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SMILES: COCCOc1ccc(cc1)-c1cnc(Nc2cnc(cn2)C#N)cc1NC[C@@H]1CNCCO1

InChI Key: InChIKey=JZMMIRSZDIQCEQ-FQEVSTJZSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 329002   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/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))		BDBM329002
PNG
(1137478-40-0 | US9663503, Compound Y-149)
Show SMILES COCCOc1ccc(cc1)-c1cnc(Nc2cnc(cn2)C#N)cc1NC[C@@H]1CNCCO1 |r|
Show InChI InChI=1S/C24H27N7O3/c1-32-8-9-34-19-4-2-17(3-5-19)21-15-30-23(31-24-16-27-18(11-25)12-29-24)10-22(21)28-14-20-13-26-6-7-33-20/h2-5,10,12,15-16,20,26H,6-9,13-14H2,1H3,(H2,28,29,30,31)/t20-/m0/s1
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US Patent
n/an/a 10n/an/an/an/an/an/a



Cancer Research Technology Limited

US Patent


Assay Description
CHK1 kinase activity was measured in a microfluidic assay that monitors the separation of a phosphorylated product from its substrate. The assay was ...

US Patent US9663503 (2017)


BindingDB Entry DOI: 10.7270/Q2T43W7G
More data for this
Ligand-Target Pair