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BDBM137736 US8871934, 329

SMILES: CN(C)C(=O)C1CN(C1)C(=O)c1cc2c(-c3ccccc3C2(O)C(F)(F)F)c(Cl)c1

InChI Key: InChIKey=YNXOQQXUZYXJAV-UHFFFAOYNA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 137736   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Pyruvate dehydrogenase kinase isoform 2 (PDHK2)


(Homo sapiens (Human))
BDBM137736
PNG
(US8871934, 329)
Show SMILES CN(C)C(=O)C1CN(C1)C(=O)c1cc2c(-c3ccccc3C2(O)C(F)(F)F)c(Cl)c1
Show InChI InChI=1/C21H18ClF3N2O3/c1-26(2)18(28)12-9-27(10-12)19(29)11-7-15-17(16(22)8-11)13-5-3-4-6-14(13)20(15,30)21(23,24)25/h3-8,12,30H,9-10H2,1-2H3
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 66n/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