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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 = 'BDBM50243422'   
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))
BDBM50243422
PNG
(1-(3-carbamoyl-5-(4-(((2-hydroxyethyl)(methyl)amin...)
Show SMILES CN(CCO)Cc1ccc(cc1)-c1cc(C(N)=O)c(NC(N)=O)s1
Show InChI InChI=1S/C16H20N4O3S/c1-20(6-7-21)9-10-2-4-11(5-3-10)13-8-12(14(17)22)15(24-13)19-16(18)23/h2-5,8,21H,6-7,9H2,1H3,(H2,17,22)(H3,18,19,23)
PDB
MMDB

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PC sid
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Similars

Article
PubMed
n/an/a 31n/an/an/an/an/an/a



AstraZeneca R&D Boston

Curated by ChEMBL


Assay Description
Inhibition of Chk1


Bioorg Med Chem Lett 18: 4242-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.016
BindingDB Entry DOI: 10.7270/Q2J102Z9
More data for this
Ligand-Target Pair