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Compile Data Set for Download or QSAR

Found 2 hits with Last Name = 'sanoja' and Initial = 'c'   
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
Squalene synthase


(Homo sapiens (Human))
BDBM18957
PNG
((2-{4-[(2-butyl-1-benzofuran-3-yl)carbonyl]-2,6-di...)
Show SMILES CCCCc1oc2ccccc2c1C(=O)c1cc(I)c(OCCN(CC)CC)c(I)c1
Show InChI InChI=1S/C25H29I2NO3/c1-4-7-11-22-23(18-10-8-9-12-21(18)31-22)24(29)17-15-19(26)25(20(27)16-17)30-14-13-28(5-2)6-3/h8-10,12,15-16H,4-7,11,13-14H2,1-3H3
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PC cid
PC sid
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Article
PubMed
n/an/a 8.00E+3n/an/an/an/an/an/a



Instituto Venezolano de Investigaciones Científicas

Curated by ChEMBL


Assay Description
Inhibitory activity against Trypanosoma cruzi glycosomal squalene synthase


J Med Chem 49: 892-9 (2006)


Article DOI: 10.1021/jm050691f
BindingDB Entry DOI: 10.7270/Q2183626
More data for this
Ligand-Target Pair
Squalene monooxygenase


(Homo sapiens (Human))
BDBM18957
PNG
((2-{4-[(2-butyl-1-benzofuran-3-yl)carbonyl]-2,6-di...)
Show SMILES CCCCc1oc2ccccc2c1C(=O)c1cc(I)c(OCCN(CC)CC)c(I)c1
Show InChI InChI=1S/C25H29I2NO3/c1-4-7-11-22-23(18-10-8-9-12-21(18)31-22)24(29)17-15-19(26)25(20(27)16-17)30-14-13-28(5-2)6-3/h8-10,12,15-16H,4-7,11,13-14H2,1-3H3
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KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
DrugBank
MCE
KEGG
PC cid
PC sid
PDB
UniChem

Patents


Similars

Article
PubMed
n/an/a 1.20E+4n/an/an/an/an/an/a



Instituto Venezolano de Investigaciones Científicas

Curated by ChEMBL


Assay Description
Inhibitory activity against Trypanosoma cruzi microsomal squalene synthase


J Med Chem 49: 892-9 (2006)


Article DOI: 10.1021/jm050691f
BindingDB Entry DOI: 10.7270/Q2183626
More data for this
Ligand-Target Pair