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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 = 'BDBM15277'   
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))
BDBM15277
PNG
(7-chloro-8-[(1H-imidazol-4-ylmethyl)amino]-3-oxo-1...)
Show SMILES Clc1cc2NC(=O)Nc3cnc(C#N)c(OCCCCCOc2cc1NCc1cnc[nH]1)n3
Show InChI InChI=1S/C21H21ClN8O3/c22-14-6-16-18(7-15(14)25-10-13-9-24-12-27-13)32-4-2-1-3-5-33-20-17(8-23)26-11-19(29-20)30-21(31)28-16/h6-7,9,11-12,25H,1-5,10H2,(H,24,27)(H2,28,29,30,31)
PDB
MMDB

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PC cid
PC sid
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Similars

Article
PubMed
n/an/a 231n/an/an/an/an/an/a



Abbott Laboratories



Assay Description
Chk1 kinase activity was assayed in reaction buffer containing substrate, enzyme, and inhibitor in the presence of 5uM ATP/[gamma-33P] ATP. 33P incor...


J Med Chem 50: 1514-27 (2007)


Article DOI: 10.1021/jm061247v
BindingDB Entry DOI: 10.7270/Q2P55KQW
More data for this
Ligand-Target Pair
3D
3D Structure (docked)