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BDBM260419 US9527838, 47

SMILES: Cn1cnnc1Sc1ccc(Sc2ccc(cc2)C(F)(F)F)c(n1)C(=O)Nc1nc(CC(O)=O)cs1

InChI Key: InChIKey=AISXRXZFXCBTKP-UHFFFAOYSA-N

Data: 1 EC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 260419   
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
FLAG-Glucokinase (GK)


(Homo sapiens (Human))
BDBM260419
PNG
(US9527838, 47)
Show SMILES Cn1cnnc1Sc1ccc(Sc2ccc(cc2)C(F)(F)F)c(n1)C(=O)Nc1nc(CC(O)=O)cs1
Show InChI InChI=1S/C21H15F3N6O3S3/c1-30-10-25-29-20(30)36-15-7-6-14(35-13-4-2-11(3-5-13)21(22,23)24)17(27-15)18(33)28-19-26-12(9-34-19)8-16(31)32/h2-7,9-10H,8H2,1H3,(H,31,32)(H,26,28,33)
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MMDB

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US Patent
n/an/an/an/a 222n/an/an/an/a



Merck Sharp & Dohme Corp

US Patent


Assay Description
Recombinant human liver glucokinase was expressed as a FLAG fusion protein in E. coli, and purified on ANTIFLAG M2 AFFINITY GEL (Sigma). The assay wa...


US Patent US9527838 (2016)


BindingDB Entry DOI: 10.7270/Q2RV0MN1
More data for this
Ligand-Target Pair