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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 = 'BDBM50414086'   
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))
BDBM50414086
PNG
(CHEMBL563792)
Show SMILES CCc1cc-2c(Cc3c(n[nH]c-23)-c2cccnc2)cc1OC1CCOC1
Show InChI InChI=1S/C21H21N3O2/c1-2-13-8-17-15(10-19(13)26-16-5-7-25-12-16)9-18-20(23-24-21(17)18)14-4-3-6-22-11-14/h3-4,6,8,10-11,16H,2,5,7,9,12H2,1H3,(H,23,24)
PDB
MMDB

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PC cid
PC sid
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Article
PubMed
5n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Chk1


J Med Chem 52: 3159-65 (2009)


Article DOI: 10.1021/jm801444x
BindingDB Entry DOI: 10.7270/Q2FF3TM8
More data for this
Ligand-Target Pair