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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Catenin beta-1 [138-686]' and Ligand = 'BDBM213768'   
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 [138-686]


(Homo sapiens (Human))
BDBM213768
PNG
(US9284299, 19 | US9738628, Compound 19)
Show SMILES On1ncc2cc(ccc12)N(Cc1nn[nH]n1)C(=O)c1cc(F)cc(Br)c1
Show InChI InChI=1S/C16H11BrFN7O2/c17-11-3-9(4-12(18)6-11)16(26)24(8-15-20-22-23-21-15)13-1-2-14-10(5-13)7-19-25(14)27/h1-7,27H,8H2,(H,20,21,22,23)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
2.87E+4n/an/an/an/an/an/an/an/a



University of Utah Research Foundation

US Patent


Assay Description
Experiments were performed in white opaque 384-well plates from PerkinElmer (Waltham, Mass.), and the samples were read on a Synergy 2 plate reader (...


US Patent US9738628 (2017)


BindingDB Entry DOI: 10.7270/Q27P91H7
More data for this
Ligand-Target Pair
Catenin beta-1 [138-686]


(Homo sapiens (Human))
BDBM213768
PNG
(US9284299, 19 | US9738628, Compound 19)
Show SMILES On1ncc2cc(ccc12)N(Cc1nn[nH]n1)C(=O)c1cc(F)cc(Br)c1
Show InChI InChI=1S/C16H11BrFN7O2/c17-11-3-9(4-12(18)6-11)16(26)24(8-15-20-22-23-21-15)13-1-2-14-10(5-13)7-19-25(14)27/h1-7,27H,8H2,(H,20,21,22,23)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
2.87E+4 -25.9n/an/an/an/an/an/a25



University of Utah Research Foundation

US Patent


Assay Description
Experiments were performed in 96-well Microfluor 2 black plates (Waltham, Mass.), and the samples were read by a Synergy 2 plate reader (Biotek, Wino...


US Patent US9284299 (2016)


BindingDB Entry DOI: 10.7270/Q2WW7GGC
More data for this
Ligand-Target Pair