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PubMed code 10915054

Compile data set for download or QSAR
Found 6 hits of Enzyme Inhibition Constant Data   
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
Pancreatic alpha-amylase


(Rattus norvegicus)
BDBM50090254
PNG
((R)-5-((S)-2,2-Dimethyl-[1,3]dioxolan-4-yl)-3,4-di...)
Show SMILES CC1(C)OC[C@H](O1)c1oc(O)c(O)c1O
Show InChI InChI=1S/C9H12O6/c1-9(2)13-3-4(15-9)7-5(10)6(11)8(12)14-7/h4,10-12H,3H2,1-2H3/t4-/m0/s1
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Article
PubMed
<4.00E+4n/an/an/an/an/an/an/an/a



University of Canterbury

Curated by ChEMBL


Assay Description
Inhibitory constant against Alpha-amylase


Bioorg Med Chem Lett 10: 1575-6 (2000)


Article DOI: 10.1016/s0960-894x(00)00288-2
BindingDB Entry DOI: 10.7270/Q2R49R9C
More data for this
Ligand-Target Pair
Pancreatic alpha-amylase


(Rattus norvegicus)
BDBM50451094
PNG
(ASCORBYL PALMITATE | Ascorbyl Palmitate | Ascorbyl...)
Show SMILES CCCCCCCCCCCCCCCC(=O)OC[C@H](O)[C@H]1OC(=O)C(O)=C1O
Show InChI InChI=1S/C22H38O7/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(24)28-16-17(23)21-19(25)20(26)22(27)29-21/h17,21,23,25-26H,2-16H2,1H3/t17-,21+/m0/s1
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UniChem
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PubMed
<4.00E+4n/an/an/an/an/an/an/an/a



University of Canterbury

Curated by ChEMBL


Assay Description
Inhibitory constant against Alpha-amylase


Bioorg Med Chem Lett 10: 1575-6 (2000)


Article DOI: 10.1016/s0960-894x(00)00288-2
BindingDB Entry DOI: 10.7270/Q2R49R9C
More data for this
Ligand-Target Pair
Pancreatic alpha-amylase


(Rattus norvegicus)
BDBM50351096
PNG
(ASCORBIC ACID)
Show SMILES OC[C@H](O)[C@H]1OC(=O)C(=O)C1O
Show InChI InChI=1S/C6H8O6/c7-1-2(8)5-3(9)4(10)6(11)12-5/h2-3,5,7-9H,1H2/t2-,3?,5+/m0/s1
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PubMed
4.34E+4n/an/an/an/an/an/an/an/a



University of Canterbury

Curated by ChEMBL


Assay Description
Inhibitory constant against Alpha-amylase


Bioorg Med Chem Lett 10: 1575-6 (2000)


Article DOI: 10.1016/s0960-894x(00)00288-2
BindingDB Entry DOI: 10.7270/Q2R49R9C
More data for this
Ligand-Target Pair
Pancreatic alpha-amylase


(Rattus norvegicus)
BDBM50351096
PNG
(ASCORBIC ACID)
Show SMILES OC[C@H](O)[C@H]1OC(=O)C(=O)C1O
Show InChI InChI=1S/C6H8O6/c7-1-2(8)5-3(9)4(10)6(11)12-5/h2-3,5,7-9H,1H2/t2-,3?,5+/m0/s1
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Article
PubMed
n/an/a 2.65E+4n/an/an/an/an/an/a



University of Canterbury

Curated by ChEMBL


Assay Description
The compound was tested for inhibition of malt Alpha-amylase by Megazyme assay


Bioorg Med Chem Lett 10: 1575-6 (2000)


Article DOI: 10.1016/s0960-894x(00)00288-2
BindingDB Entry DOI: 10.7270/Q2R49R9C
More data for this
Ligand-Target Pair
Pancreatic alpha-amylase


(Rattus norvegicus)
BDBM50090254
PNG
((R)-5-((S)-2,2-Dimethyl-[1,3]dioxolan-4-yl)-3,4-di...)
Show SMILES CC1(C)OC[C@H](O1)c1oc(O)c(O)c1O
Show InChI InChI=1S/C9H12O6/c1-9(2)13-3-4(15-9)7-5(10)6(11)8(12)14-7/h4,10-12H,3H2,1-2H3/t4-/m0/s1
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Article
PubMed
n/an/a 2.80E+4n/an/an/an/an/an/a



University of Canterbury

Curated by ChEMBL


Assay Description
The compound was tested for inhibition of malt Alpha-amylase by Megazyme assay


Bioorg Med Chem Lett 10: 1575-6 (2000)


Article DOI: 10.1016/s0960-894x(00)00288-2
BindingDB Entry DOI: 10.7270/Q2R49R9C
More data for this
Ligand-Target Pair
Pancreatic alpha-amylase


(Rattus norvegicus)
BDBM50451094
PNG
(ASCORBYL PALMITATE | Ascorbyl Palmitate | Ascorbyl...)
Show SMILES CCCCCCCCCCCCCCCC(=O)OC[C@H](O)[C@H]1OC(=O)C(O)=C1O
Show InChI InChI=1S/C22H38O7/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(24)28-16-17(23)21-19(25)20(26)22(27)29-21/h17,21,23,25-26H,2-16H2,1H3/t17-,21+/m0/s1
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Article
PubMed
n/an/a 6.25E+4n/an/an/an/an/an/a



University of Canterbury

Curated by ChEMBL


Assay Description
The compound was tested for inhibition of malt Alpha-amylase by Megazyme assay


Bioorg Med Chem Lett 10: 1575-6 (2000)


Article DOI: 10.1016/s0960-894x(00)00288-2
BindingDB Entry DOI: 10.7270/Q2R49R9C
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%