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SMILES: COc1ccc(cc1-n1c(CN2CCNCC2)nc2ccccc2c1=O)[N+]([O-])=O

InChI Key: InChIKey=BDDCLDRLILJZPQ-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50354129   
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
Hypoxia-inducible factor 1-alpha


(Homo sapiens (Human))		BDBM50354129
PNG
(CHEMBL1836180)
Show SMILES COc1ccc(cc1-n1c(CN2CCNCC2)nc2ccccc2c1=O)[N+]([O-])=O |(4.67,-1.54,;3.33,-.77,;3.33,.77,;4.67,1.54,;4.67,3.08,;3.33,3.85,;2,3.08,;2,1.54,;.67,.77,;.67,-.77,;2,-1.54,;2,-3.08,;.67,-3.85,;.67,-5.39,;2,-6.16,;3.33,-5.39,;3.33,-3.85,;-.67,-1.54,;-2,-.77,;-3.33,-1.54,;-4.67,-.77,;-4.67,.77,;-3.33,1.54,;-2,.77,;-.67,1.54,;-.67,3.08,;3.33,5.39,;4.67,6.16,;2,6.16,)|
Show InChI InChI=1S/C20H21N5O4/c1-29-18-7-6-14(25(27)28)12-17(18)24-19(13-23-10-8-21-9-11-23)22-16-5-3-2-4-15(16)20(24)26/h2-7,12,21H,8-11,13H2,1H3
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Article
PubMed
n/an/a 4.20E+3n/an/an/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Inhibition of hypoxia-induced HIF1alpha activation in human ME180 cells by HRE3-Bla-luciferase reporter gene assay

Bioorg Med Chem Lett 21: 5239-43 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.043
BindingDB Entry DOI: 10.7270/Q2H70G65
More data for this
Ligand-Target Pair