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PubMed code 14552767

Compile data set for download or QSAR
Found 22 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
Ileal sodium/bile acid cotransporter


(Homo sapiens (Human))		BDBM50134416
PNG
(CHEMBL332974 | Trifluoro-acetate{4-[3-((8R,9R)-7,7...)
Show SMILES CCCCC1(CCCC)NS(=O)(=O)c2ccc(cc2[C@H]([C@H]1O)c1cccc(NC(=O)CCCC[N+](CC)(CC)CC)c1)N(C)C
Show InChI InChI=1S/C36H58N4O4S/c1-8-13-23-36(24-14-9-2)35(42)34(31-27-30(39(6)7)21-22-32(31)45(43,44)38-36)28-18-17-19-29(26-28)37-33(41)20-15-16-25-40(10-3,11-4)12-5/h17-19,21-22,26-27,34-35,38,42H,8-16,20,23-25H2,1-7H3/p+1/t34-,35-/m1/s1
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n/an/a 1.60n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against uptake of [14C]-taurocholate in baby hamster kidney cells transfected with cDNA from human Apical Sodium-Codepen...

Bioorg Med Chem Lett 13: 3727-30 (2003)


BindingDB Entry DOI: 10.7270/Q2M044T4
More data for this
Ligand-Target Pair
Ileal sodium/bile acid cotransporter


(Homo sapiens (Human))		BDBM50134424
PNG
(CHEMBL332973 | [2-(2-{2-[4-((8R,9R)-7,7-Dibutyl-2-...)
Show SMILES CCCCC1(CCCC)NS(=O)(=O)c2ccc(cc2[C@H]([C@H]1O)c1ccc(OCCOCCOCC[N+](CC)(CC)CC)cc1)N(C)C
Show InChI InChI=1S/C37H62N3O6S/c1-8-13-21-37(22-14-9-2)36(41)35(33-29-31(39(6)7)17-20-34(33)47(42,43)38-37)30-15-18-32(19-16-30)46-28-27-45-26-25-44-24-23-40(10-3,11-4)12-5/h15-20,29,35-36,38,41H,8-14,21-28H2,1-7H3/q+1/t35-,36-/m1/s1
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n/an/a 3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against uptake of [14C]-taurocholate in baby hamster kidney cells transfected with cDNA from human Apical Sodium-Codepen...

Bioorg Med Chem Lett 13: 3727-30 (2003)


BindingDB Entry DOI: 10.7270/Q2M044T4
More data for this
Ligand-Target Pair
Ileal sodium/bile acid cotransporter


(Homo sapiens (Human))		BDBM50134414
PNG
((8R,9R)-9-(3-Amino-phenyl)-7,7-dibutyl-2-dimethyla...)
Show SMILES CCCCC1(CCCC)NS(=O)(=O)c2ccc(cc2[C@H]([C@H]1O)c1cccc(N)c1)N(C)C
Show InChI InChI=1S/C25H37N3O3S/c1-5-7-14-25(15-8-6-2)24(29)23(18-10-9-11-19(26)16-18)21-17-20(28(3)4)12-13-22(21)32(30,31)27-25/h9-13,16-17,23-24,27,29H,5-8,14-15,26H2,1-4H3/t23-,24-/m1/s1
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n/an/a 6n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against uptake of [14C]-taurocholate in baby hamster kidney cells transfected with cDNA from human Apical Sodium-Codepen...

Bioorg Med Chem Lett 13: 3727-30 (2003)


BindingDB Entry DOI: 10.7270/Q2M044T4
More data for this
Ligand-Target Pair
Ileal sodium/bile acid cotransporter


(Homo sapiens (Human))		BDBM50134421
PNG
((8R,9R)-7,7-Dibutyl-2-dimethylamino-9-(4-hydroxy-p...)
Show SMILES CCCCC1(CCCC)NS(=O)(=O)c2ccc(cc2[C@H]([C@H]1O)c1ccc(O)cc1)N(C)C
Show InChI InChI=1S/C25H36N2O4S/c1-5-7-15-25(16-8-6-2)24(29)23(18-9-12-20(28)13-10-18)21-17-19(27(3)4)11-14-22(21)32(30,31)26-25/h9-14,17,23-24,26,28-29H,5-8,15-16H2,1-4H3/t23-,24-/m1/s1
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n/an/a 8n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against uptake of [14C]-taurocholate in baby hamster kidney cells transfected with cDNA from human Apical Sodium-Codepen...

Bioorg Med Chem Lett 13: 3727-30 (2003)


BindingDB Entry DOI: 10.7270/Q2M044T4
More data for this
Ligand-Target Pair
Ileal sodium/bile acid cotransporter


(Homo sapiens (Human))		BDBM50134425
PNG
(5-Bromo-pentanoic acid [3-((8R,9R)-7,7-dibutyl-2-d...)
Show SMILES CCCCC1(CCCC)NS(=O)(=O)c2ccc(cc2[C@H]([C@H]1O)c1cccc(NC(=O)CCCCBr)c1)N(C)C
Show InChI InChI=1S/C30H44BrN3O4S/c1-5-7-17-30(18-8-6-2)29(36)28(22-12-11-13-23(20-22)32-27(35)14-9-10-19-31)25-21-24(34(3)4)15-16-26(25)39(37,38)33-30/h11-13,15-16,20-21,28-29,33,36H,5-10,14,17-19H2,1-4H3,(H,32,35)/t28-,29-/m1/s1
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against uptake of [14C]-taurocholate in baby hamster kidney cells transfected with cDNA from human Apical Sodium-Codepen...

Bioorg Med Chem Lett 13: 3727-30 (2003)


BindingDB Entry DOI: 10.7270/Q2M044T4
More data for this
Ligand-Target Pair
Ileal sodium/bile acid cotransporter


(Homo sapiens (Human))		BDBM50134406
PNG
((8R,9R)-7,7-Dibutyl-2-dimethylamino-9-(4-methoxy-p...)
Show SMILES CCCCC1(CCCC)NS(=O)(=O)c2ccc(cc2[C@H]([C@H]1O)c1ccc(OC)cc1)N(C)C
Show InChI InChI=1S/C26H38N2O4S/c1-6-8-16-26(17-9-7-2)25(29)24(19-10-13-21(32-5)14-11-19)22-18-20(28(3)4)12-15-23(22)33(30,31)27-26/h10-15,18,24-25,27,29H,6-9,16-17H2,1-5H3/t24-,25-/m1/s1
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n/an/a 26n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against uptake of [14C]-taurocholate in baby hamster kidney cells transfected with cDNA from human Apical Sodium-Codepen...

Bioorg Med Chem Lett 13: 3727-30 (2003)


BindingDB Entry DOI: 10.7270/Q2M044T4
More data for this
Ligand-Target Pair
Ileal sodium/bile acid cotransporter


(Homo sapiens (Human))		BDBM50134419
PNG
((8R,9R)-7,7-Dibutyl-2-dimethylamino-5,5-dioxo-9-ph...)
Show SMILES CCCCC1(CCCC)NS(=O)(=O)c2ccc(cc2[C@H]([C@H]1O)c1ccccc1)N(C)C
Show InChI InChI=1S/C25H36N2O3S/c1-5-7-16-25(17-8-6-2)24(28)23(19-12-10-9-11-13-19)21-18-20(27(3)4)14-15-22(21)31(29,30)26-25/h9-15,18,23-24,26,28H,5-8,16-17H2,1-4H3/t23-,24-/m1/s1
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against uptake of [14C]-taurocholate in baby hamster kidney cells transfected with cDNA from human Apical Sodium-Codepen...

Bioorg Med Chem Lett 13: 3727-30 (2003)


BindingDB Entry DOI: 10.7270/Q2M044T4
More data for this
Ligand-Target Pair
Ileal sodium/bile acid cotransporter


(Homo sapiens (Human))		BDBM50134427
PNG
((8R,9R)-7,7-Dibutyl-2-dimethylamino-9-(3-nitro-phe...)
Show SMILES CCCCC1(CCCC)NS(=O)(=O)c2ccc(cc2[C@H]([C@H]1O)c1cccc(c1)[N+]([O-])=O)N(C)C
Show InChI InChI=1S/C25H35N3O5S/c1-5-7-14-25(15-8-6-2)24(29)23(18-10-9-11-20(16-18)28(30)31)21-17-19(27(3)4)12-13-22(21)34(32,33)26-25/h9-13,16-17,23-24,26,29H,5-8,14-15H2,1-4H3/t23-,24-/m1/s1
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n/an/a 44n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against uptake of [14C]-taurocholate in baby hamster kidney cells transfected with cDNA from human Apical Sodium-Codepen...

Bioorg Med Chem Lett 13: 3727-30 (2003)


BindingDB Entry DOI: 10.7270/Q2M044T4
More data for this
Ligand-Target Pair
Ileal sodium/bile acid cotransporter


(Homo sapiens (Human))		BDBM50134411
PNG
((7R,9R)-7-Butyl-7-ethyl-2,3-dimethoxy-9-phenyl-6,7...)
Show SMILES CCCC[C@]1(CC)CS(=O)(=O)c2cc(OC)c(OC)cc2[C@H](N1)c1ccccc1
Show InChI InChI=1S/C23H31NO4S/c1-5-7-13-23(6-2)16-29(25,26)21-15-20(28-4)19(27-3)14-18(21)22(24-23)17-11-9-8-10-12-17/h8-12,14-15,22,24H,5-7,13,16H2,1-4H3/t22-,23-/m1/s1
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n/an/a 48n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against uptake of [14C]-taurocholate in baby hamster kidney cells transfected with cDNA from human Apical Sodium-Codepen...

Bioorg Med Chem Lett 13: 3727-30 (2003)


BindingDB Entry DOI: 10.7270/Q2M044T4
More data for this
Ligand-Target Pair
Ileal sodium/bile acid cotransporter


(Homo sapiens (Human))		BDBM50134417
PNG
(CHEMBL122229 | {4-[3-((8R,9R)-7,7-Dibutyl-2-dimeth...)
Show SMILES CCCCC1(CCCC)[C@H](O)[C@H](c2cccc(NC(=O)CCCC[N+](CC)(CC)CC)c2)c2cc(ccc2S(=O)(=O)N1C)N(C)C
Show InChI InChI=1S/C37H60N4O4S/c1-9-14-24-37(25-15-10-2)36(43)35(32-28-31(39(6)7)22-23-33(32)46(44,45)40(37)8)29-19-18-20-30(27-29)38-34(42)21-16-17-26-41(11-3,12-4)13-5/h18-20,22-23,27-28,35-36,43H,9-17,21,24-26H2,1-8H3/p+1/t35-,36-/m1/s1
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against uptake of [14C]-taurocholate in baby hamster kidney cells transfected with cDNA from human Apical Sodium-Codepen...

Bioorg Med Chem Lett 13: 3727-30 (2003)


BindingDB Entry DOI: 10.7270/Q2M044T4
More data for this
Ligand-Target Pair
Ileal sodium/bile acid cotransporter


(Homo sapiens (Human))		BDBM50134423
PNG
(CHEMBL434814 | [2-(2-{2-[4-((8R,9R)-7,7-Dibutyl-2-...)
Show SMILES CCCCC1(CCCC)[C@H](O)[C@H](c2ccc(OCCOCCOCC[N+](CC)(CC)CC)cc2)c2cc(ccc2S(=O)(=O)N1C)N(C)C
Show InChI InChI=1S/C38H64N3O6S/c1-9-14-22-38(23-15-10-2)37(42)36(34-30-32(39(6)7)18-21-35(34)48(43,44)40(38)8)31-16-19-33(20-17-31)47-29-28-46-27-26-45-25-24-41(11-3,12-4)13-5/h16-21,30,36-37,42H,9-15,22-29H2,1-8H3/q+1/t36-,37-/m1/s1
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against uptake of [14C]-taurocholate in baby hamster kidney cells transfected with cDNA from human Apical Sodium-Codepen...

Bioorg Med Chem Lett 13: 3727-30 (2003)


BindingDB Entry DOI: 10.7270/Q2M044T4
More data for this
Ligand-Target Pair
Ileal sodium/bile acid cotransporter


(Homo sapiens (Human))		BDBM50134409
PNG
(1-[2-(2-{2-[4-((8R,9R)-7,7-Dibutyl-2-dimethylamino...)
Show SMILES CCCCC1(CCCC)[C@H](O)[C@H](c2ccc(OCCOCCOCC[n+]3ccccc3)cc2)c2cc(ccc2S(=O)(=O)N1C)N(C)C
Show InChI InChI=1S/C37H54N3O6S/c1-6-8-19-37(20-9-7-2)36(41)35(33-29-31(38(3)4)15-18-34(33)47(42,43)39(37)5)30-13-16-32(17-14-30)46-28-27-45-26-25-44-24-23-40-21-11-10-12-22-40/h10-18,21-22,29,35-36,41H,6-9,19-20,23-28H2,1-5H3/q+1/t35-,36-/m1/s1
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against uptake of [14C]-taurocholate in baby hamster kidney cells transfected with cDNA from human Apical Sodium-Codepen...

Bioorg Med Chem Lett 13: 3727-30 (2003)


BindingDB Entry DOI: 10.7270/Q2M044T4
More data for this
Ligand-Target Pair
Ileal sodium/bile acid cotransporter


(Homo sapiens (Human))		BDBM50134412
PNG
((8R,9R)-9-(3-Amino-phenyl)-7,7-dibutyl-2-dimethyla...)
Show SMILES CCCCC1(CCCC)[C@H](O)[C@H](c2cccc(N)c2)c2cc(ccc2S(=O)(=O)N1C)N(C)C
Show InChI InChI=1S/C26H39N3O3S/c1-6-8-15-26(16-9-7-2)25(30)24(19-11-10-12-20(27)17-19)22-18-21(28(3)4)13-14-23(22)33(31,32)29(26)5/h10-14,17-18,24-25,30H,6-9,15-16,27H2,1-5H3/t24-,25-/m1/s1
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against uptake of [14C]-taurocholate in baby hamster kidney cells transfected with cDNA from human Apical Sodium-Codepen...

Bioorg Med Chem Lett 13: 3727-30 (2003)


BindingDB Entry DOI: 10.7270/Q2M044T4
More data for this
Ligand-Target Pair
Ileal sodium/bile acid cotransporter


(Homo sapiens (Human))		BDBM50134426
PNG
(CHEMBL331015 | {[3-((8R,9R)-7,7-Dibutyl-2-dimethyl...)
Show SMILES CCCCC1(CCCC)[C@H](O)[C@H](c2cccc(NC(=O)C[N+](CC)(CC)CC)c2)c2cc(ccc2S(=O)(=O)N1C)N(C)C
Show InChI InChI=1S/C34H54N4O4S/c1-9-14-21-34(22-15-10-2)33(40)32(29-24-28(36(6)7)19-20-30(29)43(41,42)37(34)8)26-17-16-18-27(23-26)35-31(39)25-38(11-3,12-4)13-5/h16-20,23-24,32-33,40H,9-15,21-22,25H2,1-8H3/p+1/t32-,33-/m1/s1
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against uptake of [14C]-taurocholate in baby hamster kidney cells transfected with cDNA from human Apical Sodium-Codepen...

Bioorg Med Chem Lett 13: 3727-30 (2003)


BindingDB Entry DOI: 10.7270/Q2M044T4
More data for this
Ligand-Target Pair
Ileal sodium/bile acid cotransporter


(Homo sapiens (Human))		BDBM50134418
PNG
((8R,9R)-7,7-Dibutyl-2-dimethylamino-9-(4-methoxy-p...)
Show SMILES CCCCC1(CCCC)[C@H](O)[C@H](c2ccc(OC)cc2)c2cc(ccc2S(=O)(=O)N1C)N(C)C
Show InChI InChI=1S/C27H40N2O4S/c1-7-9-17-27(18-10-8-2)26(30)25(20-11-14-22(33-6)15-12-20)23-19-21(28(3)4)13-16-24(23)34(31,32)29(27)5/h11-16,19,25-26,30H,7-10,17-18H2,1-6H3/t25-,26-/m1/s1
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against uptake of [14C]-taurocholate in baby hamster kidney cells transfected with cDNA from human Apical Sodium-Codepen...

Bioorg Med Chem Lett 13: 3727-30 (2003)


BindingDB Entry DOI: 10.7270/Q2M044T4
More data for this
Ligand-Target Pair
Ileal sodium/bile acid cotransporter


(Homo sapiens (Human))		BDBM50134413
PNG
((8R,9R)-7,7-Dibutyl-2-dimethylamino-9-(4-hydroxy-p...)
Show SMILES CCCCC1(CCCC)[C@H](O)[C@H](c2ccc(O)cc2)c2cc(ccc2S(=O)(=O)N1C)N(C)C
Show InChI InChI=1S/C26H38N2O4S/c1-6-8-16-26(17-9-7-2)25(30)24(19-10-13-21(29)14-11-19)22-18-20(27(3)4)12-15-23(22)33(31,32)28(26)5/h10-15,18,24-25,29-30H,6-9,16-17H2,1-5H3/t24-,25-/m1/s1
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against uptake of [14C]-taurocholate in baby hamster kidney cells transfected with cDNA from human Apical Sodium-Codepen...

Bioorg Med Chem Lett 13: 3727-30 (2003)


BindingDB Entry DOI: 10.7270/Q2M044T4
More data for this
Ligand-Target Pair
Ileal sodium/bile acid cotransporter


(Homo sapiens (Human))		BDBM50134415
PNG
(5-Bromo-pentanoic acid [3-((8R,9R)-7,7-dibutyl-2-d...)
Show SMILES CCCCC1(CCCC)[C@H](O)[C@H](c2cccc(NC(=O)CCCCBr)c2)c2cc(ccc2S(=O)(=O)N1C)N(C)C
Show InChI InChI=1S/C31H46BrN3O4S/c1-6-8-18-31(19-9-7-2)30(37)29(23-13-12-14-24(21-23)33-28(36)15-10-11-20-32)26-22-25(34(3)4)16-17-27(26)40(38,39)35(31)5/h12-14,16-17,21-22,29-30,37H,6-11,15,18-20H2,1-5H3,(H,33,36)/t29-,30-/m1/s1
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against uptake of [14C]-taurocholate in baby hamster kidney cells transfected with cDNA from human Apical Sodium-Codepen...

Bioorg Med Chem Lett 13: 3727-30 (2003)


BindingDB Entry DOI: 10.7270/Q2M044T4
More data for this
Ligand-Target Pair
Ileal sodium/bile acid cotransporter


(Homo sapiens (Human))		BDBM50134422
PNG
(2-Chloro-N-[3-((8R,9R)-7,7-dibutyl-2-dimethylamino...)
Show SMILES CCCCC1(CCCC)[C@H](O)[C@H](c2cccc(NC(=O)CCl)c2)c2cc(ccc2S(=O)(=O)N1C)N(C)C
Show InChI InChI=1S/C28H40ClN3O4S/c1-6-8-15-28(16-9-7-2)27(34)26(20-11-10-12-21(17-20)30-25(33)19-29)23-18-22(31(3)4)13-14-24(23)37(35,36)32(28)5/h10-14,17-18,26-27,34H,6-9,15-16,19H2,1-5H3,(H,30,33)/t26-,27-/m1/s1
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n/an/a 970n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against uptake of [14C]-taurocholate in baby hamster kidney cells transfected with cDNA from human Apical Sodium-Codepen...

Bioorg Med Chem Lett 13: 3727-30 (2003)


BindingDB Entry DOI: 10.7270/Q2M044T4
More data for this
Ligand-Target Pair
Ileal sodium/bile acid cotransporter


(Homo sapiens (Human))		BDBM50134408
PNG
((8R,9R)-6-Benzyl-7,7-dibutyl-2-dimethylamino-9-(3-...)
Show SMILES CCCCC1(CCCC)[C@H](O)[C@H](c2cccc(c2)[N+]([O-])=O)c2cc(ccc2S(=O)(=O)N1Cc1ccccc1)N(C)C
Show InChI InChI=1S/C32H41N3O5S/c1-5-7-19-32(20-8-6-2)31(36)30(25-15-12-16-27(21-25)35(37)38)28-22-26(33(3)4)17-18-29(28)41(39,40)34(32)23-24-13-10-9-11-14-24/h9-18,21-22,30-31,36H,5-8,19-20,23H2,1-4H3/t30-,31-/m1/s1
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n/an/a>1.00E+3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against uptake of [14C]-taurocholate in baby hamster kidney cells transfected with cDNA from human Apical Sodium-Codepen...

Bioorg Med Chem Lett 13: 3727-30 (2003)


BindingDB Entry DOI: 10.7270/Q2M044T4
More data for this
Ligand-Target Pair
Ileal sodium/bile acid cotransporter


(Homo sapiens (Human))		BDBM50134410
PNG
((8R,9R)-7,7-Dibutyl-2-dimethylamino-6-methyl-9-(3-...)
Show SMILES CCCCC1(CCCC)[C@H](O)[C@H](c2cccc(c2)[N+]([O-])=O)c2cc(ccc2S(=O)(=O)N1C)N(C)C
Show InChI InChI=1S/C26H37N3O5S/c1-6-8-15-26(16-9-7-2)25(30)24(19-11-10-12-21(17-19)29(31)32)22-18-20(27(3)4)13-14-23(22)35(33,34)28(26)5/h10-14,17-18,24-25,30H,6-9,15-16H2,1-5H3/t24-,25-/m1/s1
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n/an/a 1.20E+3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against uptake of [14C]-taurocholate in baby hamster kidney cells transfected with cDNA from human Apical Sodium-Codepen...

Bioorg Med Chem Lett 13: 3727-30 (2003)


BindingDB Entry DOI: 10.7270/Q2M044T4
More data for this
Ligand-Target Pair
Ileal sodium/bile acid cotransporter


(Homo sapiens (Human))		BDBM50134420
PNG
((8R,9R)-7,7-Dibutyl-2-dimethylamino-9-(3-methoxy-p...)
Show SMILES CCCCC1(CCCC)[C@H](O)[C@H](c2cccc(OC)c2)c2cc(ccc2S(=O)(=O)N1C)N(C)C
Show InChI InChI=1S/C27H40N2O4S/c1-7-9-16-27(17-10-8-2)26(30)25(20-12-11-13-22(18-20)33-6)23-19-21(28(3)4)14-15-24(23)34(31,32)29(27)5/h11-15,18-19,25-26,30H,7-10,16-17H2,1-6H3/t25-,26-/m1/s1
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n/an/a 1.20E+3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against uptake of [14C]-taurocholate in baby hamster kidney cells transfected with cDNA from human Apical Sodium-Codepen...

Bioorg Med Chem Lett 13: 3727-30 (2003)


BindingDB Entry DOI: 10.7270/Q2M044T4
More data for this
Ligand-Target Pair
Ileal sodium/bile acid cotransporter


(Homo sapiens (Human))		BDBM50134407
PNG
((8R,9R)-6-Benzyl-7,7-dibutyl-2-dimethylamino-9-(3-...)
Show SMILES CCCCC1(CCCC)[C@H](O)[C@H](c2cccc(NCC)c2)c2cc(ccc2S(=O)(=O)N1Cc1ccccc1)N(C)C
Show InChI InChI=1S/C34H47N3O3S/c1-6-9-21-34(22-10-7-2)33(38)32(27-17-14-18-28(23-27)35-8-3)30-24-29(36(4)5)19-20-31(30)41(39,40)37(34)25-26-15-12-11-13-16-26/h11-20,23-24,32-33,35,38H,6-10,21-22,25H2,1-5H3/t32-,33-/m1/s1
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n/an/a 2.50E+3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against uptake of [14C]-taurocholate in baby hamster kidney cells transfected with cDNA from human Apical Sodium-Codepen...

Bioorg Med Chem Lett 13: 3727-30 (2003)


BindingDB Entry DOI: 10.7270/Q2M044T4
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%