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BDBM50355113 CHEMBL1835581

SMILES: CC1NC(=O)C(C#N)=C(SCc2ccccc2)S1

InChI Key: InChIKey=BFIALVSRBPCDMI-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50355113   
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
4-diphosphocytidyl-2-C-methyl-D-erythritol kinase


(Yersinia pestis)
BDBM50355113
PNG
(CHEMBL1835581)
Show SMILES CC1NC(=O)C(C#N)=C(SCc2ccccc2)S1
Show InChI InChI=1S/C13H12N2OS2/c1-9-15-12(16)11(7-14)13(18-9)17-8-10-5-3-2-4-6-10/h2-6,9H,8H2,1H3,(H,15,16)
KEGG

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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.50E+4n/an/an/an/an/an/a



University of Utah

Curated by ChEMBL


Assay Description
Inhibition of His6-tagged Yersinia pestis KIM6 CDP-ME kinase assessed as ADP production after 30 mins by Kinase Glo luminescence-based assay or stand...


Bioorg Med Chem 19: 5886-95 (2011)


Article DOI: 10.1016/j.bmc.2011.08.012
BindingDB Entry DOI: 10.7270/Q2W37WQJ
More data for this
Ligand-Target Pair