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BDBM137784 US8871934, 377

SMILES: Cn1cc(cn1)-c1ccc2-c3ccccc3C(O)(c2c1)C(F)(F)F

InChI Key: InChIKey=QVJJBCYFQPYLFU-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 = 137784   
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))
BDBM137784
PNG
(US8871934, 377)
Show SMILES Cn1cc(cn1)-c1ccc2-c3ccccc3C(O)(c2c1)C(F)(F)F
Show InChI InChI=1S/C18H13F3N2O/c1-23-10-12(9-22-23)11-6-7-14-13-4-2-3-5-15(13)17(24,16(14)8-11)18(19,20)21/h2-10,24H,1H3
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Similars

US Patent
n/an/a 189n/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