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PubMed code 26944615

Compile data set for download or QSAR
Found 7 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
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Transcription factor 4


(Homo sapiens)
BDBM50500849
PNG
(CHEMBL3780110)
Show SMILES CO[C@@H]1[C@@H](C)OC(NC2=CC(=O)c3c(O)c4C(=O)[C@]5(OC)[C@H](O)Cc6cc(C)c(C(=O)OC)c(O)c6[C@@]5(O)C(=O)c4cc3C2=O)[C@@H](OC)[C@H]1O
Show InChI InChI=1S/C34H35NO15/c1-11-7-13-8-18(37)34(49-6)30(43)21-15(29(42)33(34,45)22(13)25(40)19(11)32(44)48-5)9-14-20(24(21)39)17(36)10-16(23(14)38)35-31-28(47-4)26(41)27(46-3)12(2)50-31/h7,9-10,12,18,26-28,31,35,37,39-41,45H,8H2,1-6H3/t12-,18-,26+,27-,28+,31?,33-,34-/m1/s1
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n/an/a 640n/an/an/an/an/an/a



King Saud University

Curated by ChEMBL


Assay Description
Inhibition of human GST tagged Tcf4/beta catenin interaction after 2 hrs using fluorescent AP Attophos substrate by ELISA analysis


Bioorg Med Chem Lett 26: 1664-70 (2016)


Article DOI: 10.1016/j.bmcl.2016.02.064
BindingDB Entry DOI: 10.7270/Q25H7K8M
More data for this
Ligand-Target Pair
Transcription factor 4


(Homo sapiens)
BDBM32102
PNG
(1,6-dimethylpyrimido[5,4-e][1,2,4]triazine-5,7(1H,...)
Show SMILES Cn1ncnc2c1nc(=O)n(C)c2=O
Show InChI InChI=1S/C7H7N5O2/c1-11-6(13)4-5(10-7(11)14)12(2)9-3-8-4/h3H,1-2H3
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Article
PubMed
n/an/a 800n/an/an/an/an/an/a



King Saud University

Curated by ChEMBL


Assay Description
Inhibition of human GST tagged Tcf4/beta catenin interaction after 2 hrs using fluorescent AP Attophos substrate by ELISA analysis


Bioorg Med Chem Lett 26: 1664-70 (2016)


Article DOI: 10.1016/j.bmcl.2016.02.064
BindingDB Entry DOI: 10.7270/Q25H7K8M
More data for this
Ligand-Target Pair
Transcription factor 4


(Homo sapiens)
BDBM50158807
PNG
(3-Butyryl-1,8-dihydroxy-2-methyl-phenanthrene-9,10...)
Show SMILES CCCC(=O)c1cc2-c3cccc(O)c3C(=O)C(=O)c2c(O)c1C
Show InChI InChI=1S/C19H16O5/c1-3-5-13(20)11-8-12-10-6-4-7-14(21)15(10)18(23)19(24)16(12)17(22)9(11)2/h4,6-8,21-22H,3,5H2,1-2H3
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n/an/a 2.40E+3n/an/an/an/an/an/a



King Saud University

Curated by ChEMBL


Assay Description
Inhibition of human GST tagged Tcf4/beta catenin interaction after 2 hrs using fluorescent AP Attophos substrate by ELISA analysis


Bioorg Med Chem Lett 26: 1664-70 (2016)


Article DOI: 10.1016/j.bmcl.2016.02.064
BindingDB Entry DOI: 10.7270/Q25H7K8M
More data for this
Ligand-Target Pair
Transcription factor 4


(Homo sapiens)
BDBM50500850
PNG
(CHEMBL261214)
Show SMILES COc1cc(O)c2c3c1c1c(OC)cc(O)c4c1c(c(CC(C)OC(=O)c1ccccc1)c(OC)c4=O)c3c(CC(C)OC(=O)Oc1ccc(O)cc1)c(OC)c2=O
Show InChI InChI=1S/C44H38O14/c1-20(56-43(50)22-10-8-7-9-11-22)16-25-31-32-26(17-21(2)57-44(51)58-24-14-12-23(45)13-15-24)42(55-6)40(49)34-28(47)19-30(53-4)36(38(32)34)35-29(52-3)18-27(46)33(37(31)35)39(48)41(25)54-5/h7-15,18-21,45-47H,16-17H2,1-6H3
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n/an/a 3.20E+3n/an/an/an/an/an/a



King Saud University

Curated by ChEMBL


Assay Description
Inhibition of human GST tagged Tcf4/beta catenin interaction after 2 hrs using fluorescent AP Attophos substrate by ELISA analysis


Bioorg Med Chem Lett 26: 1664-70 (2016)


Article DOI: 10.1016/j.bmcl.2016.02.064
BindingDB Entry DOI: 10.7270/Q25H7K8M
More data for this
Ligand-Target Pair
Transcription factor 4


(Homo sapiens)
BDBM50500848
PNG
(CHEMBL2397075)
Show SMILES COc1cc(O)c2c3c1c1c(OC)cc(O)c4c1c(c(CC(C)OC(=O)c1c(C)cc(O)cc1O)c(OC)c4=O)c3c(CC(C)OC(=O)c1c(C)cc(O)cc1O)c(OC)c2=O
Show InChI InChI=1S/C46H42O16/c1-17-9-21(47)13-25(49)31(17)45(55)61-19(3)11-23-33-34-24(12-20(4)62-46(56)32-18(2)10-22(48)14-26(32)50)44(60-8)42(54)36-28(52)16-30(58-6)38(40(34)36)37-29(57-5)15-27(51)35(39(33)37)41(53)43(23)59-7/h9-10,13-16,19-20,47-52H,11-12H2,1-8H3
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n/an/a 4.10E+3n/an/an/an/an/an/a



King Saud University

Curated by ChEMBL


Assay Description
Inhibition of human GST tagged Tcf4/beta catenin interaction after 2 hrs using fluorescent AP Attophos substrate by ELISA analysis


Bioorg Med Chem Lett 26: 1664-70 (2016)


Article DOI: 10.1016/j.bmcl.2016.02.064
BindingDB Entry DOI: 10.7270/Q25H7K8M
More data for this
Ligand-Target Pair
TCF4-CTNNB1 complex


(Homo sapiens (Human))
BDBM50500847
PNG
(CERCOSPORIN | Cercosporin)
Show SMILES COc1c(CC(C)O)c2c3c(CC(C)O)c(OC)c(=O)c4c(O)cc5OCOc6cc(O)c(c2c6c5c34)c1=O
Show InChI InChI=1S/C29H26O10/c1-10(30)5-12-18-19-13(6-11(2)31)29(37-4)27(35)21-15(33)8-17-23(25(19)21)22-16(38-9-39-17)7-14(32)20(24(18)22)26(34)28(12)36-3/h7-8,10-11,30-33H,5-6,9H2,1-4H3
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n/an/a 8.70E+3n/an/an/an/an/an/a



King Saud University

Curated by ChEMBL


Assay Description
Inhibition of human GST tagged Tcf4/beta catenin interaction after 2 hrs using fluorescent AP Attophos substrate by ELISA analysis


Bioorg Med Chem Lett 26: 1664-70 (2016)


Article DOI: 10.1016/j.bmcl.2016.02.064
BindingDB Entry DOI: 10.7270/Q25H7K8M
More data for this
Ligand-Target Pair
Transcription factor 4


(Homo sapiens)
BDBM50436058
PNG
(CHEMBL254381 | PNU-74654 | US9738628, Compound PNU...)
Show SMILES Cc1ccc(\C=N\NC(=O)c2ccccc2Oc2ccccc2)o1
Show InChI InChI=1S/C19H16N2O3/c1-14-11-12-16(23-14)13-20-21-19(22)17-9-5-6-10-18(17)24-15-7-3-2-4-8-15/h2-13H,1H3,(H,21,22)/b20-13+
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n/an/an/a 450n/an/an/an/an/a



King Saud University

Curated by ChEMBL


Assay Description
Inhibition of His6 tagged Tcf4 1-53/beta catenin (unknown origin) interaction by VP-ITC titration calorimeter method


Bioorg Med Chem Lett 26: 1664-70 (2016)


Article DOI: 10.1016/j.bmcl.2016.02.064
BindingDB Entry DOI: 10.7270/Q25H7K8M
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%