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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 = 'BDBM120918'   
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))
BDBM120918
PNG
(US8716287, 51)
Show SMILES COc1cc(CCNCc2ccc(cc2)N2CCN(C)CC2)ccc1NC(=O)Nc1cnc(cn1)C#N
Show InChI InChI=1S/C27H32N8O2/c1-34-11-13-35(14-12-34)23-6-3-21(4-7-23)17-29-10-9-20-5-8-24(25(15-20)37-2)32-27(36)33-26-19-30-22(16-28)18-31-26/h3-8,15,18-19,29H,9-14,17H2,1-2H3,(H2,31,32,33,36)
PDB
MMDB

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PC sid
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Similars

US Patent
n/an/a 3.30n/an/an/an/a7.5n/a



Sentinel Oncology Limited

US Patent


Assay Description
The compounds of the invention were tested for activity against Chk-1 kinase using the materials and protocols set out below. Reaction Buffer: Base R...


US Patent US8716287 (2014)


BindingDB Entry DOI: 10.7270/Q2TD9W0C
More data for this
Ligand-Target Pair