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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 = 'BDBM50053236'   
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))
BDBM50053236
PNG
(CHEMBL3330231)
Show SMILES Brc1cc2c(NC3CCNC3)c(-c3nc4ccccc4[nH]3)c(=O)[nH]c2s1
Show InChI InChI=1S/C18H16BrN5OS/c19-13-7-10-15(21-9-5-6-20-8-9)14(17(25)24-18(10)26-13)16-22-11-3-1-2-4-12(11)23-16/h1-4,7,9,20H,5-6,8H2,(H,22,23)(H2,21,24,25)
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Article
PubMed
n/an/a 15n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of Chk1 (unknown origin) by luminescent ADP-Glo assay


Bioorg Med Chem 22: 4882-92 (2014)


Article DOI: 10.1016/j.bmc.2014.06.044
BindingDB Entry DOI: 10.7270/Q2TM7CRB
More data for this
Ligand-Target Pair