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PubMed code 27956035

Compile data set for download or QSAR
Found 10 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
Sucrase-isomaltase, intestinal


(Rattus norvegicus (Rat))		BDBM50207556
PNG
(CHEMBL3972306)
Show SMILES Cc1cc(=O)oc2cc(OCCCCn3cc(CCCCN4C[C@H](O)[C@@H](O)[C@H](O)[C@H]4CO)nn3)ccc12 |r|
Show InChI InChI=1S/C26H36N4O7/c1-17-12-24(33)37-23-13-19(7-8-20(17)23)36-11-5-4-10-30-14-18(27-28-30)6-2-3-9-29-15-22(32)26(35)25(34)21(29)16-31/h7-8,12-14,21-22,25-26,31-32,34-35H,2-6,9-11,15-16H2,1H3/t21-,22+,25-,26-/m1/s1
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n/an/a 540n/an/an/an/an/an/a



Shibaura Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of rat small intestinal brush border membrane sucrase assessed as reduction in production of D-glucose using disaccharides as substrate in...

Bioorg Med Chem 25: 773-778 (2017)


Article DOI: 10.1016/j.bmc.2016.11.053
BindingDB Entry DOI: 10.7270/Q2CN75WZ
More data for this
Ligand-Target Pair
Sucrase-isomaltase, intestinal


(Rattus norvegicus (Rat))		BDBM50207555
PNG
(CHEMBL3901171)
Show SMILES OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCc1cn(CCCCOc2ccc3c(cc(=O)oc3c2)C(F)(F)F)nn1 |r|
Show InChI InChI=1S/C26H33F3N4O7/c27-26(28,29)19-12-23(36)40-22-11-17(6-7-18(19)22)39-10-4-3-9-33-13-16(30-31-33)5-1-2-8-32-14-21(35)25(38)24(37)20(32)15-34/h6-7,11-13,20-21,24-25,34-35,37-38H,1-5,8-10,14-15H2/t20-,21+,24-,25-/m1/s1
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n/an/a 950n/an/an/an/an/an/a



Shibaura Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of rat small intestinal brush border membrane sucrase assessed as reduction in production of D-glucose using disaccharides as substrate in...

Bioorg Med Chem 25: 773-778 (2017)


Article DOI: 10.1016/j.bmc.2016.11.053
BindingDB Entry DOI: 10.7270/Q2CN75WZ
More data for this
Ligand-Target Pair
Sucrase-isomaltase, intestinal


(Rattus norvegicus (Rat))		BDBM50207556
PNG
(CHEMBL3972306)
Show SMILES Cc1cc(=O)oc2cc(OCCCCn3cc(CCCCN4C[C@H](O)[C@@H](O)[C@H](O)[C@H]4CO)nn3)ccc12 |r|
Show InChI InChI=1S/C26H36N4O7/c1-17-12-24(33)37-23-13-19(7-8-20(17)23)36-11-5-4-10-30-14-18(27-28-30)6-2-3-9-29-15-22(32)26(35)25(34)21(29)16-31/h7-8,12-14,21-22,25-26,31-32,34-35H,2-6,9-11,15-16H2,1H3/t21-,22+,25-,26-/m1/s1
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n/an/a 1.40E+3n/an/an/an/an/an/a



Shibaura Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of rat small intestinal brush border membrane isomaltase assessed as reduction in production of D-glucose using disaccharides as substrate...

Bioorg Med Chem 25: 773-778 (2017)


Article DOI: 10.1016/j.bmc.2016.11.053
BindingDB Entry DOI: 10.7270/Q2CN75WZ
More data for this
Ligand-Target Pair
Sucrase-isomaltase, intestinal


(Rattus norvegicus (Rat))		BDBM50207553
PNG
(CHEMBL3968204)
Show SMILES CCN(CC)c1ccc2cc(C(=O)NCCOCCOCCOCCn3cc(CCCCN4C[C@H](O)[C@@H](O)[C@H](O)[C@H]4CO)nn3)c(=O)oc2c1 |r|
Show InChI InChI=1S/C34H52N6O10/c1-3-38(4-2)26-9-8-24-19-27(34(46)50-30(24)20-26)33(45)35-10-13-47-15-17-49-18-16-48-14-12-40-21-25(36-37-40)7-5-6-11-39-22-29(42)32(44)31(43)28(39)23-41/h8-9,19-21,28-29,31-32,41-44H,3-7,10-18,22-23H2,1-2H3,(H,35,45)/t28-,29+,31-,32-/m1/s1
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n/an/a 1.40E+3n/an/an/an/an/an/a



Shibaura Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of rat small intestinal brush border membrane sucrase assessed as reduction in production of D-glucose using disaccharides as substrate in...

Bioorg Med Chem 25: 773-778 (2017)


Article DOI: 10.1016/j.bmc.2016.11.053
BindingDB Entry DOI: 10.7270/Q2CN75WZ
More data for this
Ligand-Target Pair
Sucrase-isomaltase, intestinal


(Rattus norvegicus (Rat))		BDBM50207557
PNG
(CHEMBL3980365)
Show SMILES CN(C)c1cccc2c(cccc12)S(=O)(=O)NCCOCCn1cc(CCCCN2C[C@H](O)[C@@H](O)[C@H](O)[C@H]2CO)nn1 |r|
Show InChI InChI=1S/C28H42N6O7S/c1-32(2)23-10-5-9-22-21(23)8-6-11-26(22)42(39,40)29-12-15-41-16-14-34-17-20(30-31-34)7-3-4-13-33-18-25(36)28(38)27(37)24(33)19-35/h5-6,8-11,17,24-25,27-29,35-38H,3-4,7,12-16,18-19H2,1-2H3/t24-,25+,27-,28-/m1/s1
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n/an/a 1.90E+3n/an/an/an/an/an/a



Shibaura Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of rat small intestinal brush border membrane sucrase assessed as reduction in production of D-glucose using disaccharides as substrate in...

Bioorg Med Chem 25: 773-778 (2017)


Article DOI: 10.1016/j.bmc.2016.11.053
BindingDB Entry DOI: 10.7270/Q2CN75WZ
More data for this
Ligand-Target Pair
Sucrase-isomaltase, intestinal


(Rattus norvegicus (Rat))		BDBM50207554
PNG
(CHEMBL3918889)
Show SMILES OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCc1cn(CCCCOc2ccc3nc4ccc(=O)cc4oc3c2)nn1 |r|
Show InChI InChI=1S/C28H35N5O7/c34-17-23-27(37)28(38)24(36)16-32(23)10-2-1-5-18-15-33(31-30-18)11-3-4-12-39-20-7-9-22-26(14-20)40-25-13-19(35)6-8-21(25)29-22/h6-9,13-15,23-24,27-28,34,36-38H,1-5,10-12,16-17H2/t23-,24+,27-,28-/m1/s1
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n/an/a 2.70E+3n/an/an/an/an/an/a



Shibaura Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of rat small intestinal brush border membrane sucrase assessed as reduction in production of D-glucose using disaccharides as substrate in...

Bioorg Med Chem 25: 773-778 (2017)


Article DOI: 10.1016/j.bmc.2016.11.053
BindingDB Entry DOI: 10.7270/Q2CN75WZ
More data for this
Ligand-Target Pair
Sucrase-isomaltase, intestinal


(Rattus norvegicus (Rat))		BDBM50207555
PNG
(CHEMBL3901171)
Show SMILES OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCc1cn(CCCCOc2ccc3c(cc(=O)oc3c2)C(F)(F)F)nn1 |r|
Show InChI InChI=1S/C26H33F3N4O7/c27-26(28,29)19-12-23(36)40-22-11-17(6-7-18(19)22)39-10-4-3-9-33-13-16(30-31-33)5-1-2-8-32-14-21(35)25(38)24(37)20(32)15-34/h6-7,11-13,20-21,24-25,34-35,37-38H,1-5,8-10,14-15H2/t20-,21+,24-,25-/m1/s1
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n/an/a 4.10E+3n/an/an/an/an/an/a



Shibaura Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of rat small intestinal brush border membrane isomaltase assessed as reduction in production of D-glucose using disaccharides as substrate...

Bioorg Med Chem 25: 773-778 (2017)


Article DOI: 10.1016/j.bmc.2016.11.053
BindingDB Entry DOI: 10.7270/Q2CN75WZ
More data for this
Ligand-Target Pair
Sucrase-isomaltase, intestinal


(Rattus norvegicus (Rat))		BDBM50207557
PNG
(CHEMBL3980365)
Show SMILES CN(C)c1cccc2c(cccc12)S(=O)(=O)NCCOCCn1cc(CCCCN2C[C@H](O)[C@@H](O)[C@H](O)[C@H]2CO)nn1 |r|
Show InChI InChI=1S/C28H42N6O7S/c1-32(2)23-10-5-9-22-21(23)8-6-11-26(22)42(39,40)29-12-15-41-16-14-34-17-20(30-31-34)7-3-4-13-33-18-25(36)28(38)27(37)24(33)19-35/h5-6,8-11,17,24-25,27-29,35-38H,3-4,7,12-16,18-19H2,1-2H3/t24-,25+,27-,28-/m1/s1
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n/an/a 4.60E+3n/an/an/an/an/an/a



Shibaura Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of rat small intestinal brush border membrane isomaltase assessed as reduction in production of D-glucose using disaccharides as substrate...

Bioorg Med Chem 25: 773-778 (2017)


Article DOI: 10.1016/j.bmc.2016.11.053
BindingDB Entry DOI: 10.7270/Q2CN75WZ
More data for this
Ligand-Target Pair
Sucrase-isomaltase, intestinal


(Rattus norvegicus (Rat))		BDBM50207554
PNG
(CHEMBL3918889)
Show SMILES OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCc1cn(CCCCOc2ccc3nc4ccc(=O)cc4oc3c2)nn1 |r|
Show InChI InChI=1S/C28H35N5O7/c34-17-23-27(37)28(38)24(36)16-32(23)10-2-1-5-18-15-33(31-30-18)11-3-4-12-39-20-7-9-22-26(14-20)40-25-13-19(35)6-8-21(25)29-22/h6-9,13-15,23-24,27-28,34,36-38H,1-5,10-12,16-17H2/t23-,24+,27-,28-/m1/s1
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n/an/a 6.30E+3n/an/an/an/an/an/a



Shibaura Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of rat small intestinal brush border membrane isomaltase assessed as reduction in production of D-glucose using disaccharides as substrate...

Bioorg Med Chem 25: 773-778 (2017)


Article DOI: 10.1016/j.bmc.2016.11.053
BindingDB Entry DOI: 10.7270/Q2CN75WZ
More data for this
Ligand-Target Pair
Sucrase-isomaltase, intestinal


(Rattus norvegicus (Rat))		BDBM50207553
PNG
(CHEMBL3968204)
Show SMILES CCN(CC)c1ccc2cc(C(=O)NCCOCCOCCOCCn3cc(CCCCN4C[C@H](O)[C@@H](O)[C@H](O)[C@H]4CO)nn3)c(=O)oc2c1 |r|
Show InChI InChI=1S/C34H52N6O10/c1-3-38(4-2)26-9-8-24-19-27(34(46)50-30(24)20-26)33(45)35-10-13-47-15-17-49-18-16-48-14-12-40-21-25(36-37-40)7-5-6-11-39-22-29(42)32(44)31(43)28(39)23-41/h8-9,19-21,28-29,31-32,41-44H,3-7,10-18,22-23H2,1-2H3,(H,35,45)/t28-,29+,31-,32-/m1/s1
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n/an/a 1.36E+4n/an/an/an/an/an/a



Shibaura Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of rat small intestinal brush border membrane isomaltase assessed as reduction in production of D-glucose using disaccharides as substrate...

Bioorg Med Chem 25: 773-778 (2017)


Article DOI: 10.1016/j.bmc.2016.11.053
BindingDB Entry DOI: 10.7270/Q2CN75WZ
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%