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BDBM260399 US9527838, 27

SMILES: CCOC(=O)CSc1cnc(NC(=O)c2nc(Sc3ccc(F)cc3)ccc2Sc2ccc(F)cc2)s1

InChI Key: InChIKey=QNABZYYHWNXEHQ-UHFFFAOYSA-N

Data: 1 EC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 260399   
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
FLAG-Glucokinase (GK)


(Homo sapiens (Human))
BDBM260399
PNG
(US9527838, 27)
Show SMILES CCOC(=O)CSc1cnc(NC(=O)c2nc(Sc3ccc(F)cc3)ccc2Sc2ccc(F)cc2)s1
Show InChI InChI=1S/C25H19F2N3O3S4/c1-2-33-21(31)14-34-22-13-28-25(37-22)30-24(32)23-19(35-17-7-3-15(26)4-8-17)11-12-20(29-23)36-18-9-5-16(27)6-10-18/h3-13H,2,14H2,1H3,(H,28,30,32)
PDB
MMDB

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PC cid
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US Patent
n/an/an/an/a 387n/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