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BDBM50314433 CHEMBL1089712::methyl 5-(3-amino-2-carbamoyl-5,6,7,8,9,10-hexahydrocycloocta[b]thieno[3,2-e]pyridin-4-yl)-3-methylfuran-2-carboxylate

SMILES: COC(=O)c1oc(cc1C)-c1c2CCCCCCc2nc2sc(C(N)=O)c(N)c12

InChI Key: InChIKey=ZRQQPRIJTHNAKJ-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50314433   
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
Eukaryotic elongation factor 2 kinase


(Homo sapiens (Human))
BDBM50314433
PNG
(CHEMBL1089712 | methyl 5-(3-amino-2-carbamoyl-5,6,...)
Show SMILES COC(=O)c1oc(cc1C)-c1c2CCCCCCc2nc2sc(C(N)=O)c(N)c12
Show InChI InChI=1S/C21H23N3O4S/c1-10-9-13(28-17(10)21(26)27-2)14-11-7-5-3-4-6-8-12(11)24-20-15(14)16(22)18(29-20)19(23)25/h9H,3-8,22H2,1-2H3,(H2,23,25)
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Article
PubMed
n/an/a>2.00E+4n/an/an/an/an/an/a



Kyowa Hakko Kogyo Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of GST tagged eEf2K expressed in Escherichia coli by fluorometric method


Bioorg Med Chem Lett 20: 2283-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.02.005
BindingDB Entry DOI: 10.7270/Q2F18ZVT
More data for this
Ligand-Target Pair