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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 = 'BDBM50329892'   
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))
BDBM50329892
PNG
(2-chloro-N-(6-(4-(chloromethyl)-6-hydroxypyrimidin...)
Show SMILES ClCC(=O)Nc1ccc(nc1)-c1nc(CCl)cc(=O)[nH]1
Show InChI InChI=1S/C12H10Cl2N4O2/c13-4-8-3-10(19)18-12(17-8)9-2-1-7(6-15-9)16-11(20)5-14/h1-3,6H,4-5H2,(H,16,20)(H,17,18,19)
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PC cid
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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))
BDBM50329892
PNG
(2-chloro-N-(6-(4-(chloromethyl)-6-hydroxypyrimidin...)
Show SMILES ClCC(=O)Nc1ccc(nc1)-c1nc(CCl)cc(=O)[nH]1
Show InChI InChI=1S/C12H10Cl2N4O2/c13-4-8-3-10(19)18-12(17-8)9-2-1-7(6-15-9)16-11(20)5-14/h1-3,6H,4-5H2,(H,16,20)(H,17,18,19)
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