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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Serine/threonine-protein kinase Chk1' and Ligand = 'BDBM50325174'   
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))
BDBM50325174
PNG
(5-methyl-8-(thiazol-2-yl)-[1,2,4]triazolo[4,3-a]qu...)
Show SMILES Cc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1nccs1
Show InChI InChI=1S/C14H10N4OS/c1-8-6-12-16-17-14(19)18(12)11-7-9(2-3-10(8)11)13-15-4-5-20-13/h2-7H,1H3,(H,17,19)
PDB
MMDB

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.96E+3n/an/an/an/an/an/a



AstraZeneca R&D Boston

Curated by ChEMBL


Assay Description
Inhibition of His6-CHK1 expressed in baculovirus infected Sf9 cells


Bioorg Med Chem Lett 20: 5133-8 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.015
BindingDB Entry DOI: 10.7270/Q2FF3SJZ
More data for this
Ligand-Target Pair