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Compile Data Set for Download or QSAR

Found 10 hits of ic50 data for polymerid = 50007205   
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
Sterol O-acyltransferase 2


(Chlorocebus aethiops)
BDBM50204552
PNG
(CHEMBL3959948)
Show SMILES CCC[C@@H]1C\C(C[C@@]2(O1)C(=O)Nc1ccccc21)=N\OCc1ccccc1
Show InChI InChI=1S/C22H24N2O3/c1-2-8-18-13-17(24-26-15-16-9-4-3-5-10-16)14-22(27-18)19-11-6-7-12-20(19)23-21(22)25/h3-7,9-12,18H,2,8,13-15H2,1H3,(H,23,25)/b24-17-/t18-,22+/m1/s1
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PubMed
n/an/a 1.50E+3n/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


Assay Description
Inhibition of African green monkey SOAT2 expressed in CHO cells assessed as reduction in [14C]cholesteryl ester formation from [1-14C]oleic acid meas...


Bioorg Med Chem Lett 26: 5899-5901 (2016)


Article DOI: 10.1016/j.bmcl.2016.11.008
BindingDB Entry DOI: 10.7270/Q2D220KD
More data for this
Ligand-Target Pair
Sterol O-acyltransferase 2


(Chlorocebus aethiops)
BDBM50204547
PNG
(CHEMBL3923673)
Show SMILES CCC[C@@H]1CC(C[C@@]2(O1)C(=O)Nc1ccccc21)=NOCc1ccccc1
Show InChI InChI=1S/C22H24N2O3/c1-2-8-18-13-17(24-26-15-16-9-4-3-5-10-16)14-22(27-18)19-11-6-7-12-20(19)23-21(22)25/h3-7,9-12,18H,2,8,13-15H2,1H3,(H,23,25)/t18-,22+/m1/s1
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PubMed
n/an/a 3.00E+3n/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


Assay Description
Inhibition of African green monkey SOAT2 expressed in CHO cells assessed as reduction in [14C]cholesteryl ester formation from [1-14C]oleic acid meas...


Bioorg Med Chem Lett 26: 5899-5901 (2016)


Article DOI: 10.1016/j.bmcl.2016.11.008
BindingDB Entry DOI: 10.7270/Q2D220KD
More data for this
Ligand-Target Pair
Sterol O-acyltransferase 2


(Chlorocebus aethiops)
BDBM50204550
PNG
(CHEMBL3916935)
Show SMILES CCC[C@@H]1C[C@H](C[C@@]2(O1)C(=O)Nc1ccccc21)NCc1ccccc1
Show InChI InChI=1S/C22H26N2O2/c1-2-8-18-13-17(23-15-16-9-4-3-5-10-16)14-22(26-18)19-11-6-7-12-20(19)24-21(22)25/h3-7,9-12,17-18,23H,2,8,13-15H2,1H3,(H,24,25)/t17-,18-,22+/m1/s1
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n/an/a 6.80E+3n/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


Assay Description
Inhibition of African green monkey SOAT2 expressed in CHO cells assessed as reduction in [14C]cholesteryl ester formation from [1-14C]oleic acid meas...


Bioorg Med Chem Lett 26: 5899-5901 (2016)


Article DOI: 10.1016/j.bmcl.2016.11.008
BindingDB Entry DOI: 10.7270/Q2D220KD
More data for this
Ligand-Target Pair
Sterol O-acyltransferase 2


(Chlorocebus aethiops)
BDBM50204553
PNG
(CHEMBL3971022)
Show SMILES CCC[C@@H]1C[C@H](C[C@@]2(O1)C(=O)N(Cc1ccccc1)c1ccccc21)NCc1ccccc1
Show InChI InChI=1S/C29H32N2O2/c1-2-11-25-18-24(30-20-22-12-5-3-6-13-22)19-29(33-25)26-16-9-10-17-27(26)31(28(29)32)21-23-14-7-4-8-15-23/h3-10,12-17,24-25,30H,2,11,18-21H2,1H3/t24-,25-,29+/m1/s1
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n/an/a 9.10E+3n/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


Assay Description
Inhibition of African green monkey SOAT2 expressed in CHO cells assessed as reduction in [14C]cholesteryl ester formation from [1-14C]oleic acid meas...


Bioorg Med Chem Lett 26: 5899-5901 (2016)


Article DOI: 10.1016/j.bmcl.2016.11.008
BindingDB Entry DOI: 10.7270/Q2D220KD
More data for this
Ligand-Target Pair
Sterol O-acyltransferase 2


(Chlorocebus aethiops)
BDBM50204545
PNG
(CHEMBL3898917)
Show SMILES CCC[C@@H]1CC(=O)C[C@@]2(O1)C(=O)N(C)c1cccc(Br)c21
Show InChI InChI=1S/C16H18BrNO3/c1-3-5-11-8-10(19)9-16(21-11)14-12(17)6-4-7-13(14)18(2)15(16)20/h4,6-7,11H,3,5,8-9H2,1-2H3/t11-,16+/m1/s1
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n/an/a 9.30E+3n/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


Assay Description
Inhibition of African green monkey SOAT2 expressed in CHO cells assessed as reduction in [14C]cholesteryl ester formation from [1-14C]oleic acid meas...


Bioorg Med Chem Lett 26: 5899-5901 (2016)


Article DOI: 10.1016/j.bmcl.2016.11.008
BindingDB Entry DOI: 10.7270/Q2D220KD
More data for this
Ligand-Target Pair
Sterol O-acyltransferase 2


(Chlorocebus aethiops)
BDBM50204558
PNG
(CHEMBL3960874)
Show SMILES CCC[C@@H]1C[C@H](C[C@@]2(O1)C(=O)Nc1cccc(Br)c21)NCc1ccccc1
Show InChI InChI=1S/C22H25BrN2O2/c1-2-7-17-12-16(24-14-15-8-4-3-5-9-15)13-22(27-17)20-18(23)10-6-11-19(20)25-21(22)26/h3-6,8-11,16-17,24H,2,7,12-14H2,1H3,(H,25,26)/t16-,17-,22+/m1/s1
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Article
PubMed
n/an/a 1.20E+4n/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


Assay Description
Inhibition of African green monkey SOAT2 expressed in CHO cells assessed as reduction in [14C]cholesteryl ester formation from [1-14C]oleic acid meas...


Bioorg Med Chem Lett 26: 5899-5901 (2016)


Article DOI: 10.1016/j.bmcl.2016.11.008
BindingDB Entry DOI: 10.7270/Q2D220KD
More data for this
Ligand-Target Pair
Sterol O-acyltransferase 2


(Chlorocebus aethiops)
BDBM50204551
PNG
(CHEMBL3958875)
Show SMILES CCC[C@H]1C\C(C[C@]2(O1)C(=O)Nc1ccccc21)=N\OCc1ccccc1
Show InChI InChI=1S/C22H24N2O3/c1-2-8-18-13-17(24-26-15-16-9-4-3-5-10-16)14-22(27-18)19-11-6-7-12-20(19)23-21(22)25/h3-7,9-12,18H,2,8,13-15H2,1H3,(H,23,25)/b24-17-/t18-,22+/m0/s1
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n/an/a 1.60E+4n/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


Assay Description
Inhibition of African green monkey SOAT2 expressed in CHO cells assessed as reduction in [14C]cholesteryl ester formation from [1-14C]oleic acid meas...


Bioorg Med Chem Lett 26: 5899-5901 (2016)


Article DOI: 10.1016/j.bmcl.2016.11.008
BindingDB Entry DOI: 10.7270/Q2D220KD
More data for this
Ligand-Target Pair
Sterol O-acyltransferase 2


(Chlorocebus aethiops)
BDBM50204555
PNG
(CHEMBL3983935)
Show SMILES CCC[C@@H]1C[C@H](C[C@@]2(O1)C(=O)Nc1ccccc21)N1CCCC1
Show InChI InChI=1S/C19H26N2O2/c1-2-7-15-12-14(21-10-5-6-11-21)13-19(23-15)16-8-3-4-9-17(16)20-18(19)22/h3-4,8-9,14-15H,2,5-7,10-13H2,1H3,(H,20,22)/t14-,15-,19+/m1/s1
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n/an/a 2.60E+4n/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


Assay Description
Inhibition of African green monkey SOAT2 expressed in CHO cells assessed as reduction in [14C]cholesteryl ester formation from [1-14C]oleic acid meas...


Bioorg Med Chem Lett 26: 5899-5901 (2016)


Article DOI: 10.1016/j.bmcl.2016.11.008
BindingDB Entry DOI: 10.7270/Q2D220KD
More data for this
Ligand-Target Pair
Sterol O-acyltransferase 2


(Chlorocebus aethiops)
BDBM50204556
PNG
(CHEMBL3941429)
Show SMILES CCC[C@@H]1C[C@H](C[C@@]2(O1)C(=O)N(C)c1ccccc21)NCc1ccccc1
Show InChI InChI=1S/C23H28N2O2/c1-3-9-19-14-18(24-16-17-10-5-4-6-11-17)15-23(27-19)20-12-7-8-13-21(20)25(2)22(23)26/h4-8,10-13,18-19,24H,3,9,14-16H2,1-2H3/t18-,19-,23+/m1/s1
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n/an/a>2.70E+4n/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


Assay Description
Inhibition of African green monkey SOAT2 expressed in CHO cells assessed as reduction in [14C]cholesteryl ester formation from [1-14C]oleic acid meas...


Bioorg Med Chem Lett 26: 5899-5901 (2016)


Article DOI: 10.1016/j.bmcl.2016.11.008
BindingDB Entry DOI: 10.7270/Q2D220KD
More data for this
Ligand-Target Pair
Sterol O-acyltransferase 2


(Chlorocebus aethiops)
BDBM50204548
PNG
(CHEMBL3932453)
Show SMILES CCC[C@@H]1C[C@H](C[C@@]2(O1)C(=O)N(C)c1cccc(Br)c21)NCc1ccccc1
Show InChI InChI=1S/C23H27BrN2O2/c1-3-8-18-13-17(25-15-16-9-5-4-6-10-16)14-23(28-18)21-19(24)11-7-12-20(21)26(2)22(23)27/h4-7,9-12,17-18,25H,3,8,13-15H2,1-2H3/t17-,18-,23+/m1/s1
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Article
PubMed
n/an/a>3.30E+4n/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


Assay Description
Inhibition of African green monkey SOAT2 expressed in CHO cells assessed as reduction in [14C]cholesteryl ester formation from [1-14C]oleic acid meas...


Bioorg Med Chem Lett 26: 5899-5901 (2016)


Article DOI: 10.1016/j.bmcl.2016.11.008
BindingDB Entry DOI: 10.7270/Q2D220KD
More data for this
Ligand-Target Pair