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Compile Data Set for Download or QSAR

Found 46 hits of ki 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))
BDBM20877
PNG
(3-(1-benzofuran-5-yl)-1-(2-hydroxy-4-methyl-6-{[(2...)
Show SMILES Cc1cc(O)c(C(=O)CCc2ccc3occc3c2)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1
Show InChI InChI=1S/C24H26O9/c1-12-8-16(27)20(15(26)4-2-13-3-5-17-14(10-13)6-7-31-17)18(9-12)32-24-23(30)22(29)21(28)19(11-25)33-24/h3,5-10,19,21-25,27-30H,2,4,11H2,1H3/t19-,21-,22+,23-,24-/m1/s1
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50n/an/an/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
In vitro inhibition of Na-dependent [14C]-AMG uptake in CHO-K1 cells expressing human sodium glucose co-transporter 1


Bioorg Med Chem Lett 14: 5121-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.082
BindingDB Entry DOI: 10.7270/Q2VD6XX2
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50595439
PNG
(CHEMBL5178665)
Show SMILES CC(C)c1[nH]nc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1Cc1ccc(OCCCNCCC(N)=O)cc1C |r|
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97n/an/an/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00867
BindingDB Entry DOI: 10.7270/Q2FB570W
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM20875
PNG
(1-(2,4-dihydroxy-6-{[(2S,3R,4S,5S,6R)-3,4,5-trihyd...)
Show SMILES OC[C@H]1O[C@@H](Oc2cc(O)cc(O)c2C(=O)CCc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C21H24O10/c22-9-16-18(27)19(28)20(29)21(31-16)30-15-8-12(24)7-14(26)17(15)13(25)6-3-10-1-4-11(23)5-2-10/h1-2,4-5,7-8,16,18-24,26-29H,3,6,9H2/t16-,18-,19+,20-,21-/m1/s1
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180n/an/an/an/an/an/an/an/a



Max-Planck-Institut f£r molekulare Physiologie

Curated by ChEMBL


Assay Description
Binding affinity against Sodium/glucose co-transporter of isolated renal brush border membranes.


J Med Chem 43: 1692-8 (2000)


BindingDB Entry DOI: 10.7270/Q261112H
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50422357
PNG
(CHEMBL2303984)
Show SMILES OC[C@@H]1O[C@@H](Oc2cccc(O)c2C(=O)CCc2ccc(O)cc2)[C@@H](O)[C@@H](O)[C@@H]1O |r|
Show InChI InChI=1S/C21H24O9/c22-10-16-18(26)19(27)20(28)21(30-16)29-15-3-1-2-13(24)17(15)14(25)9-6-11-4-7-12(23)8-5-11/h1-5,7-8,16,18-24,26-28H,6,9-10H2/t16-,18+,19-,20-,21+/m0/s1
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560n/an/an/an/an/an/an/an/a



Max-Planck-Institut f£r molekulare Physiologie

Curated by ChEMBL


Assay Description
Binding affinity against Sodium/glucose co-transporter of isolated renal brush border membranes.


J Med Chem 43: 1692-8 (2000)


BindingDB Entry DOI: 10.7270/Q261112H
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM20878
PNG
((2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-{2-[(4-methox...)
Show SMILES COc1ccc(Cc2ccccc2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1
Show InChI InChI=1S/C20H24O7/c1-25-14-8-6-12(7-9-14)10-13-4-2-3-5-15(13)26-20-19(24)18(23)17(22)16(11-21)27-20/h2-9,16-24H,10-11H2,1H3/t16-,17-,18+,19-,20-/m1/s1
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708n/an/an/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00867
BindingDB Entry DOI: 10.7270/Q2FB570W
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50153313
PNG
(3-Cyclohexyl-1-[2-hydroxy-4-methyl-6-(3,4,5-trihyd...)
Show SMILES Cc1cc(O)c(C(=O)CCC2CCCCC2)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1
Show InChI InChI=1S/C22H32O8/c1-12-9-15(25)18(14(24)8-7-13-5-3-2-4-6-13)16(10-12)29-22-21(28)20(27)19(26)17(11-23)30-22/h9-10,13,17,19-23,25-28H,2-8,11H2,1H3/t17-,19-,20+,21-,22-/m1/s1
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1.08E+3n/an/an/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
In vitro inhibition of Na-dependent [14C]-AMG uptake in CHO-K1 cells expressing human sodium glucose co-transporter 1


Bioorg Med Chem Lett 14: 5121-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.082
BindingDB Entry DOI: 10.7270/Q2VD6XX2
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50153312
PNG
(1-[2-Hydroxy-4-methyl-6-(3,4,5-trihydroxy-6-hydrox...)
Show SMILES Cc1cc(O)c(C(=O)CCc2ccc3ccccc3c2)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1
Show InChI InChI=1S/C26H28O8/c1-14-10-19(29)22(18(28)9-7-15-6-8-16-4-2-3-5-17(16)12-15)20(11-14)33-26-25(32)24(31)23(30)21(13-27)34-26/h2-6,8,10-12,21,23-27,29-32H,7,9,13H2,1H3/t21-,23-,24+,25-,26-/m1/s1
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1.32E+3n/an/an/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
In vitro inhibition of Na-dependent [14C]-AMG uptake in CHO-K1 cells expressing human sodium glucose co-transporter 1


Bioorg Med Chem Lett 14: 5121-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.082
BindingDB Entry DOI: 10.7270/Q2VD6XX2
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50153306
PNG
(1-[2-Hydroxy-4-methyl-6-(3,4,5-trihydroxy-6-hydrox...)
Show SMILES Cc1cc(O)c(C(=O)CCc2ccsc2)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1
Show InChI InChI=1S/C20H24O8S/c1-10-6-13(23)16(12(22)3-2-11-4-5-29-9-11)14(7-10)27-20-19(26)18(25)17(24)15(8-21)28-20/h4-7,9,15,17-21,23-26H,2-3,8H2,1H3/t15-,17-,18+,19-,20-/m1/s1
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1.38E+3n/an/an/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
In vitro inhibition of Na-dependent [14C]-AMG uptake in CHO-K1 cells expressing human sodium glucose co-transporter 1


Bioorg Med Chem Lett 14: 5121-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.082
BindingDB Entry DOI: 10.7270/Q2VD6XX2
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50153302
PNG
(3-(2,3-Dihydro-benzo[1,4]dioxin-6-yl)-1-[2-hydroxy...)
Show SMILES Cc1cc(O)c(C(=O)CCc2ccc3OCCOc3c2)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1
Show InChI InChI=1S/C24H28O10/c1-12-8-15(27)20(14(26)4-2-13-3-5-16-17(10-13)32-7-6-31-16)18(9-12)33-24-23(30)22(29)21(28)19(11-25)34-24/h3,5,8-10,19,21-25,27-30H,2,4,6-7,11H2,1H3/t19-,21-,22+,23-,24-/m1/s1
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1.46E+3n/an/an/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
In vitro inhibition of Na-dependent [14C]-AMG uptake in CHO-K1 cells expressing human sodium glucose co-transporter 1


Bioorg Med Chem Lett 14: 5121-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.082
BindingDB Entry DOI: 10.7270/Q2VD6XX2
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50153301
PNG
(3-(4-Ethoxy-phenyl)-1-[2-hydroxy-4-methyl-6-(3,4,5...)
Show SMILES CCOc1ccc(CCC(=O)c2c(O)cc(C)cc2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1
Show InChI InChI=1S/C24H30O9/c1-3-31-15-7-4-14(5-8-15)6-9-16(26)20-17(27)10-13(2)11-18(20)32-24-23(30)22(29)21(28)19(12-25)33-24/h4-5,7-8,10-11,19,21-25,27-30H,3,6,9,12H2,1-2H3/t19-,21-,22+,23-,24-/m1/s1
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1.57E+3n/an/an/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
In vitro inhibition of Na-dependent [14C]-AMG uptake in CHO-K1 cells expressing human sodium glucose co-transporter 1


Bioorg Med Chem Lett 14: 5121-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.082
BindingDB Entry DOI: 10.7270/Q2VD6XX2
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50087823
PNG
(1-[2-(4,5-Dihydroxy-6-hydroxymethyl-tetrahydro-pyr...)
Show SMILES OCC1OC(CC(O)C1O)Oc1cc(O)cc(O)c1C(=O)CCc1ccc(O)cc1
Show InChI InChI=1S/C21H24O9/c22-10-18-21(28)16(27)9-19(30-18)29-17-8-13(24)7-15(26)20(17)14(25)6-3-11-1-4-12(23)5-2-11/h1-2,4-5,7-8,16,18-19,21-24,26-28H,3,6,9-10H2
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2.60E+3n/an/an/an/an/an/an/an/a



Max-Planck-Institut f£r molekulare Physiologie

Curated by ChEMBL


Assay Description
Binding affinity against Sodium/glucose co-transporter of isolated renal brush border membranes.


J Med Chem 43: 1692-8 (2000)


BindingDB Entry DOI: 10.7270/Q261112H
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50422353
PNG
(CHEMBL2303988)
Show SMILES COc1ccc(CCC(=O)c2c(O)cc(O)cc2O[C@@H]2O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)cc1 |r|
Show InChI InChI=1S/C22H26O10/c1-30-13-5-2-11(3-6-13)4-7-14(25)18-15(26)8-12(24)9-16(18)31-22-21(29)20(28)19(27)17(10-23)32-22/h2-3,5-6,8-9,17,19-24,26-29H,4,7,10H2,1H3/t17-,19+,20-,21-,22+/m0/s1
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2.80E+3n/an/an/an/an/an/an/an/a



Max-Planck-Institut f£r molekulare Physiologie

Curated by ChEMBL


Assay Description
Binding affinity against Sodium/glucose co-transporter of isolated renal brush border membranes.


J Med Chem 43: 1692-8 (2000)


BindingDB Entry DOI: 10.7270/Q261112H
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50153292
PNG
(1-[4-Fluoro-2-hydroxy-6-(3,4,5-trihydroxy-6-hydrox...)
Show SMILES OC[C@H]1O[C@@H](Oc2cc(F)cc(O)c2C(=O)CCc2ccc3ccccc3c2)[C@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C25H25FO8/c26-16-10-18(29)21(17(28)8-6-13-5-7-14-3-1-2-4-15(14)9-13)19(11-16)33-25-24(32)23(31)22(30)20(12-27)34-25/h1-5,7,9-11,20,22-25,27,29-32H,6,8,12H2/t20-,22-,23+,24-,25-/m1/s1
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3.69E+3n/an/an/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
In vitro inhibition of Na-dependent [14C]-AMG uptake in CHO-K1 cells expressing human sodium glucose co-transporter 1


Bioorg Med Chem Lett 14: 5121-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.082
BindingDB Entry DOI: 10.7270/Q2VD6XX2
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50153293
PNG
(1-[4-Chloro-2-hydroxy-6-(3,4,5-trihydroxy-6-hydrox...)
Show SMILES OC[C@H]1O[C@@H](Oc2cc(Cl)cc(O)c2C(=O)CCc2ccc3OCCOc3c2)[C@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C23H25ClO10/c24-12-8-14(27)19(13(26)3-1-11-2-4-15-16(7-11)32-6-5-31-15)17(9-12)33-23-22(30)21(29)20(28)18(10-25)34-23/h2,4,7-9,18,20-23,25,27-30H,1,3,5-6,10H2/t18-,20-,21+,22-,23-/m1/s1
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3.75E+3n/an/an/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
In vitro inhibition of Na-dependent [14C]-AMG uptake in CHO-K1 cells expressing human sodium glucose co-transporter 1


Bioorg Med Chem Lett 14: 5121-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.082
BindingDB Entry DOI: 10.7270/Q2VD6XX2
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50422355
PNG
(CHEMBL2303989)
Show SMILES Nc1cc(CCC(=O)c2c(O)cc(O)cc2O[C@@H]2O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)ccc1O |r|
Show InChI InChI=1S/C21H25NO10/c22-11-5-9(1-3-12(11)25)2-4-13(26)17-14(27)6-10(24)7-15(17)31-21-20(30)19(29)18(28)16(8-23)32-21/h1,3,5-7,16,18-21,23-25,27-30H,2,4,8,22H2/t16-,18+,19-,20-,21+/m0/s1
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3.80E+3n/an/an/an/an/an/an/an/a



Max-Planck-Institut f£r molekulare Physiologie

Curated by ChEMBL


Assay Description
Binding affinity against Sodium/glucose co-transporter of isolated renal brush border membranes.


J Med Chem 43: 1692-8 (2000)


BindingDB Entry DOI: 10.7270/Q261112H
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50153303
PNG
(3-Furan-3-yl-1-[2-hydroxy-4-methyl-6-(3,4,5-trihyd...)
Show SMILES Cc1cc(O)c(C(=O)CCc2ccoc2)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1
Show InChI InChI=1S/C20H24O9/c1-10-6-13(23)16(12(22)3-2-11-4-5-27-9-11)14(7-10)28-20-19(26)18(25)17(24)15(8-21)29-20/h4-7,9,15,17-21,23-26H,2-3,8H2,1H3/t15-,17-,18+,19-,20-/m1/s1
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4.38E+3n/an/an/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
In vitro inhibition of Na-dependent [14C]-AMG uptake in CHO-K1 cells expressing human sodium glucose co-transporter 1


Bioorg Med Chem Lett 14: 5121-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.082
BindingDB Entry DOI: 10.7270/Q2VD6XX2
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50559516
PNG
(GSK-189075 | GSK-189075A | GSK189075A | Remogliflo...)
Show SMILES [H][C@]1(COC(=O)OCC)O[C@@]([H])(Oc2nn(C(C)C)c(C)c2Cc2ccc(OC(C)C)cc2)[C@]([H])(O)[C@@]([H])(O)[C@]1([H])O |r|
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4.52E+3n/an/an/an/an/an/an/an/a


TBA

Assay Description
Antagonist potency at cloned recombinant human adenosine A2B receptor transfected in CHO cells by cAMP assay


Citation and Details
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50153299
PNG
(1-[4-Chloro-2-hydroxy-6-(3,4,5-trihydroxy-6-hydrox...)
Show SMILES CCOc1ccc(CCC(=O)c2c(O)cc(Cl)cc2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1
Show InChI InChI=1S/C23H27ClO9/c1-2-31-14-6-3-12(4-7-14)5-8-15(26)19-16(27)9-13(24)10-17(19)32-23-22(30)21(29)20(28)18(11-25)33-23/h3-4,6-7,9-10,18,20-23,25,27-30H,2,5,8,11H2,1H3/t18-,20-,21+,22-,23-/m1/s1
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4.64E+3n/an/an/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
In vitro inhibition of Na-dependent [14C]-AMG uptake in CHO-K1 cells expressing human sodium glucose co-transporter 1


Bioorg Med Chem Lett 14: 5121-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.082
BindingDB Entry DOI: 10.7270/Q2VD6XX2
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50153296
PNG
(1-[4-Chloro-2-hydroxy-6-(3,4,5-trihydroxy-6-hydrox...)
Show SMILES OC[C@H]1O[C@@H](Oc2cc(Cl)cc(O)c2C(=O)CCc2ccc3ccccc3c2)[C@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C25H25ClO8/c26-16-10-18(29)21(17(28)8-6-13-5-7-14-3-1-2-4-15(14)9-13)19(11-16)33-25-24(32)23(31)22(30)20(12-27)34-25/h1-5,7,9-11,20,22-25,27,29-32H,6,8,12H2/t20-,22-,23+,24-,25-/m1/s1
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4.78E+3n/an/an/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
In vitro inhibition of Na-dependent [14C]-AMG uptake in CHO-K1 cells expressing human sodium glucose co-transporter 1


Bioorg Med Chem Lett 14: 5121-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.082
BindingDB Entry DOI: 10.7270/Q2VD6XX2
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50422350
PNG
(CHEMBL2303987)
Show SMILES OC[C@@H]1O[C@@H](Oc2cc(O)cc(O)c2C(=O)CCc2ccc(O)c(c2)N=Cc2ccc(cc2)[N+]([O-])=O)[C@@H](O)[C@@H](O)[C@@H]1O |r,w:26.28|
Show InChI InChI=1S/C28H28N2O12/c31-13-23-25(36)26(37)27(38)28(42-23)41-22-11-17(32)10-21(35)24(22)20(34)8-4-14-3-7-19(33)18(9-14)29-12-15-1-5-16(6-2-15)30(39)40/h1-3,5-7,9-12,23,25-28,31-33,35-38H,4,8,13H2/t23-,25+,26-,27-,28+/m0/s1
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5.30E+3n/an/an/an/an/an/an/an/a



Max-Planck-Institut f£r molekulare Physiologie

Curated by ChEMBL


Assay Description
Binding affinity against Sodium/glucose co-transporter of isolated renal brush border membranes.


J Med Chem 43: 1692-8 (2000)


BindingDB Entry DOI: 10.7270/Q261112H
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50153298
PNG
(3-(2,3-Dihydro-benzo[1,4]dioxin-6-yl)-1-[4-ethyl-2...)
Show SMILES CCc1cc(O)c(C(=O)CCc2ccc3OCCOc3c2)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1
Show InChI InChI=1S/C25H30O10/c1-2-13-9-16(28)21(15(27)5-3-14-4-6-17-18(11-14)33-8-7-32-17)19(10-13)34-25-24(31)23(30)22(29)20(12-26)35-25/h4,6,9-11,20,22-26,28-31H,2-3,5,7-8,12H2,1H3/t20-,22-,23+,24-,25-/m1/s1
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6.28E+3n/an/an/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
In vitro inhibition of Na-dependent [14C]-AMG uptake in CHO-K1 cells expressing human sodium glucose co-transporter 1


Bioorg Med Chem Lett 14: 5121-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.082
BindingDB Entry DOI: 10.7270/Q2VD6XX2
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50153305
PNG
(1-[4-Ethyl-2-hydroxy-6-(3,4,5-trihydroxy-6-hydroxy...)
Show SMILES CCc1cc(O)c(C(=O)CCc2ccc3ccccc3c2)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1
Show InChI InChI=1S/C27H30O8/c1-2-15-12-20(30)23(19(29)10-8-16-7-9-17-5-3-4-6-18(17)11-16)21(13-15)34-27-26(33)25(32)24(31)22(14-28)35-27/h3-7,9,11-13,22,24-28,30-33H,2,8,10,14H2,1H3/t22-,24-,25+,26-,27-/m1/s1
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6.50E+3n/an/an/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
In vitro inhibition of Na-dependent [14C]-AMG uptake in CHO-K1 cells expressing human sodium glucose co-transporter 1


Bioorg Med Chem Lett 14: 5121-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.082
BindingDB Entry DOI: 10.7270/Q2VD6XX2
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50422349
PNG
(CHEMBL2303986)
Show SMILES OC[C@@H]1O[C@@H](Oc2cc(O)cc(O)c2C(=O)CCc2ccc(O)c(NC(=O)CI)c2)[C@@H](O)[C@@H](O)[C@@H]1O |r|
Show InChI InChI=1S/C23H26INO11/c24-8-18(31)25-12-5-10(1-3-13(12)28)2-4-14(29)19-15(30)6-11(27)7-16(19)35-23-22(34)21(33)20(32)17(9-26)36-23/h1,3,5-7,17,20-23,26-28,30,32-34H,2,4,8-9H2,(H,25,31)/t17-,20+,21-,22-,23+/m0/s1
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7.00E+3n/an/an/an/an/an/an/an/a



Max-Planck-Institut f£r molekulare Physiologie

Curated by ChEMBL


Assay Description
Binding affinity against Sodium/glucose co-transporter of isolated renal brush border membranes.


J Med Chem 43: 1692-8 (2000)


BindingDB Entry DOI: 10.7270/Q261112H
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50351429
PNG
(CHEMBL450044)
Show SMILES CCOC(=O)OCC1OC(Oc2ccccc2Cc2ccc(OC)cc2)C(O)C(O)C1O
Show InChI InChI=1S/C23H28O9/c1-3-29-23(27)30-13-18-19(24)20(25)21(26)22(32-18)31-17-7-5-4-6-15(17)12-14-8-10-16(28-2)11-9-14/h4-11,18-22,24-26H,3,12-13H2,1-2H3
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7.54E+3n/an/an/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00867
BindingDB Entry DOI: 10.7270/Q2FB570W
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50422348
PNG
(CHEMBL2303985)
Show SMILES OC[C@@H]1O[C@@H](Oc2cc(O)cc(O)c2C(=O)CCc2ccc(O)c(NC(=O)CBr)c2)[C@@H](O)[C@@H](O)[C@@H]1O |r|
Show InChI InChI=1S/C23H26BrNO11/c24-8-18(31)25-12-5-10(1-3-13(12)28)2-4-14(29)19-15(30)6-11(27)7-16(19)35-23-22(34)21(33)20(32)17(9-26)36-23/h1,3,5-7,17,20-23,26-28,30,32-34H,2,4,8-9H2,(H,25,31)/t17-,20+,21-,22-,23+/m0/s1
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7.70E+3n/an/an/an/an/an/an/an/a



Max-Planck-Institut f£r molekulare Physiologie

Curated by ChEMBL


Assay Description
Binding affinity against Sodium/glucose co-transporter of isolated renal brush border membranes.


J Med Chem 43: 1692-8 (2000)


BindingDB Entry DOI: 10.7270/Q261112H
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50153294
PNG
(3-(4-Ethoxy-phenyl)-1-[4-ethyl-2-hydroxy-6-(3,4,5-...)
Show SMILES CCOc1ccc(CCC(=O)c2c(O)cc(CC)cc2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1
Show InChI InChI=1S/C25H32O9/c1-3-14-11-18(28)21(17(27)10-7-15-5-8-16(9-6-15)32-4-2)19(12-14)33-25-24(31)23(30)22(29)20(13-26)34-25/h5-6,8-9,11-12,20,22-26,28-31H,3-4,7,10,13H2,1-2H3/t20-,22-,23+,24-,25-/m1/s1
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8.39E+3n/an/an/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
In vitro inhibition of Na-dependent [14C]-AMG uptake in CHO-K1 cells expressing human sodium glucose co-transporter 1


Bioorg Med Chem Lett 14: 5121-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.082
BindingDB Entry DOI: 10.7270/Q2VD6XX2
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50153307
PNG
(1-[2-Hydroxy-4-isopropyl-6-(3,4,5-trihydroxy-6-hyd...)
Show SMILES CC(C)c1cc(O)c(C(=O)CCc2ccc3ccccc3c2)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1
Show InChI InChI=1S/C28H32O8/c1-15(2)19-12-21(31)24(20(30)10-8-16-7-9-17-5-3-4-6-18(17)11-16)22(13-19)35-28-27(34)26(33)25(32)23(14-29)36-28/h3-7,9,11-13,15,23,25-29,31-34H,8,10,14H2,1-2H3/t23-,25-,26+,27-,28-/m1/s1
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8.59E+3n/an/an/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
In vitro inhibition of Na-dependent [14C]-AMG uptake in CHO-K1 cells expressing human sodium glucose co-transporter 1


Bioorg Med Chem Lett 14: 5121-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.082
BindingDB Entry DOI: 10.7270/Q2VD6XX2
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50153308
PNG
(1-[2-Amino-4-methyl-6-(3,4,5-trihydroxy-6-hydroxym...)
Show SMILES Cc1cc(N)c(C(=O)CCc2ccc3ccccc3c2)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1
Show InChI InChI=1S/C26H29NO7/c1-14-10-18(27)22(19(29)9-7-15-6-8-16-4-2-3-5-17(16)12-15)20(11-14)33-26-25(32)24(31)23(30)21(13-28)34-26/h2-6,8,10-12,21,23-26,28,30-32H,7,9,13,27H2,1H3/t21-,23-,24+,25-,26-/m1/s1
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9.89E+3n/an/an/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
In vitro inhibition of Na-dependent [14C]-AMG uptake in CHO-K1 cells expressing human sodium glucose co-transporter 1


Bioorg Med Chem Lett 14: 5121-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.082
BindingDB Entry DOI: 10.7270/Q2VD6XX2
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50153297
PNG
(1-[2-Amino-4-methyl-6-(3,4,5-trihydroxy-6-hydroxym...)
Show SMILES CCOc1ccc(CCC(=O)c2c(N)cc(C)cc2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1
Show InChI InChI=1S/C24H31NO8/c1-3-31-15-7-4-14(5-8-15)6-9-17(27)20-16(25)10-13(2)11-18(20)32-24-23(30)22(29)21(28)19(12-26)33-24/h4-5,7-8,10-11,19,21-24,26,28-30H,3,6,9,12,25H2,1-2H3/t19-,21-,22+,23-,24-/m1/s1
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1.35E+4n/an/an/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
In vitro inhibition of Na-dependent [14C]-AMG uptake in CHO-K1 cells expressing human sodium glucose co-transporter 1


Bioorg Med Chem Lett 14: 5121-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.082
BindingDB Entry DOI: 10.7270/Q2VD6XX2
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50409197
PNG
(CHEMBL2096900)
Show SMILES OC[C@H]1O[C@H](Oc2cc(O)cc(O)c2C(=O)CCc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O |r|
Show InChI InChI=1S/C21H24O10/c22-9-16-18(27)19(28)20(29)21(31-16)30-15-8-12(24)7-14(26)17(15)13(25)6-3-10-1-4-11(23)5-2-10/h1-2,4-5,7-8,16,18-24,26-29H,3,6,9H2/t16-,18-,19+,20-,21+/m1/s1
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1.40E+4n/an/an/an/an/an/an/an/a



Max-Planck-Institut f£r molekulare Physiologie

Curated by ChEMBL


Assay Description
Binding affinity against Sodium/glucose co-transporter of isolated renal brush border membranes.


J Med Chem 43: 1692-8 (2000)


BindingDB Entry DOI: 10.7270/Q261112H
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50153309
PNG
(3-(2,3-Dihydro-benzo[1,4]dioxin-6-yl)-1-[2-hydroxy...)
Show SMILES CC(C)c1cc(O)c(C(=O)CCc2ccc3OCCOc3c2)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1
Show InChI InChI=1S/C26H32O10/c1-13(2)15-10-17(29)22(16(28)5-3-14-4-6-18-19(9-14)34-8-7-33-18)20(11-15)35-26-25(32)24(31)23(30)21(12-27)36-26/h4,6,9-11,13,21,23-27,29-32H,3,5,7-8,12H2,1-2H3/t21-,23-,24+,25-,26-/m1/s1
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1.61E+4n/an/an/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
In vitro inhibition of Na-dependent [14C]-AMG uptake in CHO-K1 cells expressing human sodium glucose co-transporter 1


Bioorg Med Chem Lett 14: 5121-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.082
BindingDB Entry DOI: 10.7270/Q2VD6XX2
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50153311
PNG
(1-[2-Amino-4-methyl-6-(3,4,5-trihydroxy-6-hydroxym...)
Show SMILES Cc1cc(N)c(C(=O)CCc2ccc3OCCOc3c2)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1
Show InChI InChI=1S/C24H29NO9/c1-12-8-14(25)20(15(27)4-2-13-3-5-16-17(10-13)32-7-6-31-16)18(9-12)33-24-23(30)22(29)21(28)19(11-26)34-24/h3,5,8-10,19,21-24,26,28-30H,2,4,6-7,11,25H2,1H3/t19-,21-,22+,23-,24-/m1/s1
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1.62E+4n/an/an/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
In vitro inhibition of Na-dependent [14C]-AMG uptake in CHO-K1 cells expressing human sodium glucose co-transporter 1


Bioorg Med Chem Lett 14: 5121-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.082
BindingDB Entry DOI: 10.7270/Q2VD6XX2
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50422352
PNG
(CHEMBL2303990)
Show SMILES OC[C@@H]1O[C@@H](Oc2cc(O)cc(O)c2C(=O)CCc2ccc(O)c(c2)[N+]([O-])=O)[C@@H](O)[C@@H](O)[C@@H]1O |r|
Show InChI InChI=1S/C21H23NO12/c23-8-16-18(28)19(29)20(30)21(34-16)33-15-7-10(24)6-14(27)17(15)13(26)4-2-9-1-3-12(25)11(5-9)22(31)32/h1,3,5-7,16,18-21,23-25,27-30H,2,4,8H2/t16-,18+,19-,20-,21+/m0/s1
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2.16E+4n/an/an/an/an/an/an/an/a



Max-Planck-Institut f£r molekulare Physiologie

Curated by ChEMBL


Assay Description
Binding affinity against Sodium/glucose co-transporter of isolated renal brush border membranes.


J Med Chem 43: 1692-8 (2000)


BindingDB Entry DOI: 10.7270/Q261112H
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50422346
PNG
(CHEMBL2303991)
Show SMILES OC[C@@H]1O[C@@H](Oc2cc(O)c(Br)c(O)c2C(=O)CCc2cc(Br)c(O)c(Br)c2)[C@@H](O)[C@@H](O)[C@@H]1O |r|
Show InChI InChI=1S/C21H21Br3O10/c22-8-3-7(4-9(23)16(8)28)1-2-10(26)14-12(5-11(27)15(24)18(14)30)33-21-20(32)19(31)17(29)13(6-25)34-21/h3-5,13,17,19-21,25,27-32H,1-2,6H2/t13-,17+,19-,20-,21+/m0/s1
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2.31E+4n/an/an/an/an/an/an/an/a



Max-Planck-Institut f£r molekulare Physiologie

Curated by ChEMBL


Assay Description
Binding affinity against Sodium/glucose co-transporter of isolated renal brush border membranes.


J Med Chem 43: 1692-8 (2000)


BindingDB Entry DOI: 10.7270/Q261112H
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50153304
PNG
(3-(4-Ethoxy-phenyl)-1-[2-hydroxy-4-isopropyl-6-(3,...)
Show SMILES CCOc1ccc(CCC(=O)c2c(O)cc(cc2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C(C)C)cc1
Show InChI InChI=1S/C26H34O9/c1-4-33-17-8-5-15(6-9-17)7-10-18(28)22-19(29)11-16(14(2)3)12-20(22)34-26-25(32)24(31)23(30)21(13-27)35-26/h5-6,8-9,11-12,14,21,23-27,29-32H,4,7,10,13H2,1-3H3/t21-,23-,24+,25-,26-/m1/s1
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3.31E+4n/an/an/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
In vitro inhibition of Na-dependent [14C]-AMG uptake in CHO-K1 cells expressing human sodium glucose co-transporter 1


Bioorg Med Chem Lett 14: 5121-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.082
BindingDB Entry DOI: 10.7270/Q2VD6XX2
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50422351
PNG
(CHEMBL2303981)
Show SMILES OC[C@@H]1O[C@@H](Oc2c(I)c(O)cc(O)c2C(=O)CCc2ccc(O)c(NC(=O)CI)c2)[C@@H](O)[C@@H](O)[C@@H]1O |r|
Show InChI InChI=1S/C23H25I2NO11/c24-7-16(32)26-10-5-9(1-3-11(10)28)2-4-12(29)17-13(30)6-14(31)18(25)22(17)37-23-21(35)20(34)19(33)15(8-27)36-23/h1,3,5-6,15,19-21,23,27-28,30-31,33-35H,2,4,7-8H2,(H,26,32)/t15-,19+,20-,21-,23-/m0/s1
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4.00E+4n/an/an/an/an/an/an/an/a



Max-Planck-Institut f£r molekulare Physiologie

Curated by ChEMBL


Assay Description
Binding affinity against Sodium/glucose co-transporter of isolated renal brush border membranes.


J Med Chem 43: 1692-8 (2000)


BindingDB Entry DOI: 10.7270/Q261112H
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50153300
PNG
(1-[2-Chloro-6-(3,4,5-trihydroxy-6-hydroxymethyl-te...)
Show SMILES CCOc1ccc(CCC(=O)c2c(Cl)cccc2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1
Show InChI InChI=1S/C23H27ClO8/c1-2-30-14-9-6-13(7-10-14)8-11-16(26)19-15(24)4-3-5-17(19)31-23-22(29)21(28)20(27)18(12-25)32-23/h3-7,9-10,18,20-23,25,27-29H,2,8,11-12H2,1H3/t18-,20-,21+,22-,23-/m1/s1
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>4.50E+4n/an/an/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
In vitro inhibition of Na-dependent [14C]-AMG uptake in CHO-K1 cells expressing human sodium glucose co-transporter 1


Bioorg Med Chem Lett 14: 5121-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.082
BindingDB Entry DOI: 10.7270/Q2VD6XX2
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50153310
PNG
(1-[2-Chloro-6-(3,4,5-trihydroxy-6-hydroxymethyl-te...)
Show SMILES OC[C@H]1O[C@@H](Oc2cccc(Cl)c2C(=O)CCc2ccc3ccccc3c2)[C@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C25H25ClO7/c26-17-6-3-7-19(32-25-24(31)23(30)22(29)20(13-27)33-25)21(17)18(28)11-9-14-8-10-15-4-1-2-5-16(15)12-14/h1-8,10,12,20,22-25,27,29-31H,9,11,13H2/t20-,22-,23+,24-,25-/m1/s1
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>4.50E+4n/an/an/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
In vitro inhibition of Na-dependent [14C]-AMG uptake in CHO-K1 cells expressing human sodium glucose co-transporter 1


Bioorg Med Chem Lett 14: 5121-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.082
BindingDB Entry DOI: 10.7270/Q2VD6XX2
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50422356
PNG
(CHEMBL2303983)
Show SMILES CO[C@H]1[C@H](O)[C@H](CO)O[C@@H](Oc2cc(O)cc(O)c2C(=O)CCc2ccc(O)cc2)[C@H]1O |r|
Show InChI InChI=1S/C22H26O10/c1-30-21-19(28)17(10-23)32-22(20(21)29)31-16-9-13(25)8-15(27)18(16)14(26)7-4-11-2-5-12(24)6-3-11/h2-3,5-6,8-9,17,19-25,27-29H,4,7,10H2,1H3/t17-,19+,20-,21-,22+/m0/s1
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4.50E+4n/an/an/an/an/an/an/an/a



Max-Planck-Institut f£r molekulare Physiologie

Curated by ChEMBL


Assay Description
Binding affinity against Sodium/glucose co-transporter of isolated renal brush border membranes.


J Med Chem 43: 1692-8 (2000)


BindingDB Entry DOI: 10.7270/Q261112H
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50153295
PNG
(1-[2-Chloro-6-(3,4,5-trihydroxy-6-hydroxymethyl-te...)
Show SMILES OC[C@H]1O[C@@H](Oc2cccc(Cl)c2C(=O)CCc2ccc3OCCOc3c2)[C@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C23H25ClO9/c24-13-2-1-3-16(32-23-22(29)21(28)20(27)18(11-25)33-23)19(13)14(26)6-4-12-5-7-15-17(10-12)31-9-8-30-15/h1-3,5,7,10,18,20-23,25,27-29H,4,6,8-9,11H2/t18-,20-,21+,22-,23-/m1/s1
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>4.50E+4n/an/an/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
In vitro inhibition of Na-dependent [14C]-AMG uptake in CHO-K1 cells expressing human sodium glucose co-transporter 1


Bioorg Med Chem Lett 14: 5121-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.082
BindingDB Entry DOI: 10.7270/Q2VD6XX2
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM23446
PNG
(3-(4-hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)prop...)
Show SMILES Oc1ccc(CCC(=O)c2c(O)cc(O)cc2O)cc1
Show InChI InChI=1S/C15H14O5/c16-10-4-1-9(2-5-10)3-6-12(18)15-13(19)7-11(17)8-14(15)20/h1-2,4-5,7-8,16-17,19-20H,3,6H2
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8.60E+4n/an/an/an/an/an/an/an/a



Max-Planck-Institut f£r molekulare Physiologie

Curated by ChEMBL


Assay Description
Binding affinity against Sodium/glucose co-transporter of isolated renal brush border membranes.


J Med Chem 43: 1692-8 (2000)


BindingDB Entry DOI: 10.7270/Q261112H
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50422345
PNG
(CHEMBL2303982)
Show SMILES OC[C@@H]1O[C@@H](Oc2c(Br)c(O)c(Br)c(O)c2C(=O)CCc2cc(Br)c(O)c(Br)c2)[C@@H](O)[C@@H](O)[C@@H]1O |r|
Show InChI InChI=1S/C21H20Br4O10/c22-7-3-6(4-8(23)14(7)28)1-2-9(27)11-16(30)12(24)17(31)13(25)20(11)35-21-19(33)18(32)15(29)10(5-26)34-21/h3-4,10,15,18-19,21,26,28-33H,1-2,5H2/t10-,15+,18-,19-,21-/m0/s1
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9.31E+4n/an/an/an/an/an/an/an/a



Max-Planck-Institut f£r molekulare Physiologie

Curated by ChEMBL


Assay Description
Binding affinity against Sodium/glucose co-transporter of isolated renal brush border membranes.


J Med Chem 43: 1692-8 (2000)


BindingDB Entry DOI: 10.7270/Q261112H
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50422358
PNG
(CHEMBL2303994)
Show SMILES CN(C)c1cccc2c(cccc12)S(=O)(=O)Nc1cc(CCC(=O)c2c(O)cc(O)cc2O[C@@H]2O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)ccc1O |r|
Show InChI InChI=1S/C33H36N2O12S/c1-35(2)22-7-3-6-20-19(22)5-4-8-28(20)48(44,45)34-21-13-17(9-11-23(21)38)10-12-24(39)29-25(40)14-18(37)15-26(29)46-33-32(43)31(42)30(41)27(16-36)47-33/h3-9,11,13-15,27,30-34,36-38,40-43H,10,12,16H2,1-2H3/t27-,30+,31-,32-,33+/m0/s1
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9.43E+4n/an/an/an/an/an/an/an/a



Max-Planck-Institut f£r molekulare Physiologie

Curated by ChEMBL


Assay Description
Binding affinity against Sodium/glucose co-transporter of isolated renal brush border membranes.


J Med Chem 43: 1692-8 (2000)


BindingDB Entry DOI: 10.7270/Q261112H
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50422354
PNG
(CHEMBL2303993)
Show SMILES OC[C@@H]1O[C@@H](Oc2cc(O)cc(O)c2C(=O)CCc2ccc(O)c(NC(=O)CCC(O)=O)c2)[C@@H](O)[C@@H](O)[C@@H]1O |r|
Show InChI InChI=1S/C25H29NO13/c27-10-18-22(35)23(36)24(37)25(39-18)38-17-9-12(28)8-16(31)21(17)15(30)4-2-11-1-3-14(29)13(7-11)26-19(32)5-6-20(33)34/h1,3,7-9,18,22-25,27-29,31,35-37H,2,4-6,10H2,(H,26,32)(H,33,34)/t18-,22+,23-,24-,25+/m0/s1
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1.16E+5n/an/an/an/an/an/an/an/a



Max-Planck-Institut f£r molekulare Physiologie

Curated by ChEMBL


Assay Description
Binding affinity against Sodium/glucose co-transporter of isolated renal brush border membranes.


J Med Chem 43: 1692-8 (2000)


BindingDB Entry DOI: 10.7270/Q261112H
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50422347
PNG
(CHEMBL2303992)
Show SMILES Nc1cc(CCC(=O)c2c(O)cc(O)cc2O[C@@H]2O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)cc(c1O)S(O)(=O)=O |r|
Show InChI InChI=1S/C21H25NO13S/c22-10-3-8(4-15(17(10)27)36(31,32)33)1-2-11(25)16-12(26)5-9(24)6-13(16)34-21-20(30)19(29)18(28)14(7-23)35-21/h3-6,14,18-21,23-24,26-30H,1-2,7,22H2,(H,31,32,33)/t14-,18+,19-,20-,21+/m0/s1
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1.52E+5n/an/an/an/an/an/an/an/a



Max-Planck-Institut f£r molekulare Physiologie

Curated by ChEMBL


Assay Description
Binding affinity against Sodium/glucose co-transporter of isolated renal brush border membranes.


J Med Chem 43: 1692-8 (2000)


BindingDB Entry DOI: 10.7270/Q261112H
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM50409196
PNG
(CHEMBL2029165)
Show SMILES OC[C@@H]1O[C@@H](Oc2cc(O)cc(O)c2C(=O)\C=C/c2ccc(O)cc2)[C@@H](O)[C@@H](O)[C@@H]1O |r|
Show InChI InChI=1S/C21H22O10/c22-9-16-18(27)19(28)20(29)21(31-16)30-15-8-12(24)7-14(26)17(15)13(25)6-3-10-1-4-11(23)5-2-10/h1-8,16,18-24,26-29H,9H2/b6-3-/t16-,18+,19-,20-,21+/m0/s1
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>1.00E+6n/an/an/an/an/an/an/an/a



Max-Planck-Institut f£r molekulare Physiologie

Curated by ChEMBL


Assay Description
Binding affinity against Sodium/glucose co-transporter of isolated renal brush border membranes.


J Med Chem 43: 1692-8 (2000)


BindingDB Entry DOI: 10.7270/Q261112H
More data for this
Ligand-Target Pair