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Compile Data Set for Download or QSAR

Found 1474 hits of ic50 for UniProtKB: P13866   
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
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50242614
PNG
((S)-1-((S)-2-((S)-2,5-diamino-5-oxopentanamido)-3-...)
Show SMILES N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(O)=O |r|
Show InChI InChI=1S/C13H22N4O6/c14-7(3-4-10(15)19)11(20)16-8(6-18)12(21)17-5-1-2-9(17)13(22)23/h7-9,18H,1-6,14H2,(H2,15,19)(H,16,20)(H,22,23)/t7-,8-,9-/m0/s1
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n/an/a 0.160n/an/an/an/an/an/a



University Würzburg

Curated by ChEMBL


Assay Description
Inhibition of human SGLT1 expressed in xenopus laevis oocyte assessed as inhibition of methyl-alpha-D-[14C]glucopyranoside uptake after 1 hrs


J Biol Chem 282: 28501-13 (2007)


Article DOI: 10.1074/jbc.M705416200
BindingDB Entry DOI: 10.7270/Q2SJ1KCM
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50242617
PNG
(CHEMBL521026 | QSPac)
Show SMILES CC(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(O)=O |r|
Show InChI InChI=1S/C15H24N4O7/c1-8(21)19-6-2-3-11(19)14(24)18-10(7-20)13(23)17-9(15(25)26)4-5-12(16)22/h9-11,20H,2-7H2,1H3,(H2,16,22)(H,17,23)(H,18,24)(H,25,26)/t9-,10-,11-/m0/s1
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n/an/a 0.170n/an/an/an/an/an/a



University Würzburg

Curated by ChEMBL


Assay Description
Inhibition of human SGLT1 expressed in xenopus laevis oocyte assessed as inhibition of methyl-alpha-D-[14C]glucopyranoside uptake after 1 hrs


J Biol Chem 282: 28501-13 (2007)


Article DOI: 10.1074/jbc.M705416200
BindingDB Entry DOI: 10.7270/Q2SJ1KCM
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50560402
PNG
(LIK-066 | Licogliflozin | Lik066 | USRE49080, Exam...)
Show SMILES CCc1ccc(cc1Cc1ccc2OCCOc2c1)[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
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n/an/a 0.5n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of SGLT1 (unknown origin)


Citation and Details

Article DOI: 10.1016/j.bmcl.2020.127387
BindingDB Entry DOI: 10.7270/Q2DZ0D1D
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM402285
PNG
(US10011627, 1)
Show SMILES OC[C@@]12CO[C@@](O1)([C@H](O)[C@@H](O)[C@@H]2O)c1ccc(Cl)c(Cc2ccc3OCCOc3c2)c1 |TLB:10:9:3.4:6,THB:12:11:3.4:6,8:7:3.4:6|
Show InChI InChI=1S/C22H23ClO8/c23-15-3-2-14(22-20(27)18(25)19(26)21(10-24,31-22)11-30-22)9-13(15)7-12-1-4-16-17(8-12)29-6-5-28-16/h1-4,8-9,18-20,24-27H,5-7,10-11H2/t18-,19-,20+,21-,22-/m0/s1
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n/an/a 0.580n/an/an/an/an/an/a



Vernalis (R&D) Ltd



Assay Description
The following method was used to determine the inhibitory activity of the compounds of the present invention on SGLT1 and SGLT2. The experimental met...


Bioorg Med Chem 17: 6590-605 (2009)


BindingDB Entry DOI: 10.7270/Q2C24ZS4
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM132916
PNG
(US8846746, 194)
Show SMILES C[C@@H]1[C@H](CNC1=O)C(=O)Nc1cc(-c2cccc(c2)C(C)(C)C)n(n1)-c1ccccc1Cl |r|
Show InChI InChI=1S/C25H27ClN4O2/c1-15-18(14-27-23(15)31)24(32)28-22-13-21(16-8-7-9-17(12-16)25(2,3)4)30(29-22)20-11-6-5-10-19(20)26/h5-13,15,18H,14H2,1-4H3,(H,27,31)(H,28,29,32)/t15-,18+/m1/s1
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n/an/a 0.700n/an/an/an/an/a37



Japan Tobacco Inc.

US Patent


Assay Description
The stable cell line expressing human SGLT1 was seeded at 5x104 cells/well on BioCoat Poly-D-Lysine 96 well plate with Lid (Becton Dickinson and Comp...


US Patent US8846746 (2014)


BindingDB Entry DOI: 10.7270/Q27M06MJ
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM132862
PNG
(US8846746, 132)
Show SMILES CC(C)(C)c1cccc(c1)-c1cc(NC(=O)[C@H]2CNC(=O)C2)nn1-c1ccccc1Cl |r|
Show InChI InChI=1S/C24H25ClN4O2/c1-24(2,3)17-8-6-7-15(11-17)20-13-21(27-23(31)16-12-22(30)26-14-16)28-29(20)19-10-5-4-9-18(19)25/h4-11,13,16H,12,14H2,1-3H3,(H,26,30)(H,27,28,31)/t16-/m1/s1
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n/an/a 0.900n/an/an/an/an/a37



Japan Tobacco Inc.

US Patent


Assay Description
The stable cell line expressing human SGLT1 was seeded at 5x104 cells/well on BioCoat Poly-D-Lysine 96 well plate with Lid (Becton Dickinson and Comp...


US Patent US8846746 (2014)


BindingDB Entry DOI: 10.7270/Q27M06MJ
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM493926
PNG
(US10988462, Example 37)
Show SMILES C[C@@H]1[C@H](CNC1=O)C(=O)Nc1cc(-c2cc(F)cc(OC(C)(C)C(F)(F)F)c2)n(n1)-c1cnc(nc1)N(C)C |r|
Show InChI InChI=1S/C25H27F4N7O3/c1-13-18(12-30-21(13)37)22(38)33-20-9-19(36(34-20)16-10-31-23(32-11-16)35(4)5)14-6-15(26)8-17(7-14)39-24(2,3)25(27,28)29/h6-11,13,18H,12H2,1-5H3,(H,30,37)(H,33,34,38)/t13-,18+/m1/s1
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n/an/a 0.980n/an/an/an/an/an/a



Japan Tobacco Inc.

US Patent


Assay Description
Human SGLT1-stably-expressing cell lines were seeded at 5×104 cells/well on BioCoat™ Poly-D-Lysine 96 well plate with Lid (Becton, Dickinson and Comp...


US Patent US10988462 (2021)


BindingDB Entry DOI: 10.7270/Q2TH8QV5
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM176693
PNG
(US9688710, 116 4-(4-(2-methyl-5-((2S,3R,4R,5S,6R)-...)
Show SMILES CS[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1ccc(C)c(Cc2ccc(CCCC(=O)NC3(CC3)C(=O)N3CCN(C)CC3)cc2)c1 |r|
Show InChI InChI=1S/C33H45N3O6S/c1-21-7-12-24(30-28(39)27(38)29(40)31(42-30)43-3)20-25(21)19-23-10-8-22(9-11-23)5-4-6-26(37)34-33(13-14-33)32(41)36-17-15-35(2)16-18-36/h7-12,20,27-31,38-40H,4-6,13-19H2,1-3H3,(H,34,37)/t27-,28-,29+,30+,31-/m1/s1
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n/an/a 1.10n/an/an/an/an/an/a



Lexicon Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of human HA-tagged SGLT1 expressed in HEK293 cells assessed as decrease in [14C]-AMG uptake measured after 1 to 2 hrs by scintillation cou...


J Med Chem 60: 710-721 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01541
BindingDB Entry DOI: 10.7270/Q2C24ZQ7
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM133145
PNG
(US8846746, 463)
Show SMILES CCOc1ccc(F)c(c1)-n1nc(NC(=O)[C@@H]2CNC(=O)C2)cc1-c1cccc(CO[C@H](C)C(F)(F)F)c1 |r|
Show InChI InChI=1S/C26H26F4N4O4/c1-3-37-19-7-8-20(27)22(11-19)34-21(12-23(33-34)32-25(36)18-10-24(35)31-13-18)17-6-4-5-16(9-17)14-38-15(2)26(28,29)30/h4-9,11-12,15,18H,3,10,13-14H2,1-2H3,(H,31,35)(H,32,33,36)/t15-,18+/m1/s1
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n/an/a 1.10n/an/an/an/an/a37



Japan Tobacco Inc.

US Patent


Assay Description
The stable cell line expressing human SGLT1 was seeded at 5x104 cells/well on BioCoat Poly-D-Lysine 96 well plate with Lid (Becton Dickinson and Comp...


US Patent US8846746 (2014)


BindingDB Entry DOI: 10.7270/Q27M06MJ
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM132870
PNG
(US8846746, 140)
Show SMILES CCC(F)(F)c1cccc(c1)-c1cc(NC(=O)[C@H]2CNC(=O)C2)nn1-c1ccccc1Cl |r|
Show InChI InChI=1S/C23H21ClF2N4O2/c1-2-23(25,26)16-7-5-6-14(10-16)19-12-20(28-22(32)15-11-21(31)27-13-15)29-30(19)18-9-4-3-8-17(18)24/h3-10,12,15H,2,11,13H2,1H3,(H,27,31)(H,28,29,32)/t15-/m1/s1
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n/an/a 1.10n/an/an/an/an/a37



Japan Tobacco Inc.

US Patent


Assay Description
The stable cell line expressing human SGLT1 was seeded at 5x104 cells/well on BioCoat Poly-D-Lysine 96 well plate with Lid (Becton Dickinson and Comp...


US Patent US8846746 (2014)


BindingDB Entry DOI: 10.7270/Q27M06MJ
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM132882
PNG
(US8846746, 154)
Show SMILES CCC(F)(F)c1cccc(c1)-c1cc(NC(=O)[C@H]2CNC(=O)[C@@H]2C)nn1-c1ccccc1 |r|
Show InChI InChI=1S/C24H24F2N4O2/c1-3-24(25,26)17-9-7-8-16(12-17)20-13-21(29-30(20)18-10-5-4-6-11-18)28-23(32)19-14-27-22(31)15(19)2/h4-13,15,19H,3,14H2,1-2H3,(H,27,31)(H,28,29,32)/t15-,19+/m1/s1
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n/an/a 1.10n/an/an/an/an/a37



Japan Tobacco Inc.

US Patent


Assay Description
The stable cell line expressing human SGLT1 was seeded at 5x104 cells/well on BioCoat Poly-D-Lysine 96 well plate with Lid (Becton Dickinson and Comp...


US Patent US8846746 (2014)


BindingDB Entry DOI: 10.7270/Q27M06MJ
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM493906
PNG
(US10988462, Example 21)
Show SMILES C[C@@H]1[C@H](CNC1=O)C(=O)Nc1cc(-c2cc(F)cc(OC(C)(C)C(F)(F)F)c2)n(n1)-c1cncc(F)c1 |r|
Show InChI InChI=1S/C24H22F5N5O3/c1-12-18(11-31-21(12)35)22(36)32-20-8-19(34(33-20)16-6-15(26)9-30-10-16)13-4-14(25)7-17(5-13)37-23(2,3)24(27,28)29/h4-10,12,18H,11H2,1-3H3,(H,31,35)(H,32,33,36)/t12-,18+/m1/s1
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n/an/a 1.20n/an/an/an/an/an/a



Japan Tobacco Inc.

US Patent


Assay Description
Human SGLT1-stably-expressing cell lines were seeded at 5×104 cells/well on BioCoat™ Poly-D-Lysine 96 well plate with Lid (Becton, Dickinson and Comp...


US Patent US10988462 (2021)


BindingDB Entry DOI: 10.7270/Q2TH8QV5
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM132856
PNG
(US8846746, 126)
Show SMILES CC(C)(C)c1cccc(c1)-c1cc(NC(=O)[C@H]2CNC(=O)C2)nn1-c1cccc(Cl)c1 |r|
Show InChI InChI=1S/C24H25ClN4O2/c1-24(2,3)17-7-4-6-15(10-17)20-13-21(27-23(31)16-11-22(30)26-14-16)28-29(20)19-9-5-8-18(25)12-19/h4-10,12-13,16H,11,14H2,1-3H3,(H,26,30)(H,27,28,31)/t16-/m1/s1
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n/an/a 1.20n/an/an/an/an/a37



Japan Tobacco Inc.

US Patent


Assay Description
The stable cell line expressing human SGLT1 was seeded at 5x104 cells/well on BioCoat Poly-D-Lysine 96 well plate with Lid (Becton Dickinson and Comp...


US Patent US8846746 (2014)


BindingDB Entry DOI: 10.7270/Q27M06MJ
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM493905
PNG
(US10988462, Example 20)
Show SMILES C[C@@H]1[C@H](CNC1=O)C(=O)Nc1cc(-c2cc(F)cc(OC(C)(C)C(F)(F)F)c2)n(n1)-c1ccc(nc1)C(F)(F)F |r|
Show InChI InChI=1S/C25H22F7N5O3/c1-12-17(11-34-21(12)38)22(39)35-20-9-18(37(36-20)15-4-5-19(33-10-15)24(27,28)29)13-6-14(26)8-16(7-13)40-23(2,3)25(30,31)32/h4-10,12,17H,11H2,1-3H3,(H,34,38)(H,35,36,39)/t12-,17+/m1/s1
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n/an/a 1.20n/an/an/an/an/an/a



Japan Tobacco Inc.

US Patent


Assay Description
Human SGLT1-stably-expressing cell lines were seeded at 5×104 cells/well on BioCoat™ Poly-D-Lysine 96 well plate with Lid (Becton, Dickinson and Comp...


US Patent US10988462 (2021)


BindingDB Entry DOI: 10.7270/Q2TH8QV5
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM493894
PNG
(US10988462, Example 10)
Show SMILES C[C@@H]1[C@H](CNC1=O)C(=O)Nc1cc(-c2cc(F)cc(OC(C)(C)C(F)(F)F)c2)n(n1)-c1cncc(c1)C(F)(F)F |r|
Show InChI InChI=1S/C25H22F7N5O3/c1-12-18(11-34-21(12)38)22(39)35-20-8-19(37(36-20)16-6-14(9-33-10-16)24(27,28)29)13-4-15(26)7-17(5-13)40-23(2,3)25(30,31)32/h4-10,12,18H,11H2,1-3H3,(H,34,38)(H,35,36,39)/t12-,18+/m1/s1
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n/an/a 1.20n/an/an/an/an/an/a



Japan Tobacco Inc.

US Patent


Assay Description
Human SGLT1-stably-expressing cell lines were seeded at 5×104 cells/well on BioCoat™ Poly-D-Lysine 96 well plate with Lid (Becton, Dickinson and Comp...


US Patent US10988462 (2021)


BindingDB Entry DOI: 10.7270/Q2TH8QV5
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM132860
PNG
(US8846746, 130)
Show SMILES FC(F)(F)Oc1cccc(c1)-c1cc(NC(=O)[C@H]2CNC(=O)C2)nn1-c1ccccc1Cl |r|
Show InChI InChI=1S/C21H16ClF3N4O3/c22-15-6-1-2-7-16(15)29-17(12-4-3-5-14(8-12)32-21(23,24)25)10-18(28-29)27-20(31)13-9-19(30)26-11-13/h1-8,10,13H,9,11H2,(H,26,30)(H,27,28,31)/t13-/m1/s1
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n/an/a 1.30n/an/an/an/an/a37



Japan Tobacco Inc.

US Patent


Assay Description
The stable cell line expressing human SGLT1 was seeded at 5x104 cells/well on BioCoat Poly-D-Lysine 96 well plate with Lid (Becton Dickinson and Comp...


US Patent US8846746 (2014)


BindingDB Entry DOI: 10.7270/Q27M06MJ
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM132929
PNG
(US8846746, 208)
Show SMILES CCC(F)(F)c1cccc(c1)-c1cc(NC(=O)[C@H]2CNC(=O)[C@@H]2C)nn1-c1ccccc1Cl |r|
Show InChI InChI=1S/C24H23ClF2N4O2/c1-3-24(26,27)16-8-6-7-15(11-16)20-12-21(29-23(33)17-13-28-22(32)14(17)2)30-31(20)19-10-5-4-9-18(19)25/h4-12,14,17H,3,13H2,1-2H3,(H,28,32)(H,29,30,33)/t14-,17+/m1/s1
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n/an/a 1.30n/an/an/an/an/a37



Japan Tobacco Inc.

US Patent


Assay Description
The stable cell line expressing human SGLT1 was seeded at 5x104 cells/well on BioCoat Poly-D-Lysine 96 well plate with Lid (Becton Dickinson and Comp...


US Patent US8846746 (2014)


BindingDB Entry DOI: 10.7270/Q27M06MJ
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM493901
PNG
(US10988462, Example 17)
Show SMILES C[C@@H]1[C@H](CNC1=O)C(=O)Nc1cc(-c2cc(F)cc(OC(C)(C)C(F)(F)F)c2)n(n1)-c1cncc(Cl)c1 |r|
Show InChI InChI=1S/C24H22ClF4N5O3/c1-12-18(11-31-21(12)35)22(36)32-20-8-19(34(33-20)16-6-14(25)9-30-10-16)13-4-15(26)7-17(5-13)37-23(2,3)24(27,28)29/h4-10,12,18H,11H2,1-3H3,(H,31,35)(H,32,33,36)/t12-,18+/m1/s1
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n/an/a 1.30n/an/an/an/an/an/a



Japan Tobacco Inc.

US Patent


Assay Description
Human SGLT1-stably-expressing cell lines were seeded at 5×104 cells/well on BioCoat™ Poly-D-Lysine 96 well plate with Lid (Becton, Dickinson and Comp...


US Patent US10988462 (2021)


BindingDB Entry DOI: 10.7270/Q2TH8QV5
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM132874
PNG
(US8846746, 144)
Show SMILES CCC(F)(F)c1cccc(c1)-c1cc(NC(=O)[C@H]2CNC(=O)C2)nn1-c1ccccc1C |r|
Show InChI InChI=1S/C24H24F2N4O2/c1-3-24(25,26)18-9-6-8-16(11-18)20-13-21(28-23(32)17-12-22(31)27-14-17)29-30(20)19-10-5-4-7-15(19)2/h4-11,13,17H,3,12,14H2,1-2H3,(H,27,31)(H,28,29,32)/t17-/m1/s1
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n/an/a 1.30n/an/an/an/an/a37



Japan Tobacco Inc.

US Patent


Assay Description
The stable cell line expressing human SGLT1 was seeded at 5x104 cells/well on BioCoat Poly-D-Lysine 96 well plate with Lid (Becton Dickinson and Comp...


US Patent US8846746 (2014)


BindingDB Entry DOI: 10.7270/Q27M06MJ
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM132915
PNG
(US8846746, 193)
Show SMILES C[C@@H]1[C@H](CNC1=O)C(=O)Nc1cc(-c2cccc(OC(F)(F)F)c2)n(n1)-c1ccccc1Cl |r|
Show InChI InChI=1S/C22H18ClF3N4O3/c1-12-15(11-27-20(12)31)21(32)28-19-10-18(30(29-19)17-8-3-2-7-16(17)23)13-5-4-6-14(9-13)33-22(24,25)26/h2-10,12,15H,11H2,1H3,(H,27,31)(H,28,29,32)/t12-,15+/m1/s1
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n/an/a 1.30n/an/an/an/an/a37



Japan Tobacco Inc.

US Patent


Assay Description
The stable cell line expressing human SGLT1 was seeded at 5x104 cells/well on BioCoat Poly-D-Lysine 96 well plate with Lid (Becton Dickinson and Comp...


US Patent US8846746 (2014)


BindingDB Entry DOI: 10.7270/Q27M06MJ
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM132936
PNG
(US8846746, 215)
Show SMILES C[C@@H]1[C@H](CNC1=O)C(=O)Nc1cc(-c2cccc(OCC(F)(F)F)c2)n(n1)-c1ccccc1Cl |r|
Show InChI InChI=1S/C23H20ClF3N4O3/c1-13-16(11-28-21(13)32)22(33)29-20-10-19(31(30-20)18-8-3-2-7-17(18)24)14-5-4-6-15(9-14)34-12-23(25,26)27/h2-10,13,16H,11-12H2,1H3,(H,28,32)(H,29,30,33)/t13-,16+/m1/s1
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n/an/a 1.40n/an/an/an/an/a37



Japan Tobacco Inc.

US Patent


Assay Description
The stable cell line expressing human SGLT1 was seeded at 5x104 cells/well on BioCoat Poly-D-Lysine 96 well plate with Lid (Becton Dickinson and Comp...


US Patent US8846746 (2014)


BindingDB Entry DOI: 10.7270/Q27M06MJ
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM132848
PNG
(US8846746, 117)
Show SMILES CCCc1cccc(c1)-c1cc(NC(=O)[C@H]2CNC(=O)C2)nn1-c1ccccc1F |r|
Show InChI InChI=1S/C23H23FN4O2/c1-2-6-15-7-5-8-16(11-15)20-13-21(26-23(30)17-12-22(29)25-14-17)27-28(20)19-10-4-3-9-18(19)24/h3-5,7-11,13,17H,2,6,12,14H2,1H3,(H,25,29)(H,26,27,30)/t17-/m1/s1
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n/an/a 1.40n/an/an/an/an/a37



Japan Tobacco Inc.

US Patent


Assay Description
The stable cell line expressing human SGLT1 was seeded at 5x104 cells/well on BioCoat Poly-D-Lysine 96 well plate with Lid (Becton Dickinson and Comp...


US Patent US8846746 (2014)


BindingDB Entry DOI: 10.7270/Q27M06MJ
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM132924
PNG
(US8846746, 203)
Show SMILES C[C@@H]1[C@H](CNC1=O)C(=O)Nc1cc(-c2cccc(c2)C(F)(F)F)n(n1)-c1ccccc1Cl |r|
Show InChI InChI=1S/C22H18ClF3N4O2/c1-12-15(11-27-20(12)31)21(32)28-19-10-18(13-5-4-6-14(9-13)22(24,25)26)30(29-19)17-8-3-2-7-16(17)23/h2-10,12,15H,11H2,1H3,(H,27,31)(H,28,29,32)/t12-,15+/m1/s1
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n/an/a 1.40n/an/an/an/an/a37



Japan Tobacco Inc.

US Patent


Assay Description
The stable cell line expressing human SGLT1 was seeded at 5x104 cells/well on BioCoat Poly-D-Lysine 96 well plate with Lid (Becton Dickinson and Comp...


US Patent US8846746 (2014)


BindingDB Entry DOI: 10.7270/Q27M06MJ
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM132857
PNG
(US8846746, 127)
Show SMILES Cc1cccc(c1)-n1nc(NC(=O)[C@H]2CNC(=O)C2)cc1-c1cccc(c1)C(C)(C)C |r|
Show InChI InChI=1S/C25H28N4O2/c1-16-7-5-10-20(11-16)29-21(17-8-6-9-19(12-17)25(2,3)4)14-22(28-29)27-24(31)18-13-23(30)26-15-18/h5-12,14,18H,13,15H2,1-4H3,(H,26,30)(H,27,28,31)/t18-/m1/s1
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n/an/a 1.40n/an/an/an/an/a37



Japan Tobacco Inc.

US Patent


Assay Description
The stable cell line expressing human SGLT1 was seeded at 5x104 cells/well on BioCoat Poly-D-Lysine 96 well plate with Lid (Becton Dickinson and Comp...


US Patent US8846746 (2014)


BindingDB Entry DOI: 10.7270/Q27M06MJ
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM133146
PNG
(US8846746, 464)
Show SMILES CC(C)Oc1ccc(F)c(c1)-n1nc(NC(=O)[C@@H]2CNC(=O)C2)cc1-c1cccc(CO[C@H](C)C(F)(F)F)c1 |r|
Show InChI InChI=1S/C27H28F4N4O4/c1-15(2)39-20-7-8-21(28)23(11-20)35-22(12-24(34-35)33-26(37)19-10-25(36)32-13-19)18-6-4-5-17(9-18)14-38-16(3)27(29,30)31/h4-9,11-12,15-16,19H,10,13-14H2,1-3H3,(H,32,36)(H,33,34,37)/t16-,19+/m1/s1
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n/an/a 1.40n/an/an/an/an/a37



Japan Tobacco Inc.

US Patent


Assay Description
The stable cell line expressing human SGLT1 was seeded at 5x104 cells/well on BioCoat Poly-D-Lysine 96 well plate with Lid (Becton Dickinson and Comp...


US Patent US8846746 (2014)


BindingDB Entry DOI: 10.7270/Q27M06MJ
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM133143
PNG
(US8846746, 461)
Show SMILES CC(C)Oc1ccc(F)c(c1)-n1nc(NC(=O)[C@@H]2CNC(=O)C2)cc1-c1cccc(COCC(F)(F)F)c1 |r|
Show InChI InChI=1S/C26H26F4N4O4/c1-15(2)38-19-6-7-20(27)22(10-19)34-21(11-23(33-34)32-25(36)18-9-24(35)31-12-18)17-5-3-4-16(8-17)13-37-14-26(28,29)30/h3-8,10-11,15,18H,9,12-14H2,1-2H3,(H,31,35)(H,32,33,36)/t18-/m0/s1
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n/an/a 1.40n/an/an/an/an/a37



Japan Tobacco Inc.

US Patent


Assay Description
The stable cell line expressing human SGLT1 was seeded at 5x104 cells/well on BioCoat Poly-D-Lysine 96 well plate with Lid (Becton Dickinson and Comp...


US Patent US8846746 (2014)


BindingDB Entry DOI: 10.7270/Q27M06MJ
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM402293
PNG
(US10011627, 9)
Show SMILES CCc1ccc(cc1Cc1ccc2OCCOc2c1)[C@]12OC[C@](CO)(O1)[C@@H](O)[C@H](O)[C@H]2O |TLB:29:28:21.20:25,THB:27:26:21.20:25,31:30:21.20:25|
Show InChI InChI=1S/C24H28O8/c1-2-15-4-5-17(24-22(28)20(26)21(27)23(12-25,32-24)13-31-24)11-16(15)9-14-3-6-18-19(10-14)30-8-7-29-18/h3-6,10-11,20-22,25-28H,2,7-9,12-13H2,1H3/t20-,21-,22+,23-,24-/m0/s1
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n/an/a 1.49n/an/an/an/an/an/a



Vernalis (R&D) Ltd



Assay Description
The following method was used to determine the inhibitory activity of the compounds of the present invention on SGLT1 and SGLT2. The experimental met...


Bioorg Med Chem 17: 6590-605 (2009)


BindingDB Entry DOI: 10.7270/Q2C24ZS4
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM133004
PNG
(US8846746, 302)
Show SMILES CCCc1cccc(c1)-c1cc(NC(=O)C2CCS(=O)(=O)CC2)nn1-c1ccccc1
Show InChI InChI=1S/C24H27N3O3S/c1-2-7-18-8-6-9-20(16-18)22-17-23(26-27(22)21-10-4-3-5-11-21)25-24(28)19-12-14-31(29,30)15-13-19/h3-6,8-11,16-17,19H,2,7,12-15H2,1H3,(H,25,26,28)
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n/an/a 1.5n/an/an/an/an/a37



Japan Tobacco Inc.

US Patent


Assay Description
The stable cell line expressing human SGLT1 was seeded at 5x104 cells/well on BioCoat Poly-D-Lysine 96 well plate with Lid (Becton Dickinson and Comp...


US Patent US8846746 (2014)


BindingDB Entry DOI: 10.7270/Q27M06MJ
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM133055
PNG
(US8846746, 360)
Show SMILES CCCc1cccc(c1)-c1cc(NC(=O)C2CNC(=O)C22CC2)nn1-c1ccccc1
Show InChI InChI=1S/C25H26N4O2/c1-2-7-17-8-6-9-18(14-17)21-15-22(28-29(21)19-10-4-3-5-11-19)27-23(30)20-16-26-24(31)25(20)12-13-25/h3-6,8-11,14-15,20H,2,7,12-13,16H2,1H3,(H,26,31)(H,27,28,30)
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n/an/a 1.5n/an/an/an/an/a37



Japan Tobacco Inc.

US Patent


Assay Description
The stable cell line expressing human SGLT1 was seeded at 5x104 cells/well on BioCoat Poly-D-Lysine 96 well plate with Lid (Becton Dickinson and Comp...


US Patent US8846746 (2014)


BindingDB Entry DOI: 10.7270/Q27M06MJ
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM132868
PNG
(US8846746, 138)
Show SMILES CC(C)C(F)(F)c1cccc(c1)-c1cc(NC(=O)[C@H]2CNC(=O)C2)nn1-c1ccccc1 |r|
Show InChI InChI=1S/C24H24F2N4O2/c1-15(2)24(25,26)18-8-6-7-16(11-18)20-13-21(28-23(32)17-12-22(31)27-14-17)29-30(20)19-9-4-3-5-10-19/h3-11,13,15,17H,12,14H2,1-2H3,(H,27,31)(H,28,29,32)/t17-/m1/s1
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n/an/a 1.5n/an/an/an/an/a37



Japan Tobacco Inc.

US Patent


Assay Description
The stable cell line expressing human SGLT1 was seeded at 5x104 cells/well on BioCoat Poly-D-Lysine 96 well plate with Lid (Becton Dickinson and Comp...


US Patent US8846746 (2014)


BindingDB Entry DOI: 10.7270/Q27M06MJ
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM176697
PNG
(US9688710, 120 N-(2-methyl-1-(4-methylpiperidin-1-...)
Show SMILES CS[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1ccc(C)c(Cc2ccc(CCCC(=O)NC(C)(C)C(=O)N3CCC(C)CC3)cc2)c1 |r|
Show InChI InChI=1S/C34H48N2O6S/c1-21-15-17-36(18-16-21)33(41)34(3,4)35-27(37)8-6-7-23-10-12-24(13-11-23)19-26-20-25(14-9-22(26)2)31-29(39)28(38)30(40)32(42-31)43-5/h9-14,20-21,28-32,38-40H,6-8,15-19H2,1-5H3,(H,35,37)/t28-,29-,30+,31+,32-/m1/s1
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n/an/a 1.60n/an/an/an/an/an/a



Lexicon Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of human HA-tagged SGLT1 expressed in HEK293 cells assessed as decrease in [14C]-AMG uptake measured after 1 to 2 hrs by scintillation cou...


J Med Chem 60: 710-721 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01541
BindingDB Entry DOI: 10.7270/Q2C24ZQ7
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM132803
PNG
(US8846746, 70)
Show SMILES CC(C)Cc1cccc(c1)-c1cc(NC(=O)[C@H]2CNC(=O)C2)nn1-c1ccccc1 |r|
Show InChI InChI=1S/C24H26N4O2/c1-16(2)11-17-7-6-8-18(12-17)21-14-22(26-24(30)19-13-23(29)25-15-19)27-28(21)20-9-4-3-5-10-20/h3-10,12,14,16,19H,11,13,15H2,1-2H3,(H,25,29)(H,26,27,30)/t19-/m1/s1
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n/an/a 1.60n/an/an/an/an/a37



Japan Tobacco Inc.

US Patent


Assay Description
The stable cell line expressing human SGLT1 was seeded at 5x104 cells/well on BioCoat Poly-D-Lysine 96 well plate with Lid (Becton Dickinson and Comp...


US Patent US8846746 (2014)


BindingDB Entry DOI: 10.7270/Q27M06MJ
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM133135
PNG
(US8846746, 453)
Show SMILES CCCOc1cccc(c1)-n1nc(NC(=O)[C@@H]2CNC(=O)C2)cc1-c1cccc(CO[C@H](C)C(F)(F)F)c1 |r|
Show InChI InChI=1S/C27H29F3N4O4/c1-3-10-37-22-9-5-8-21(13-22)34-23(14-24(33-34)32-26(36)20-12-25(35)31-15-20)19-7-4-6-18(11-19)16-38-17(2)27(28,29)30/h4-9,11,13-14,17,20H,3,10,12,15-16H2,1-2H3,(H,31,35)(H,32,33,36)/t17-,20+/m1/s1
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n/an/a 1.70n/an/an/an/an/a37



Japan Tobacco Inc.

US Patent


Assay Description
The stable cell line expressing human SGLT1 was seeded at 5x104 cells/well on BioCoat Poly-D-Lysine 96 well plate with Lid (Becton Dickinson and Comp...


US Patent US8846746 (2014)


BindingDB Entry DOI: 10.7270/Q27M06MJ
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM133134
PNG
(US8846746, 452)
Show SMILES CCOc1cccc(c1)-n1nc(NC(=O)[C@@H]2CNC(=O)C2)cc1-c1cccc(CO[C@H](C)C(F)(F)F)c1 |r|
Show InChI InChI=1S/C26H27F3N4O4/c1-3-36-21-9-5-8-20(12-21)33-22(13-23(32-33)31-25(35)19-11-24(34)30-14-19)18-7-4-6-17(10-18)15-37-16(2)26(27,28)29/h4-10,12-13,16,19H,3,11,14-15H2,1-2H3,(H,30,34)(H,31,32,35)/t16-,19+/m1/s1
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n/an/a 1.70n/an/an/an/an/a37



Japan Tobacco Inc.

US Patent


Assay Description
The stable cell line expressing human SGLT1 was seeded at 5x104 cells/well on BioCoat Poly-D-Lysine 96 well plate with Lid (Becton Dickinson and Comp...


US Patent US8846746 (2014)


BindingDB Entry DOI: 10.7270/Q27M06MJ
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM176709
PNG
(US9688710, 132 N-(1-((2-(dimethylamino)ethyl)(meth...)
Show SMILES CS[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1ccc(C)c(Cc2ccc(CCCC(=O)NC(C)(C)C(=O)N(C)CCN(C)C)cc2)c1 |r|
Show InChI InChI=1S/C33H49N3O6S/c1-21-11-16-24(30-28(39)27(38)29(40)31(42-30)43-7)20-25(21)19-23-14-12-22(13-15-23)9-8-10-26(37)34-33(2,3)32(41)36(6)18-17-35(4)5/h11-16,20,27-31,38-40H,8-10,17-19H2,1-7H3,(H,34,37)/t27-,28-,29+,30+,31-/m1/s1
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n/an/a 1.70n/an/an/an/an/an/a



Lexicon Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of human HA-tagged SGLT1 expressed in HEK293 cells assessed as decrease in [14C]-AMG uptake measured after 1 to 2 hrs by scintillation cou...


J Med Chem 60: 710-721 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01541
BindingDB Entry DOI: 10.7270/Q2C24ZQ7
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM133147
PNG
(US8846746, 465)
Show SMILES COCCOc1ccc(F)c(c1)-n1nc(NC(=O)[C@@H]2CNC(=O)C2)cc1-c1cccc(CO[C@H](C)C(F)(F)F)c1 |r|
Show InChI InChI=1S/C27H28F4N4O5/c1-16(27(29,30)31)40-15-17-4-3-5-18(10-17)22-13-24(33-26(37)19-11-25(36)32-14-19)34-35(22)23-12-20(6-7-21(23)28)39-9-8-38-2/h3-7,10,12-13,16,19H,8-9,11,14-15H2,1-2H3,(H,32,36)(H,33,34,37)/t16-,19+/m1/s1
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n/an/a 1.70n/an/an/an/an/a37



Japan Tobacco Inc.

US Patent


Assay Description
The stable cell line expressing human SGLT1 was seeded at 5x104 cells/well on BioCoat Poly-D-Lysine 96 well plate with Lid (Becton Dickinson and Comp...


US Patent US8846746 (2014)


BindingDB Entry DOI: 10.7270/Q27M06MJ
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM132809
PNG
(US8846746, 76)
Show SMILES CCCc1cccc(c1)-c1cc(NC(=O)[C@H]2CNC(=O)C2)nn1-c1cccc(C)c1 |r|
Show InChI InChI=1S/C24H26N4O2/c1-3-6-17-8-5-9-18(12-17)21-14-22(26-24(30)19-13-23(29)25-15-19)27-28(21)20-10-4-7-16(2)11-20/h4-5,7-12,14,19H,3,6,13,15H2,1-2H3,(H,25,29)(H,26,27,30)/t19-/m1/s1
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US Patent
n/an/a 1.70n/an/an/an/an/a37



Japan Tobacco Inc.

US Patent


Assay Description
The stable cell line expressing human SGLT1 was seeded at 5x104 cells/well on BioCoat Poly-D-Lysine 96 well plate with Lid (Becton Dickinson and Comp...


US Patent US8846746 (2014)


BindingDB Entry DOI: 10.7270/Q27M06MJ
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM132869
PNG
(US8846746, 139)
Show SMILES CCC(F)(F)c1cccc(c1)-c1cc(NC(=O)[C@H]2CNC(=O)C2)nn1-c1cccc(Cl)c1 |r|
Show InChI InChI=1S/C23H21ClF2N4O2/c1-2-23(25,26)16-6-3-5-14(9-16)19-12-20(28-22(32)15-10-21(31)27-13-15)29-30(19)18-8-4-7-17(24)11-18/h3-9,11-12,15H,2,10,13H2,1H3,(H,27,31)(H,28,29,32)/t15-/m1/s1
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n/an/a 1.70n/an/an/an/an/a37



Japan Tobacco Inc.

US Patent


Assay Description
The stable cell line expressing human SGLT1 was seeded at 5x104 cells/well on BioCoat Poly-D-Lysine 96 well plate with Lid (Becton Dickinson and Comp...


US Patent US8846746 (2014)


BindingDB Entry DOI: 10.7270/Q27M06MJ
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM132823
PNG
(US8846746, 91)
Show SMILES CCCc1cccc(c1)-c1cc(NC(=O)[C@H]2CNC(=O)[C@@H]2C)nn1-c1ccccc1 |r|
Show InChI InChI=1S/C24H26N4O2/c1-3-8-17-9-7-10-18(13-17)21-14-22(27-28(21)19-11-5-4-6-12-19)26-24(30)20-15-25-23(29)16(20)2/h4-7,9-14,16,20H,3,8,15H2,1-2H3,(H,25,29)(H,26,27,30)/t16-,20+/m1/s1
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n/an/a 1.80n/an/an/an/an/a37



Japan Tobacco Inc.

US Patent


Assay Description
The stable cell line expressing human SGLT1 was seeded at 5x104 cells/well on BioCoat Poly-D-Lysine 96 well plate with Lid (Becton Dickinson and Comp...


US Patent US8846746 (2014)


BindingDB Entry DOI: 10.7270/Q27M06MJ
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM133209
PNG
(US8846746, 534)
Show SMILES CCOc1cc(F)cc(c1)-n1nc(NC(=O)[C@@H]2CNC(=O)C2)cc1-c1cccc(CO[C@H](C)C(F)(F)F)c1 |r|
Show InChI InChI=1S/C26H26F4N4O4/c1-3-37-21-10-19(27)9-20(11-21)34-22(12-23(33-34)32-25(36)18-8-24(35)31-13-18)17-6-4-5-16(7-17)14-38-15(2)26(28,29)30/h4-7,9-12,15,18H,3,8,13-14H2,1-2H3,(H,31,35)(H,32,33,36)/t15-,18+/m1/s1
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n/an/a 1.80n/an/an/an/an/a37



Japan Tobacco Inc.

US Patent


Assay Description
The stable cell line expressing human SGLT1 was seeded at 5x104 cells/well on BioCoat Poly-D-Lysine 96 well plate with Lid (Becton Dickinson and Comp...


US Patent US8846746 (2014)


BindingDB Entry DOI: 10.7270/Q27M06MJ
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM176414
PNG
(US9688710, 113 N-(2-methyl-1-(4-methylpiperazin-1-...)
Show SMILES CS[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1ccc(C)c(Cc2ccc(CCCC(=O)NC(C)(C)C(=O)N3CCN(C)CC3)cc2)c1 |r|
Show InChI InChI=1S/C33H47N3O6S/c1-21-9-14-24(30-28(39)27(38)29(40)31(42-30)43-5)20-25(21)19-23-12-10-22(11-13-23)7-6-8-26(37)34-33(2,3)32(41)36-17-15-35(4)16-18-36/h9-14,20,27-31,38-40H,6-8,15-19H2,1-5H3,(H,34,37)/t27-,28-,29+,30+,31-/m1/s1
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n/an/a 1.80n/an/an/an/an/an/a



Lexicon Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of human HA-tagged SGLT1 expressed in HEK293 cells assessed as decrease in [14C]-AMG uptake measured after 1 to 2 hrs by scintillation cou...


J Med Chem 60: 710-721 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01541
BindingDB Entry DOI: 10.7270/Q2C24ZQ7
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50349240
PNG
(CHEMBL1807551)
Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1ccc(Cl)c(Cc2ccc(cc2)C2CC2)c1 |r|
Show InChI InChI=1S/C22H25ClO5/c23-17-8-7-15(22-21(27)20(26)19(25)18(11-24)28-22)10-16(17)9-12-1-3-13(4-2-12)14-5-6-14/h1-4,7-8,10,14,18-22,24-27H,5-6,9,11H2/t18-,19-,20+,21-,22+/m1/s1
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n/an/a 1.80n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human SGLT2 expressed in african green monkey COS7 cells assessed as inhibition of [14C]-methyl-alpha-D-glucopyranoside uptake after 2 ...


Bioorg Med Chem Lett 21: 4465-70 (2011)


Article DOI: 10.1016/j.bmcl.2011.06.032
BindingDB Entry DOI: 10.7270/Q29W0FVZ
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM132759
PNG
(US8846746, 25)
Show SMILES CC(C)(C)c1cccc(c1)-c1cc(NC(=O)[C@H]2CNC(=O)C2)nn1-c1ccccc1 |r|
Show InChI InChI=1S/C24H26N4O2/c1-24(2,3)18-9-7-8-16(12-18)20-14-21(26-23(30)17-13-22(29)25-15-17)27-28(20)19-10-5-4-6-11-19/h4-12,14,17H,13,15H2,1-3H3,(H,25,29)(H,26,27,30)/t17-/m1/s1
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n/an/a 1.80n/an/an/an/an/a37



Japan Tobacco Inc.

US Patent


Assay Description
The stable cell line expressing human SGLT1 was seeded at 5x104 cells/well on BioCoat Poly-D-Lysine 96 well plate with Lid (Becton Dickinson and Comp...


US Patent US8846746 (2014)


BindingDB Entry DOI: 10.7270/Q27M06MJ
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM402291
PNG
(US10011627, 7)
Show SMILES CCCc1ccc(cc1Cc1ccc2OCCOc2c1)[C@]12OC[C@](CO)(O1)[C@@H](O)[C@H](O)[C@H]2O |TLB:30:29:22.21:26,THB:32:31:22.21:26,28:27:22.21:26|
Show InChI InChI=1S/C25H30O8/c1-2-3-16-5-6-18(25-23(29)21(27)22(28)24(13-26,33-25)14-32-25)12-17(16)10-15-4-7-19-20(11-15)31-9-8-30-19/h4-7,11-12,21-23,26-29H,2-3,8-10,13-14H2,1H3/t21-,22-,23+,24-,25-/m0/s1
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n/an/a 1.82n/an/an/an/an/an/a



Vernalis (R&D) Ltd



Assay Description
The following method was used to determine the inhibitory activity of the compounds of the present invention on SGLT1 and SGLT2. The experimental met...


Bioorg Med Chem 17: 6590-605 (2009)


BindingDB Entry DOI: 10.7270/Q2C24ZS4
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM132832
PNG
(US8846746, 100)
Show SMILES CCCc1cccc(c1)-c1cc(NC(=O)[C@H]2CNC(=O)C2)nn1-c1ccccc1Cl |r|
Show InChI InChI=1S/C23H23ClN4O2/c1-2-6-15-7-5-8-16(11-15)20-13-21(26-23(30)17-12-22(29)25-14-17)27-28(20)19-10-4-3-9-18(19)24/h3-5,7-11,13,17H,2,6,12,14H2,1H3,(H,25,29)(H,26,27,30)/t17-/m1/s1
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n/an/a 1.90n/an/an/an/an/a37



Japan Tobacco Inc.

US Patent


Assay Description
The stable cell line expressing human SGLT1 was seeded at 5x104 cells/well on BioCoat Poly-D-Lysine 96 well plate with Lid (Becton Dickinson and Comp...


US Patent US8846746 (2014)


BindingDB Entry DOI: 10.7270/Q27M06MJ
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM493879
PNG
(US10988462, Example 1)
Show SMILES C[C@@H]1[C@H](CNC1=O)C(=O)Nc1cc(-c2cc(F)cc(OC(C)(C)C(F)(F)F)c2)n(n1)-c1cnc(nc1)C(F)(F)F |r|
Show InChI InChI=1S/C24H21F7N6O3/c1-11-16(10-32-19(11)38)20(39)35-18-7-17(37(36-18)14-8-33-21(34-9-14)23(26,27)28)12-4-13(25)6-15(5-12)40-22(2,3)24(29,30)31/h4-9,11,16H,10H2,1-3H3,(H,32,38)(H,35,36,39)/t11-,16+/m1/s1
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n/an/a 1.90n/an/an/an/an/an/a



Japan Tobacco Inc.

US Patent


Assay Description
Human SGLT1-stably-expressing cell lines were seeded at 5×104 cells/well on BioCoat™ Poly-D-Lysine 96 well plate with Lid (Becton, Dickinson and Comp...


US Patent US10988462 (2021)


BindingDB Entry DOI: 10.7270/Q2TH8QV5
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM493925
PNG
(US10988462, Example 36)
Show SMILES COc1ncc(cn1)-n1nc(NC(=O)[C@H]2CNC(=O)[C@@H]2C)cc1-c1cc(F)cc(OC(C)(C)C(F)(F)F)c1 |r|
Show InChI InChI=1S/C24H24F4N6O4/c1-12-17(11-29-20(12)35)21(36)32-19-8-18(34(33-19)15-9-30-22(37-4)31-10-15)13-5-14(25)7-16(6-13)38-23(2,3)24(26,27)28/h5-10,12,17H,11H2,1-4H3,(H,29,35)(H,32,33,36)/t12-,17+/m1/s1
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n/an/a 1.90n/an/an/an/an/an/a



Japan Tobacco Inc.

US Patent


Assay Description
Human SGLT1-stably-expressing cell lines were seeded at 5×104 cells/well on BioCoat™ Poly-D-Lysine 96 well plate with Lid (Becton, Dickinson and Comp...


US Patent US10988462 (2021)


BindingDB Entry DOI: 10.7270/Q2TH8QV5
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM133136
PNG
(US8846746, 454)
Show SMILES CC(C)Oc1cccc(c1)-n1nc(NC(=O)[C@@H]2CNC(=O)C2)cc1-c1cccc(CO[C@H](C)C(F)(F)F)c1 |r|
Show InChI InChI=1S/C27H29F3N4O4/c1-16(2)38-22-9-5-8-21(12-22)34-23(13-24(33-34)32-26(36)20-11-25(35)31-14-20)19-7-4-6-18(10-19)15-37-17(3)27(28,29)30/h4-10,12-13,16-17,20H,11,14-15H2,1-3H3,(H,31,35)(H,32,33,36)/t17-,20+/m1/s1
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n/an/a 2n/an/an/an/an/a37



Japan Tobacco Inc.

US Patent


Assay Description
The stable cell line expressing human SGLT1 was seeded at 5x104 cells/well on BioCoat Poly-D-Lysine 96 well plate with Lid (Becton Dickinson and Comp...


US Patent US8846746 (2014)


BindingDB Entry DOI: 10.7270/Q27M06MJ
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM132810
PNG
(US8846746, 77)
Show SMILES CCCc1cccc(c1)-c1cc(NC(=O)[C@@H]2CNC(=O)C2)nn1-c1cccc(C)c1 |r|
Show InChI InChI=1S/C24H26N4O2/c1-3-6-17-8-5-9-18(12-17)21-14-22(26-24(30)19-13-23(29)25-15-19)27-28(21)20-10-4-7-16(2)11-20/h4-5,7-12,14,19H,3,6,13,15H2,1-2H3,(H,25,29)(H,26,27,30)/t19-/m0/s1
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n/an/a 2n/an/an/an/an/a37



Japan Tobacco Inc.

US Patent


Assay Description
The stable cell line expressing human SGLT1 was seeded at 5x104 cells/well on BioCoat Poly-D-Lysine 96 well plate with Lid (Becton Dickinson and Comp...


US Patent US8846746 (2014)


BindingDB Entry DOI: 10.7270/Q27M06MJ
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50242615
PNG
(CHEMBL486028 | QCPac)
Show SMILES C[C@H](NC(=O)[C@@H]1CCCN1C(C)=O)C(=O)N[C@@H](CS)C(O)=O |r|
Show InChI InChI=1S/C13H21N3O5S/c1-7(11(18)15-9(6-22)13(20)21)14-12(19)10-4-3-5-16(10)8(2)17/h7,9-10,22H,3-6H2,1-2H3,(H,14,19)(H,15,18)(H,20,21)/t7-,9-,10-/m0/s1
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n/an/a 2n/an/an/an/an/an/a



University Würzburg

Curated by ChEMBL


Assay Description
Inhibition of human SGLT1 expressed in xenopus laevis oocyte assessed as inhibition of methyl-alpha-D-[14C]glucopyranoside uptake after 1 hrs


J Biol Chem 282: 28501-13 (2007)


Article DOI: 10.1074/jbc.M705416200
BindingDB Entry DOI: 10.7270/Q2SJ1KCM
More data for this
Ligand-Target Pair
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