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Compile Data Set for Download or QSAR

Found 5 hits Enz. Inhib. hit(s) with Target = 'Catenin beta-1' and Ligand = 'BDBM50094494'   
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
Catenin beta-1


(Homo sapiens (Human))
BDBM50094494
PNG
(CHEMBL3589022)
Show SMILES OC(=O)Cn1c2ccccc2c2nc3nonc3nc12
Show InChI InChI=1S/C12H7N5O3/c18-8(19)5-17-7-4-2-1-3-6(7)9-12(17)14-11-10(13-9)15-20-16-11/h1-4H,5H2,(H,18,19)
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Article
PubMed
4.10E+3n/an/an/an/an/an/an/an/a



University of Utah

Curated by ChEMBL


Assay Description
Inhibition of N-terminally His6-tagged human beta-catenin (residues 138-686)/C-terminally biotinylated human Tcf4 (residues 7-51) interaction after 4...


J Med Chem 58: 4678-92 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00223
BindingDB Entry DOI: 10.7270/Q2G44S28
More data for this
Ligand-Target Pair
Catenin beta-1


(Homo sapiens (Human))
BDBM50094494
PNG
(CHEMBL3589022)
Show SMILES OC(=O)Cn1c2ccccc2c2nc3nonc3nc12
Show InChI InChI=1S/C12H7N5O3/c18-8(19)5-17-7-4-2-1-3-6(7)9-12(17)14-11-10(13-9)15-20-16-11/h1-4H,5H2,(H,18,19)
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Article
PubMed
5.80E+3n/an/an/an/an/an/an/an/a



University of Utah

Curated by ChEMBL


Assay Description
Inhibition of human wild-type beta-catenin (residues 138-686)/C-terminally fluorescein labeled human wild-type Tcf4 (residues 7-51) interaction after...


J Med Chem 58: 4678-92 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00223
BindingDB Entry DOI: 10.7270/Q2G44S28
More data for this
Ligand-Target Pair
Catenin beta-1


(Homo sapiens (Human))
BDBM50094494
PNG
(CHEMBL3589022)
Show SMILES OC(=O)Cn1c2ccccc2c2nc3nonc3nc12
Show InChI InChI=1S/C12H7N5O3/c18-8(19)5-17-7-4-2-1-3-6(7)9-12(17)14-11-10(13-9)15-20-16-11/h1-4H,5H2,(H,18,19)
PDB
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Article
PubMed
n/an/a 2.50E+4n/an/an/an/an/an/a



University of Utah

Curated by ChEMBL


Assay Description
Inhibition of human wild-type beta-catenin (residues 138-686)/C-terminally fluorescein labeled human wild-type Tcf4 (residues 7-51) interaction after...


J Med Chem 58: 4678-92 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00223
BindingDB Entry DOI: 10.7270/Q2G44S28
More data for this
Ligand-Target Pair
Catenin beta-1


(Homo sapiens (Human))
BDBM50094494
PNG
(CHEMBL3589022)
Show SMILES OC(=O)Cn1c2ccccc2c2nc3nonc3nc12
Show InChI InChI=1S/C12H7N5O3/c18-8(19)5-17-7-4-2-1-3-6(7)9-12(17)14-11-10(13-9)15-20-16-11/h1-4H,5H2,(H,18,19)
PDB
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Article
PubMed
n/an/a 2.80E+5n/an/an/an/an/an/a



University of Utah

Curated by ChEMBL


Assay Description
Inhibition of human wild-type beta-catenin (residues 138-686)/C-terminally fluorescein-labeled human E-cadherin (residues 819-873) interaction by FP ...


J Med Chem 58: 4678-92 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00223
BindingDB Entry DOI: 10.7270/Q2G44S28
More data for this
Ligand-Target Pair
Catenin beta-1


(Homo sapiens (Human))
BDBM50094494
PNG
(CHEMBL3589022)
Show SMILES OC(=O)Cn1c2ccccc2c2nc3nonc3nc12
Show InChI InChI=1S/C12H7N5O3/c18-8(19)5-17-7-4-2-1-3-6(7)9-12(17)14-11-10(13-9)15-20-16-11/h1-4H,5H2,(H,18,19)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
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GoogleScholar
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PC cid
PC sid
UniChem

Patents


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Article
PubMed
n/an/a 4.50E+5n/an/an/an/an/an/a



University of Utah

Curated by ChEMBL


Assay Description
Inhibition of human wild-type beta-catenin (residues 138-686)/C-terminally fluorescein-labeled human APC-R3 (residues 1477-1519) interaction by FP co...


J Med Chem 58: 4678-92 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00223
BindingDB Entry DOI: 10.7270/Q2G44S28
More data for this
Ligand-Target Pair