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Compile Data Set for Download or QSAR

Found 1 hit of ic50 for monomerid = 50082063   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Adenosine kinase


(Homo sapiens (Human))
BDBM50082063
PNG
((+/-)-6-ethyl-6-(p-tolyl)pyrrolo[2,1-d][1,5]benzox...)
Show SMILES CCC1(Oc2ccccc2-n2cccc2C1=O)c1ccc(C)cc1
Show InChI InChI=1S/C21H19NO2/c1-3-21(16-12-10-15(2)11-13-16)20(23)18-8-6-14-22(18)17-7-4-5-9-19(17)24-21/h4-14H,3H2,1-2H3
PDB
MMDB

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Similars

Article
PubMed
n/an/a 8.00E+4n/an/an/an/an/an/a



Universita` di Siena

Curated by ChEMBL


Assay Description
Inhibition of human adenosine kinase


J Med Chem 54: 1401-20 (2011)


Article DOI: 10.1021/jm101438u
BindingDB Entry DOI: 10.7270/Q2XD120B
More data for this
Ligand-Target Pair