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BDBM138005 US8871934, 598

SMILES: CC(O)c1cc(cc2c1-c1ccccc1C2(O)C(F)(F)F)-c1cnn(C)c1

InChI Key: InChIKey=RCDOJXLKUQYEEJ-UHFFFAOYSA-N

Data: 1 IC50

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Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 138005   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
[Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 2, mitochondrial


(Homo sapiens (Human))
BDBM138005
PNG
(US8871934, 598)
Show SMILES CC(O)c1cc(cc2c1-c1ccccc1C2(O)C(F)(F)F)-c1cnn(C)c1
Show InChI InChI=1S/C20H17F3N2O2/c1-11(26)15-7-12(13-9-24-25(2)10-13)8-17-18(15)14-5-3-4-6-16(14)19(17,27)20(21,22)23/h3-11,26-27H,1-2H3
PDB

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Similars

US Patent
n/an/a 653n/an/an/an/a8.030



Japan Tobacco Inc

US Patent


Assay Description
The inhibitory action of PDHK activity was indirectly evaluated by performing a kinase reaction in the presence of a test compound and measuring the ...


US Patent US8871934 (2014)


BindingDB Entry DOI: 10.7270/Q2JQ0ZQT
More data for this
Ligand-Target Pair