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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 = 'BDBM50218714'   
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))
BDBM50218714
PNG
(3-phenyl-5,10-dihydro-dibenzo[b,e][1,4]diazepin-11...)
Show SMILES O=C1Nc2ccccc2Nc2cc(ccc12)-c1ccccc1
Show InChI InChI=1S/C19H14N2O/c22-19-15-11-10-14(13-6-2-1-3-7-13)12-18(15)20-16-8-4-5-9-17(16)21-19/h1-12,20H,(H,21,22)
PDB
MMDB

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Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of human recombinant Chk1


J Med Chem 50: 4162-76 (2007)


Article DOI: 10.1021/jm070105d
BindingDB Entry DOI: 10.7270/Q22J6BKS
More data for this
Ligand-Target Pair
3D
3D Structure (docked)