](O)[C@H](O)[C@H]1O
Show InChI InChI=1S/C8H17NO4/c1-2-4-6(11)8(13)7(12)5(10)3-9-4/h4-13H,2-3H2,1H3/t4-,5+,6-,7+,8+/m0/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 4.87E+5n/an/an/an/an/an/a



Universit£ de Poitiers

Curated by ChEMBL


Assay Description
Inhibition of bovine liver beta-glucosidase


Bioorg Med Chem 21: 4803-12 (2013)


Article DOI: 10.1016/j.bmc.2013.03.035
BindingDB Entry DOI: 10.7270/Q2GQ7053
More data for this
Ligand-Target Pair
β-galactosidase


(Bos taurus (Bovine))
BDBM50437451
PNG
(CHEMBL2409348)
Show SMILES CC[C@@H]1NC[C@@H](O)[C@@H](O)[C@H](O)[C@H]1O
Show InChI InChI=1S/C8H17NO4/c1-2-4-6(11)8(13)7(12)5(10)3-9-4/h4-13H,2-3H2,1H3/t4-,5+,6-,7+,8+/m0/s1
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 5.26E+5n/an/an/an/an/an/a



Universit£ de Poitiers

Curated by ChEMBL


Assay Description
Inhibition of bovine liver beta-galactosidase


Bioorg Med Chem 21: 4803-12 (2013)


Article DOI: 10.1016/j.bmc.2013.03.035
BindingDB Entry DOI: 10.7270/Q2GQ7053
More data for this
Ligand-Target Pair
β-galactosidase


(Bos taurus (Bovine))
BDBM50437450
PNG
(CHEMBL2409346)
Show SMILES CCC[C@@H]1NC[C@@H](O)[C@@H](O)[C@H](O)[C@H]1O
Show InChI InChI=1S/C9H19NO4/c1-2-3-5-7(12)9(14)8(13)6(11)4-10-5/h5-14H,2-4H2,1H3/t5-,6+,7-,8+,9+/m0/s1
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 5.41E+5n/an/an/an/an/an/a



Universit£ de Poitiers

Curated by ChEMBL


Assay Description
Inhibition of bovine liver beta-galactosidase


Bioorg Med Chem 21: 4803-12 (2013)


Article DOI: 10.1016/j.bmc.2013.03.035
BindingDB Entry DOI: 10.7270/Q2GQ7053
More data for this
Ligand-Target Pair
Alpha-L-fucosidase 1


(Bos taurus)
BDBM50437449
PNG
(CHEMBL2409342)
Show SMILES CCC[C@@H]1N[C@@H](CO)[C@@H](O)[C@H](O)[C@H]1O
Show InChI InChI=1S/C9H19NO4/c1-2-3-5-7(12)9(14)8(13)6(4-11)10-5/h5-14H,2-4H2,1H3/t5-,6-,7-,8+,9+/m0/s1
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 7.13E+5n/an/an/an/an/an/a



Universit£ de Poitiers

Curated by ChEMBL


Assay Description
Inhibition of bovine kidney alpha-L-fucosidase


Bioorg Med Chem 21: 4803-12 (2013)


Article DOI: 10.1016/j.bmc.2013.03.035
BindingDB Entry DOI: 10.7270/Q2GQ7053
More data for this
Ligand-Target Pair