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SMILES: Clc1cc2NC(=O)Nc3cnc(C#N)c(OC\C=C/COc2cc1NC(=O)OCCN1CCOCC1)n3

InChI Key: InChIKey=DGLVFUGIKGSLJR-UPHRSURJSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50224912   
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))		BDBM50224912
PNG
(((Z)-7-chloro-18-cyano-3-oxo-11,16-dioxa-2,4,19,21...)
Show SMILES Clc1cc2NC(=O)Nc3cnc(C#N)c(OC\C=C/COc2cc1NC(=O)OCCN1CCOCC1)n3 |c:17|
Show InChI InChI=1S/C23H24ClN7O6/c24-15-11-17-19(12-16(15)28-23(33)37-10-5-31-3-8-34-9-4-31)35-6-1-2-7-36-21-18(13-25)26-14-20(29-21)30-22(32)27-17/h1-2,11-12,14H,3-10H2,(H,28,33)(H2,27,29,30,32)/b2-1-
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n/an/a 3n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Chk1

Bioorg Med Chem Lett 17: 6593-601 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.063
BindingDB Entry DOI: 10.7270/Q2X067WT
More data for this
Ligand-Target Pair