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PubMed code 18602198

Compile data set for download or QSAR
Found 1 hit of Enzyme Inhibition Constant Data   
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
Serine/threonine-protein kinase Chk1


(Homo sapiens (Human))
BDBM50268249
PNG
(12,13-[6-Deoxy-6-amino-4-O-methyl-D-mannopyranosyl...)
Show SMILES CO[C@@H]1[C@@H](CN)O[C@@H]2[C@H]([C@H]1O)n1c3ccccc3c3c4C(=O)NC(=O)c4c4c5ccccc5n2c4c13 |r|
Show InChI InChI=1S/C27H22N4O5/c1-35-24-15(10-28)36-27-22(23(24)32)30-13-8-4-2-6-11(13)16-18-19(26(34)29-25(18)33)17-12-7-3-5-9-14(12)31(27)21(17)20(16)30/h2-9,15,22-24,27,32H,10,28H2,1H3,(H,29,33,34)/t15-,22+,23-,24-,27-/m1/s1
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Similars

Article
PubMed
n/an/a 2.80n/an/an/an/an/an/a



Université Blaise Pascal

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged human full-length CHK1 expressed in Sf9 cells


Eur J Med Chem 44: 2234-8 (2009)


Article DOI: 10.1016/j.ejmech.2008.05.023
BindingDB Entry DOI: 10.7270/Q2XP74R2
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
* indicates data uncertainty>20%