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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Hypoxia-inducible factor 1-alpha' and Ligand = 'BDBM50329891'   
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
Hypoxia-inducible factor 1-alpha


(Homo sapiens (Human))
BDBM50329891
PNG
(2-chloro-N-(6-(5-ethyl-4-hydroxy-6-methylpyrimidin...)
Show SMILES CCc1c(C)nc([nH]c1=O)-c1ccc(NC(=O)CCl)cn1
Show InChI InChI=1S/C14H15ClN4O2/c1-3-10-8(2)17-13(19-14(10)21)11-5-4-9(7-16-11)18-12(20)6-15/h4-5,7H,3,6H2,1-2H3,(H,18,20)(H,17,19,21)
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PC cid
PC sid
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Similars

Article
PubMed
n/an/a 1.50E+3n/an/an/an/an/an/a



Piramal Life Sciences

Curated by ChEMBL


Assay Description
Inhibition of HIF1alpha in human U251 cells under hypoxic condition by luciferase reporter gene assay


Bioorg Med Chem Lett 20: 6426-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.09.083
BindingDB Entry DOI: 10.7270/Q2HX1CXM
More data for this
Ligand-Target Pair
Hypoxia-inducible factor 1-alpha


(Homo sapiens (Human))
BDBM50329891
PNG
(2-chloro-N-(6-(5-ethyl-4-hydroxy-6-methylpyrimidin...)
Show SMILES CCc1c(C)nc([nH]c1=O)-c1ccc(NC(=O)CCl)cn1
Show InChI InChI=1S/C14H15ClN4O2/c1-3-10-8(2)17-13(19-14(10)21)11-5-4-9(7-16-11)18-12(20)6-15/h4-5,7H,3,6H2,1-2H3,(H,18,20)(H,17,19,21)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 5.50E+3n/an/an/an/an/an/a



Piramal Life Sciences

Curated by ChEMBL


Assay Description
Inhibition of HIF1alpha in human U251 cells under normoxic condition by luciferase reporter gene assay


Bioorg Med Chem Lett 20: 6426-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.09.083
BindingDB Entry DOI: 10.7270/Q2HX1CXM
More data for this
Ligand-Target Pair