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Compile Data Set for Download or QSAR

Found 158 hits with Last Name = 'ariazi' and Initial = 'jl'   
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
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50420316
PNG
(CHEMBL2089119)
Show SMILES Cc1c(Cl)cccc1Cn1c(SCC(O)=O)nc(=O)c2sc(nc12)N1CCOCC1
Show InChI InChI=1S/C19H19ClN4O4S2/c1-11-12(3-2-4-13(11)20)9-24-16-15(17(27)22-19(24)29-10-14(25)26)30-18(21-16)23-5-7-28-8-6-23/h2-4H,5-10H2,1H3,(H,25,26)
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n/an/a 0.0500n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of PI3K beta by continuous TR-FRET assay


ACS Med Chem Lett 3: 524-529 (2012)


Article DOI: 10.1021/ml300045b
BindingDB Entry DOI: 10.7270/Q2J967PT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50420311
PNG
(CHEMBL2089114)
Show SMILES Cc1c(Cl)cccc1Cn1c(CO)nc(=O)c2sc(nc12)N1CCOCC1
Show InChI InChI=1S/C18H19ClN4O3S/c1-11-12(3-2-4-13(11)19)9-23-14(10-24)20-17(25)15-16(23)21-18(27-15)22-5-7-26-8-6-22/h2-4,24H,5-10H2,1H3
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n/an/a 0.100n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of PI3K beta by continuous TR-FRET assay


ACS Med Chem Lett 3: 524-529 (2012)


Article DOI: 10.1021/ml300045b
BindingDB Entry DOI: 10.7270/Q2J967PT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50420321
PNG
(CHEMBL2089112)
Show SMILES Cc1c(Cn2c(CO)nc(=O)c3sc(nc23)N2CCOCC2)cccc1C(F)(F)F
Show InChI InChI=1S/C19H19F3N4O3S/c1-11-12(3-2-4-13(11)19(20,21)22)9-26-14(10-27)23-17(28)15-16(26)24-18(30-15)25-5-7-29-8-6-25/h2-4,27H,5-10H2,1H3
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n/an/a 0.200n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of PI3K beta by continuous TR-FRET assay


ACS Med Chem Lett 3: 524-529 (2012)


Article DOI: 10.1021/ml300045b
BindingDB Entry DOI: 10.7270/Q2J967PT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50420309
PNG
(CHEMBL2089120)
Show SMILES Cc1c(Cl)cccc1Cn1c(N)nc(=O)c2sc(nc12)N1CCOCC1
Show InChI InChI=1S/C17H18ClN5O2S/c1-10-11(3-2-4-12(10)18)9-23-14-13(15(24)21-16(23)19)26-17(20-14)22-5-7-25-8-6-22/h2-4H,5-9H2,1H3,(H2,19,21,24)
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TBA

Curated by ChEMBL


Assay Description
Inhibition of PI3K beta by continuous TR-FRET assay


ACS Med Chem Lett 3: 524-529 (2012)


Article DOI: 10.1021/ml300045b
BindingDB Entry DOI: 10.7270/Q2J967PT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50420317
PNG
(CHEMBL2089118)
Show SMILES CSc1nc(=O)c2sc(nc2n1Cc1cccc(Cl)c1C)N1CCOCC1
Show InChI InChI=1S/C18H19ClN4O2S2/c1-11-12(4-3-5-13(11)19)10-23-15-14(16(24)21-18(23)26-2)27-17(20-15)22-6-8-25-9-7-22/h3-5H,6-10H2,1-2H3
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TBA

Curated by ChEMBL


Assay Description
Inhibition of PI3K beta by continuous TR-FRET assay


ACS Med Chem Lett 3: 524-529 (2012)


Article DOI: 10.1021/ml300045b
BindingDB Entry DOI: 10.7270/Q2J967PT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50420310
PNG
(CHEMBL2089116)
Show SMILES COc1nc(=O)c2sc(nc2n1Cc1cccc(Cl)c1C)N1CCOCC1
Show InChI InChI=1S/C18H19ClN4O3S/c1-11-12(4-3-5-13(11)19)10-23-15-14(16(24)21-17(23)25-2)27-18(20-15)22-6-8-26-9-7-22/h3-5H,6-10H2,1-2H3
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n/an/a 0.300n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of PI3K beta by continuous TR-FRET assay


ACS Med Chem Lett 3: 524-529 (2012)


Article DOI: 10.1021/ml300045b
BindingDB Entry DOI: 10.7270/Q2J967PT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50420312
PNG
(CHEMBL2089109)
Show SMILES Cc1c(Cn2c(nc(=O)c3sc(nc23)N2CCOCC2)C2CC2)cccc1C(F)(F)F
Show InChI InChI=1S/C21H21F3N4O2S/c1-12-14(3-2-4-15(12)21(22,23)24)11-28-17(13-5-6-13)25-19(29)16-18(28)26-20(31-16)27-7-9-30-10-8-27/h2-4,13H,5-11H2,1H3
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TBA

Curated by ChEMBL


Assay Description
Inhibition of PI3K beta by continuous TR-FRET assay


ACS Med Chem Lett 3: 524-529 (2012)


Article DOI: 10.1021/ml300045b
BindingDB Entry DOI: 10.7270/Q2J967PT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50420313
PNG
(CHEMBL2089108)
Show SMILES CCc1nc(=O)c2sc(nc2n1Cc1cccc(c1C)C(F)(F)F)N1CCOCC1
Show InChI InChI=1S/C20H21F3N4O2S/c1-3-15-24-18(28)16-17(25-19(30-16)26-7-9-29-10-8-26)27(15)11-13-5-4-6-14(12(13)2)20(21,22)23/h4-6H,3,7-11H2,1-2H3
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TBA

Curated by ChEMBL


Assay Description
Inhibition of PI3K beta by continuous TR-FRET assay


ACS Med Chem Lett 3: 524-529 (2012)


Article DOI: 10.1021/ml300045b
BindingDB Entry DOI: 10.7270/Q2J967PT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50420314
PNG
(CHEMBL2089107)
Show SMILES Cc1nc(=O)c2sc(nc2n1Cc1cccc(Cl)c1C)N1CCOCC1
Show InChI InChI=1S/C18H19ClN4O2S/c1-11-13(4-3-5-14(11)19)10-23-12(2)20-17(24)15-16(23)21-18(26-15)22-6-8-25-9-7-22/h3-5H,6-10H2,1-2H3
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TBA

Curated by ChEMBL


Assay Description
Inhibition of PI3K beta by continuous TR-FRET assay


ACS Med Chem Lett 3: 524-529 (2012)


Article DOI: 10.1021/ml300045b
BindingDB Entry DOI: 10.7270/Q2J967PT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50420315
PNG
(CHEMBL2089106)
Show SMILES Cc1nc(=O)c2sc(nc2n1Cc1cccc(c1C)C(F)(F)F)N1CCOCC1
Show InChI InChI=1S/C19H19F3N4O2S/c1-11-13(4-3-5-14(11)19(20,21)22)10-26-12(2)23-17(27)15-16(26)24-18(29-15)25-6-8-28-9-7-25/h3-5H,6-10H2,1-2H3
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n/an/a 0.600n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of PI3K beta by continuous TR-FRET assay


ACS Med Chem Lett 3: 524-529 (2012)


Article DOI: 10.1021/ml300045b
BindingDB Entry DOI: 10.7270/Q2J967PT
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (Human))
BDBM50287311
PNG
(CHEMBL4176968)
Show SMILES CC[C@@]1(CC(O)=O)CCc2cc(ccc2C1=O)-c1ccc(NC(=O)Nc2cccc(c2)C(F)(F)F)cc1 |r|
Show InChI InChI=1S/C28H25F3N2O4/c1-2-27(16-24(34)35)13-12-19-14-18(8-11-23(19)25(27)36)17-6-9-21(10-7-17)32-26(37)33-22-5-3-4-20(15-22)28(29,30)31/h3-11,14-15H,2,12-13,16H2,1H3,(H,34,35)(H2,32,33,37)/t27-/m0/s1
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n/an/a 1n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of recombinant human DGAT1 expressed in baculovirus infected Sf9 insect microsomal membranes using C10-DAG and [3H]-labelled decanoyl-CoA ...


ACS Med Chem Lett 9: 103-108 (2018)


Article DOI: 10.1021/acsmedchemlett.7b00450
BindingDB Entry DOI: 10.7270/Q2V127C9
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50420316
PNG
(CHEMBL2089119)
Show SMILES Cc1c(Cl)cccc1Cn1c(SCC(O)=O)nc(=O)c2sc(nc12)N1CCOCC1
Show InChI InChI=1S/C19H19ClN4O4S2/c1-11-12(3-2-4-13(11)20)9-24-16-15(17(27)22-19(24)29-10-14(25)26)30-18(21-16)23-5-7-28-8-6-23/h2-4H,5-10H2,1H3,(H,25,26)
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TBA

Curated by ChEMBL


Assay Description
Inhibition of PI3K delta by continuous TR-FRET assay


ACS Med Chem Lett 3: 524-529 (2012)


Article DOI: 10.1021/ml300045b
BindingDB Entry DOI: 10.7270/Q2J967PT
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (Human))
BDBM50287389
PNG
(CHEMBL4174767)
Show SMILES CC[C@@]1(CC(O)=O)CCc2cc(ccc2C1=O)-c1ccc(NC(=O)Nc2ccc(Cl)cc2)cc1 |r|
Show InChI InChI=1S/C27H25ClN2O4/c1-2-27(16-24(31)32)14-13-19-15-18(5-12-23(19)25(27)33)17-3-8-21(9-4-17)29-26(34)30-22-10-6-20(28)7-11-22/h3-12,15H,2,13-14,16H2,1H3,(H,31,32)(H2,29,30,34)/t27-/m0/s1
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GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of recombinant human DGAT1 expressed in baculovirus infected Sf9 insect microsomal membranes using C10-DAG and C10-CoA as substrate pretre...


ACS Med Chem Lett 9: 103-108 (2018)


Article DOI: 10.1021/acsmedchemlett.7b00450
BindingDB Entry DOI: 10.7270/Q2V127C9
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50420311
PNG
(CHEMBL2089114)
Show SMILES Cc1c(Cl)cccc1Cn1c(CO)nc(=O)c2sc(nc12)N1CCOCC1
Show InChI InChI=1S/C18H19ClN4O3S/c1-11-12(3-2-4-13(11)19)9-23-14(10-24)20-17(25)15-16(23)21-18(27-15)22-5-7-26-8-6-22/h2-4,24H,5-10H2,1H3
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TBA

Curated by ChEMBL


Assay Description
Inhibition of PI3K delta by continuous TR-FRET assay


ACS Med Chem Lett 3: 524-529 (2012)


Article DOI: 10.1021/ml300045b
BindingDB Entry DOI: 10.7270/Q2J967PT
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (Human))
BDBM50287453
PNG
(CHEMBL4163300)
Show SMILES CCC1(CC(O)=O)CCc2cc(ccc2C1=O)-c1ccc(NC(=O)Nc2ccc(Cl)cc2)cc1
Show InChI InChI=1S/C27H25ClN2O4/c1-2-27(16-24(31)32)14-13-19-15-18(5-12-23(19)25(27)33)17-3-8-21(9-4-17)29-26(34)30-22-10-6-20(28)7-11-22/h3-12,15H,2,13-14,16H2,1H3,(H,31,32)(H2,29,30,34)
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GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of recombinant human DGAT1 expressed in baculovirus infected Sf9 insect microsomal membranes using C10-DAG and C10-CoA as substrate pretre...


ACS Med Chem Lett 9: 103-108 (2018)


Article DOI: 10.1021/acsmedchemlett.7b00450
BindingDB Entry DOI: 10.7270/Q2V127C9
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (Human))
BDBM50287311
PNG
(CHEMBL4176968)
Show SMILES CC[C@@]1(CC(O)=O)CCc2cc(ccc2C1=O)-c1ccc(NC(=O)Nc2cccc(c2)C(F)(F)F)cc1 |r|
Show InChI InChI=1S/C28H25F3N2O4/c1-2-27(16-24(34)35)13-12-19-14-18(8-11-23(19)25(27)36)17-6-9-21(10-7-17)32-26(37)33-22-5-3-4-20(15-22)28(29,30)31/h3-11,14-15H,2,12-13,16H2,1H3,(H,34,35)(H2,32,33,37)/t27-/m0/s1
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GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of recombinant human DGAT1 expressed in baculovirus infected Sf9 insect microsomal membranes using C10-DAG and C10-CoA as substrate pretre...


ACS Med Chem Lett 9: 103-108 (2018)


Article DOI: 10.1021/acsmedchemlett.7b00450
BindingDB Entry DOI: 10.7270/Q2V127C9
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (Human))
BDBM50287449
PNG
(CHEMBL4176181)
Show SMILES OC(=O)CC1(CC(F)(F)F)CCc2cc(ccc2C1=O)-c1ccc(NC(=O)Nc2ccccc2)cc1
Show InChI InChI=1S/C27H23F3N2O4/c28-27(29,30)16-26(15-23(33)34)13-12-19-14-18(8-11-22(19)24(26)35)17-6-9-21(10-7-17)32-25(36)31-20-4-2-1-3-5-20/h1-11,14H,12-13,15-16H2,(H,33,34)(H2,31,32,36)
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GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of recombinant human DGAT1 expressed in baculovirus infected Sf9 insect microsomal membranes using C10-DAG and C10-CoA as substrate pretre...


ACS Med Chem Lett 9: 103-108 (2018)


Article DOI: 10.1021/acsmedchemlett.7b00450
BindingDB Entry DOI: 10.7270/Q2V127C9
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (Human))
BDBM50287329
PNG
(CHEMBL4163009)
Show SMILES OC(=O)C[C@]1(CC(F)(F)F)CCc2cc(ccc2C1=O)-c1cnc(NC(=O)Nc2cccc(c2)C(F)(F)F)cn1 |r|
Show InChI InChI=1S/C26H20F6N4O4/c27-25(28,29)13-24(10-21(37)38)7-6-14-8-15(4-5-18(14)22(24)39)19-11-34-20(12-33-19)36-23(40)35-17-3-1-2-16(9-17)26(30,31)32/h1-5,8-9,11-12H,6-7,10,13H2,(H,37,38)(H2,34,35,36,40)/t24-/m0/s1
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GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of recombinant human DGAT1 expressed in baculovirus infected Sf9 insect microsomal membranes using C10-DAG and [3H]-labelled decanoyl-CoA ...


ACS Med Chem Lett 9: 103-108 (2018)


Article DOI: 10.1021/acsmedchemlett.7b00450
BindingDB Entry DOI: 10.7270/Q2V127C9
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (Human))
BDBM50287313
PNG
(CHEMBL4168991)
Show SMILES CCC1(CC(O)=O)CCc2cc(ccc2C1=O)-c1ccc(NC(=O)Nc2cccc(c2)C(F)(F)F)cc1
Show InChI InChI=1S/C28H25F3N2O4/c1-2-27(16-24(34)35)13-12-19-14-18(8-11-23(19)25(27)36)17-6-9-21(10-7-17)32-26(37)33-22-5-3-4-20(15-22)28(29,30)31/h3-11,14-15H,2,12-13,16H2,1H3,(H,34,35)(H2,32,33,37)
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n/an/a 3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of recombinant human DGAT1 expressed in baculovirus infected Sf9 insect microsomal membranes using C10-DAG and C10-CoA as substrate pretre...


ACS Med Chem Lett 9: 103-108 (2018)


Article DOI: 10.1021/acsmedchemlett.7b00450
BindingDB Entry DOI: 10.7270/Q2V127C9
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50420309
PNG
(CHEMBL2089120)
Show SMILES Cc1c(Cl)cccc1Cn1c(N)nc(=O)c2sc(nc12)N1CCOCC1
Show InChI InChI=1S/C17H18ClN5O2S/c1-10-11(3-2-4-12(10)18)9-23-14-13(15(24)21-16(23)19)26-17(20-14)22-5-7-25-8-6-22/h2-4H,5-9H2,1H3,(H2,19,21,24)
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n/an/a 3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of PI3K delta by continuous TR-FRET assay


ACS Med Chem Lett 3: 524-529 (2012)


Article DOI: 10.1021/ml300045b
BindingDB Entry DOI: 10.7270/Q2J967PT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50420321
PNG
(CHEMBL2089112)
Show SMILES Cc1c(Cn2c(CO)nc(=O)c3sc(nc23)N2CCOCC2)cccc1C(F)(F)F
Show InChI InChI=1S/C19H19F3N4O3S/c1-11-12(3-2-4-13(11)19(20,21)22)9-26-14(10-27)23-17(28)15-16(26)24-18(30-15)25-5-7-29-8-6-25/h2-4,27H,5-10H2,1H3
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n/an/a 3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of PI3K delta by continuous TR-FRET assay


ACS Med Chem Lett 3: 524-529 (2012)


Article DOI: 10.1021/ml300045b
BindingDB Entry DOI: 10.7270/Q2J967PT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50420324
PNG
(CHEMBL2089105)
Show SMILES Cc1c(Cl)cccc1Cn1cnc(=O)c2sc(nc12)N1CCOCC1
Show InChI InChI=1S/C17H17ClN4O2S/c1-11-12(3-2-4-13(11)18)9-22-10-19-16(23)14-15(22)20-17(25-14)21-5-7-24-8-6-21/h2-4,10H,5-9H2,1H3
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n/an/a 3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of PI3K beta by continuous TR-FRET assay


ACS Med Chem Lett 3: 524-529 (2012)


Article DOI: 10.1021/ml300045b
BindingDB Entry DOI: 10.7270/Q2J967PT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50420322
PNG
(CHEMBL2089111)
Show SMILES Cc1c(Cn2c(Cc3ccccc3)nc(=O)c3sc(nc23)N2CCOCC2)cccc1C(F)(F)F
Show InChI InChI=1S/C25H23F3N4O2S/c1-16-18(8-5-9-19(16)25(26,27)28)15-32-20(14-17-6-3-2-4-7-17)29-23(33)21-22(32)30-24(35-21)31-10-12-34-13-11-31/h2-9H,10-15H2,1H3
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n/an/a 3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of PI3K beta by continuous TR-FRET assay


ACS Med Chem Lett 3: 524-529 (2012)


Article DOI: 10.1021/ml300045b
BindingDB Entry DOI: 10.7270/Q2J967PT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50420325
PNG
(CHEMBL2089104)
Show SMILES Cc1c(Cn2cnc(=O)c3sc(nc23)N2CCOCC2)cccc1C(F)(F)F
Show InChI InChI=1S/C18H17F3N4O2S/c1-11-12(3-2-4-13(11)18(19,20)21)9-25-10-22-16(26)14-15(25)23-17(28-14)24-5-7-27-8-6-24/h2-4,10H,5-9H2,1H3
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n/an/a 3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of PI3K beta by continuous TR-FRET assay


ACS Med Chem Lett 3: 524-529 (2012)


Article DOI: 10.1021/ml300045b
BindingDB Entry DOI: 10.7270/Q2J967PT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50420320
PNG
(CHEMBL2089113)
Show SMILES Cc1c(Cn2c(CN)nc(=O)c3sc(nc23)N2CCOCC2)cccc1C(F)(F)F
Show InChI InChI=1S/C19H20F3N5O2S/c1-11-12(3-2-4-13(11)19(20,21)22)10-27-14(9-23)24-17(28)15-16(27)25-18(30-15)26-5-7-29-8-6-26/h2-4H,5-10,23H2,1H3
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n/an/a 3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of PI3K beta by continuous TR-FRET assay


ACS Med Chem Lett 3: 524-529 (2012)


Article DOI: 10.1021/ml300045b
BindingDB Entry DOI: 10.7270/Q2J967PT
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (Human))
BDBM50287310
PNG
(CHEMBL4173715)
Show SMILES OC(=O)C[C@]1(CC(F)(F)F)CCc2cc(ccc2C1=O)-c1cnc(NC(=O)Nc2ccc(F)c(F)c2)cn1 |r|
Show InChI InChI=1S/C25H19F5N4O4/c26-17-4-2-15(8-18(17)27)33-23(38)34-20-11-31-19(10-32-20)14-1-3-16-13(7-14)5-6-24(22(16)37,9-21(35)36)12-25(28,29)30/h1-4,7-8,10-11H,5-6,9,12H2,(H,35,36)(H2,32,33,34,38)/t24-/m0/s1
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n/an/a 3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of recombinant human DGAT1 expressed in baculovirus infected Sf9 insect microsomal membranes using C10-DAG and [3H]-labelled decanoyl-CoA ...


ACS Med Chem Lett 9: 103-108 (2018)


Article DOI: 10.1021/acsmedchemlett.7b00450
BindingDB Entry DOI: 10.7270/Q2V127C9
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50420318
PNG
(CHEMBL2089117)
Show SMILES Cc1c(Cl)cccc1Cn1c2nc(sc2c(=O)[nH]c1=S)N1CCOCC1
Show InChI InChI=1S/C17H17ClN4O2S2/c1-10-11(3-2-4-12(10)18)9-22-14-13(15(23)20-16(22)25)26-17(19-14)21-5-7-24-8-6-21/h2-4H,5-9H2,1H3,(H,20,23,25)
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n/an/a 5n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of PI3K beta by continuous TR-FRET assay


ACS Med Chem Lett 3: 524-529 (2012)


Article DOI: 10.1021/ml300045b
BindingDB Entry DOI: 10.7270/Q2J967PT
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (Human))
BDBM50287451
PNG
(CHEMBL4172357)
Show SMILES CCC1(CC(O)=O)CCc2cc(ccc2C1=O)-c1ccc(NC(=O)Nc2cccc(Cl)c2)cc1
Show InChI InChI=1S/C27H25ClN2O4/c1-2-27(16-24(31)32)13-12-19-14-18(8-11-23(19)25(27)33)17-6-9-21(10-7-17)29-26(34)30-22-5-3-4-20(28)15-22/h3-11,14-15H,2,12-13,16H2,1H3,(H,31,32)(H2,29,30,34)
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n/an/a 6n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of recombinant human DGAT1 expressed in baculovirus infected Sf9 insect microsomal membranes using C10-DAG and C10-CoA as substrate pretre...


ACS Med Chem Lett 9: 103-108 (2018)


Article DOI: 10.1021/acsmedchemlett.7b00450
BindingDB Entry DOI: 10.7270/Q2V127C9
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50420319
PNG
(CHEMBL2089115)
Show SMILES Cc1c(Cl)cccc1Cn1c2nc(sc2c(=O)[nH]c1=O)N1CCOCC1
Show InChI InChI=1S/C17H17ClN4O3S/c1-10-11(3-2-4-12(10)18)9-22-14-13(15(23)20-16(22)24)26-17(19-14)21-5-7-25-8-6-21/h2-4H,5-9H2,1H3,(H,20,23,24)
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n/an/a 8n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of PI3K beta by continuous TR-FRET assay


ACS Med Chem Lett 3: 524-529 (2012)


Article DOI: 10.1021/ml300045b
BindingDB Entry DOI: 10.7270/Q2J967PT
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (Human))
BDBM50287313
PNG
(CHEMBL4168991)
Show SMILES CCC1(CC(O)=O)CCc2cc(ccc2C1=O)-c1ccc(NC(=O)Nc2cccc(c2)C(F)(F)F)cc1
Show InChI InChI=1S/C28H25F3N2O4/c1-2-27(16-24(34)35)13-12-19-14-18(8-11-23(19)25(27)36)17-6-9-21(10-7-17)32-26(37)33-22-5-3-4-20(15-22)28(29,30)31/h3-11,14-15H,2,12-13,16H2,1H3,(H,34,35)(H2,32,33,37)
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n/an/a 8n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of recombinant human DGAT1 expressed in baculovirus infected Sf9 insect microsomal membranes using C10-DAG and [3H]-labelled decanoyl-CoA ...


ACS Med Chem Lett 9: 103-108 (2018)


Article DOI: 10.1021/acsmedchemlett.7b00450
BindingDB Entry DOI: 10.7270/Q2V127C9
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (Human))
BDBM50287389
PNG
(CHEMBL4174767)
Show SMILES CC[C@@]1(CC(O)=O)CCc2cc(ccc2C1=O)-c1ccc(NC(=O)Nc2ccc(Cl)cc2)cc1 |r|
Show InChI InChI=1S/C27H25ClN2O4/c1-2-27(16-24(31)32)14-13-19-15-18(5-12-23(19)25(27)33)17-3-8-21(9-4-17)29-26(34)30-22-10-6-20(28)7-11-22/h3-12,15H,2,13-14,16H2,1H3,(H,31,32)(H2,29,30,34)/t27-/m0/s1
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n/an/a 8n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of recombinant human DGAT1 expressed in baculovirus infected Sf9 insect microsomal membranes using C10-DAG and [3H]-labelled decanoyl-CoA ...


ACS Med Chem Lett 9: 103-108 (2018)


Article DOI: 10.1021/acsmedchemlett.7b00450
BindingDB Entry DOI: 10.7270/Q2V127C9
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (Human))
BDBM50287459
PNG
(CHEMBL4171309)
Show SMILES CC[C@@]1(CC(O)=O)CCc2cc(ccc2C1=O)-c1ccc(NC(=O)Nc2cccc(c2)C(F)(F)F)cc1Cl |r|
Show InChI InChI=1S/C28H24ClF3N2O4/c1-2-27(15-24(35)36)11-10-17-12-16(6-8-22(17)25(27)37)21-9-7-20(14-23(21)29)34-26(38)33-19-5-3-4-18(13-19)28(30,31)32/h3-9,12-14H,2,10-11,15H2,1H3,(H,35,36)(H2,33,34,38)/t27-/m0/s1
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n/an/a 8n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of recombinant human DGAT1 expressed in baculovirus infected Sf9 insect microsomal membranes using C10-DAG and [3H]-labelled decanoyl-CoA ...


ACS Med Chem Lett 9: 103-108 (2018)


Article DOI: 10.1021/acsmedchemlett.7b00450
BindingDB Entry DOI: 10.7270/Q2V127C9
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50420314
PNG
(CHEMBL2089107)
Show SMILES Cc1nc(=O)c2sc(nc2n1Cc1cccc(Cl)c1C)N1CCOCC1
Show InChI InChI=1S/C18H19ClN4O2S/c1-11-13(4-3-5-14(11)19)10-23-12(2)20-17(24)15-16(23)21-18(26-15)22-6-8-25-9-7-22/h3-5H,6-10H2,1-2H3
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n/an/a 10n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of PI3K delta by continuous TR-FRET assay


ACS Med Chem Lett 3: 524-529 (2012)


Article DOI: 10.1021/ml300045b
BindingDB Entry DOI: 10.7270/Q2J967PT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50420326
PNG
(CHEMBL2089103)
Show SMILES Clc1cccc(Cn2cnc(=O)c3sc(nc23)N2CCOCC2)c1Cl
Show InChI InChI=1S/C16H14Cl2N4O2S/c17-11-3-1-2-10(12(11)18)8-22-9-19-15(23)13-14(22)20-16(25-13)21-4-6-24-7-5-21/h1-3,9H,4-8H2
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n/an/a 10n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of PI3K beta by continuous TR-FRET assay


ACS Med Chem Lett 3: 524-529 (2012)


Article DOI: 10.1021/ml300045b
BindingDB Entry DOI: 10.7270/Q2J967PT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50420310
PNG
(CHEMBL2089116)
Show SMILES COc1nc(=O)c2sc(nc2n1Cc1cccc(Cl)c1C)N1CCOCC1
Show InChI InChI=1S/C18H19ClN4O3S/c1-11-12(4-3-5-13(11)19)10-23-15-14(16(24)21-17(23)25-2)27-18(20-15)22-6-8-26-9-7-22/h3-5H,6-10H2,1-2H3
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n/an/a 10n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of PI3K delta by continuous TR-FRET assay


ACS Med Chem Lett 3: 524-529 (2012)


Article DOI: 10.1021/ml300045b
BindingDB Entry DOI: 10.7270/Q2J967PT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50420317
PNG
(CHEMBL2089118)
Show SMILES CSc1nc(=O)c2sc(nc2n1Cc1cccc(Cl)c1C)N1CCOCC1
Show InChI InChI=1S/C18H19ClN4O2S2/c1-11-12(4-3-5-13(11)19)10-23-15-14(16(24)21-18(23)26-2)27-17(20-15)22-6-8-25-9-7-22/h3-5H,6-10H2,1-2H3
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n/an/a 10n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of PI3K delta by continuous TR-FRET assay


ACS Med Chem Lett 3: 524-529 (2012)


Article DOI: 10.1021/ml300045b
BindingDB Entry DOI: 10.7270/Q2J967PT
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (Human))
BDBM50287454
PNG
(CHEMBL4171202)
Show SMILES CCC1(CC(O)=O)CCc2cc(ccc2C1=O)-c1ccc(NC(=O)Nc2ccc(C)cc2)cc1
Show InChI InChI=1S/C28H28N2O4/c1-3-28(17-25(31)32)15-14-21-16-20(8-13-24(21)26(28)33)19-6-11-23(12-7-19)30-27(34)29-22-9-4-18(2)5-10-22/h4-13,16H,3,14-15,17H2,1-2H3,(H,31,32)(H2,29,30,34)
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n/an/a 10n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of recombinant human DGAT1 expressed in baculovirus infected Sf9 insect microsomal membranes using C10-DAG and C10-CoA as substrate pretre...


ACS Med Chem Lett 9: 103-108 (2018)


Article DOI: 10.1021/acsmedchemlett.7b00450
BindingDB Entry DOI: 10.7270/Q2V127C9
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50420313
PNG
(CHEMBL2089108)
Show SMILES CCc1nc(=O)c2sc(nc2n1Cc1cccc(c1C)C(F)(F)F)N1CCOCC1
Show InChI InChI=1S/C20H21F3N4O2S/c1-3-15-24-18(28)16-17(25-19(30-16)26-7-9-29-10-8-26)27(15)11-13-5-4-6-14(12(13)2)20(21,22)23/h4-6H,3,7-11H2,1-2H3
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n/an/a 13n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of PI3K delta by continuous TR-FRET assay


ACS Med Chem Lett 3: 524-529 (2012)


Article DOI: 10.1021/ml300045b
BindingDB Entry DOI: 10.7270/Q2J967PT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50420312
PNG
(CHEMBL2089109)
Show SMILES Cc1c(Cn2c(nc(=O)c3sc(nc23)N2CCOCC2)C2CC2)cccc1C(F)(F)F
Show InChI InChI=1S/C21H21F3N4O2S/c1-12-14(3-2-4-15(12)21(22,23)24)11-28-17(13-5-6-13)25-19(29)16-18(28)26-20(31-16)27-7-9-30-10-8-27/h2-4,13H,5-11H2,1H3
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n/an/a 16n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of PI3K delta by continuous TR-FRET assay


ACS Med Chem Lett 3: 524-529 (2012)


Article DOI: 10.1021/ml300045b
BindingDB Entry DOI: 10.7270/Q2J967PT
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (Human))
BDBM50287456
PNG
(CHEMBL4159532)
Show SMILES CC1(CC(O)=O)CCc2cc(ccc2C1=O)-c1ccc(NC(=O)Nc2cccc(Cl)c2)cc1
Show InChI InChI=1S/C26H23ClN2O4/c1-26(15-23(30)31)12-11-18-13-17(7-10-22(18)24(26)32)16-5-8-20(9-6-16)28-25(33)29-21-4-2-3-19(27)14-21/h2-10,13-14H,11-12,15H2,1H3,(H,30,31)(H2,28,29,33)
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n/an/a 16n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of recombinant human DGAT1 expressed in baculovirus infected Sf9 insect microsomal membranes using C10-DAG and C10-CoA as substrate pretre...


ACS Med Chem Lett 9: 103-108 (2018)


Article DOI: 10.1021/acsmedchemlett.7b00450
BindingDB Entry DOI: 10.7270/Q2V127C9
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (Human))
BDBM50287450
PNG
(CHEMBL4161067)
Show SMILES CCC1(CC(O)=O)CCc2cc(ccc2C1=O)-c1ccc(NC(=O)Nc2cccc(C)c2)cc1
Show InChI InChI=1S/C28H28N2O4/c1-3-28(17-25(31)32)14-13-21-16-20(9-12-24(21)26(28)33)19-7-10-22(11-8-19)29-27(34)30-23-6-4-5-18(2)15-23/h4-12,15-16H,3,13-14,17H2,1-2H3,(H,31,32)(H2,29,30,34)
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n/an/a 16n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of recombinant human DGAT1 expressed in baculovirus infected Sf9 insect microsomal membranes using C10-DAG and C10-CoA as substrate pretre...


ACS Med Chem Lett 9: 103-108 (2018)


Article DOI: 10.1021/acsmedchemlett.7b00450
BindingDB Entry DOI: 10.7270/Q2V127C9
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (Human))
BDBM50287448
PNG
(CHEMBL4172800)
Show SMILES CCCC1(CC(O)=O)CCc2cc(ccc2C1=O)-c1ccc(NC(=O)Nc2ccccc2)cc1
Show InChI InChI=1S/C28H28N2O4/c1-2-15-28(18-25(31)32)16-14-21-17-20(10-13-24(21)26(28)33)19-8-11-23(12-9-19)30-27(34)29-22-6-4-3-5-7-22/h3-13,17H,2,14-16,18H2,1H3,(H,31,32)(H2,29,30,34)
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n/an/a 16n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of recombinant human DGAT1 expressed in baculovirus infected Sf9 insect microsomal membranes using C10-DAG and C10-CoA as substrate pretre...


ACS Med Chem Lett 9: 103-108 (2018)


Article DOI: 10.1021/acsmedchemlett.7b00450
BindingDB Entry DOI: 10.7270/Q2V127C9
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (Human))
BDBM50287458
PNG
(CHEMBL4163414)
Show SMILES CC[C@@]1(CC(O)=O)CCc2cc(ccc2C1=O)-c1ccc(NC(=O)Nc2ccc(F)c(F)c2)cc1Cl |r|
Show InChI InChI=1S/C27H23ClF2N2O4/c1-2-27(14-24(33)34)10-9-16-11-15(3-6-20(16)25(27)35)19-7-4-17(12-21(19)28)31-26(36)32-18-5-8-22(29)23(30)13-18/h3-8,11-13H,2,9-10,14H2,1H3,(H,33,34)(H2,31,32,36)/t27-/m0/s1
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n/an/a 20n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of recombinant human DGAT1 expressed in baculovirus infected Sf9 insect microsomal membranes using C10-DAG and [3H]-labelled decanoyl-CoA ...


ACS Med Chem Lett 9: 103-108 (2018)


Article DOI: 10.1021/acsmedchemlett.7b00450
BindingDB Entry DOI: 10.7270/Q2V127C9
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (Human))
BDBM50287314
PNG
(CHEMBL4167907)
Show SMILES CCC1(CC(O)=O)CCc2cc(ccc2C1=O)-c1ccc(NC(=O)Nc2ccc(cc2)C(F)(F)F)cc1
Show InChI InChI=1S/C28H25F3N2O4/c1-2-27(16-24(34)35)14-13-19-15-18(5-12-23(19)25(27)36)17-3-8-21(9-4-17)32-26(37)33-22-10-6-20(7-11-22)28(29,30)31/h3-12,15H,2,13-14,16H2,1H3,(H,34,35)(H2,32,33,37)
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n/an/a 20n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of recombinant human DGAT1 expressed in baculovirus infected Sf9 insect microsomal membranes using C10-DAG and C10-CoA as substrate pretre...


ACS Med Chem Lett 9: 103-108 (2018)


Article DOI: 10.1021/acsmedchemlett.7b00450
BindingDB Entry DOI: 10.7270/Q2V127C9
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50420315
PNG
(CHEMBL2089106)
Show SMILES Cc1nc(=O)c2sc(nc2n1Cc1cccc(c1C)C(F)(F)F)N1CCOCC1
Show InChI InChI=1S/C19H19F3N4O2S/c1-11-13(4-3-5-14(11)19(20,21)22)10-26-12(2)23-17(27)15-16(26)24-18(29-15)25-6-8-28-9-7-25/h3-5H,6-10H2,1-2H3
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n/an/a 20n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of PI3K delta by continuous TR-FRET assay


ACS Med Chem Lett 3: 524-529 (2012)


Article DOI: 10.1021/ml300045b
BindingDB Entry DOI: 10.7270/Q2J967PT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50420331
PNG
(CHEMBL2089097)
Show SMILES Cc1ccccc1Cn1cnc(=O)c2sc(nc12)N1CCOCC1
Show InChI InChI=1S/C17H18N4O2S/c1-12-4-2-3-5-13(12)10-21-11-18-16(22)14-15(21)19-17(24-14)20-6-8-23-9-7-20/h2-5,11H,6-10H2,1H3
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n/an/a 25n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of PI3K beta by continuous TR-FRET assay


ACS Med Chem Lett 3: 524-529 (2012)


Article DOI: 10.1021/ml300045b
BindingDB Entry DOI: 10.7270/Q2J967PT
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (Human))
BDBM50287388
PNG
(CHEMBL4167845)
Show SMILES CC1(CC(O)=O)CCc2cc(ccc2C1=O)-c1ccc(NC(=O)Nc2cccc(c2)C(F)(F)F)cc1
Show InChI InChI=1S/C27H23F3N2O4/c1-26(15-23(33)34)12-11-18-13-17(7-10-22(18)24(26)35)16-5-8-20(9-6-16)31-25(36)32-21-4-2-3-19(14-21)27(28,29)30/h2-10,13-14H,11-12,15H2,1H3,(H,33,34)(H2,31,32,36)
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n/an/a 32n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of recombinant human DGAT1 expressed in baculovirus infected Sf9 insect microsomal membranes using C10-DAG and C10-CoA as substrate pretre...


ACS Med Chem Lett 9: 103-108 (2018)


Article DOI: 10.1021/acsmedchemlett.7b00450
BindingDB Entry DOI: 10.7270/Q2V127C9
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (Human))
BDBM50287452
PNG
(CHEMBL4175767)
Show SMILES CCC1(CC(O)=O)CCc2cc(ccc2C1=O)-c1ccc(NC(=O)Nc2cccc(F)c2)cc1
Show InChI InChI=1S/C27H25FN2O4/c1-2-27(16-24(31)32)13-12-19-14-18(8-11-23(19)25(27)33)17-6-9-21(10-7-17)29-26(34)30-22-5-3-4-20(28)15-22/h3-11,14-15H,2,12-13,16H2,1H3,(H,31,32)(H2,29,30,34)
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n/an/a 32n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of recombinant human DGAT1 expressed in baculovirus infected Sf9 insect microsomal membranes using C10-DAG and C10-CoA as substrate pretre...


ACS Med Chem Lett 9: 103-108 (2018)


Article DOI: 10.1021/acsmedchemlett.7b00450
BindingDB Entry DOI: 10.7270/Q2V127C9
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50420324
PNG
(CHEMBL2089105)
Show SMILES Cc1c(Cl)cccc1Cn1cnc(=O)c2sc(nc12)N1CCOCC1
Show InChI InChI=1S/C17H17ClN4O2S/c1-11-12(3-2-4-13(11)18)9-22-10-19-16(23)14-15(22)20-17(25-14)21-5-7-24-8-6-21/h2-4,10H,5-9H2,1H3
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n/an/a 40n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of PI3K delta by continuous TR-FRET assay


ACS Med Chem Lett 3: 524-529 (2012)


Article DOI: 10.1021/ml300045b
BindingDB Entry DOI: 10.7270/Q2J967PT
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (Human))
BDBM50287308
PNG
(CHEMBL4164478)
Show SMILES CCC1(CC(O)=O)CCc2cc(ccc2C1=O)-c1ccc(NC(=O)Nc2cccc(OC)c2)cc1
Show InChI InChI=1S/C28H28N2O5/c1-3-28(17-25(31)32)14-13-20-15-19(9-12-24(20)26(28)33)18-7-10-21(11-8-18)29-27(34)30-22-5-4-6-23(16-22)35-2/h4-12,15-16H,3,13-14,17H2,1-2H3,(H,31,32)(H2,29,30,34)
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n/an/a 50n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of recombinant human DGAT1 expressed in baculovirus infected Sf9 insect microsomal membranes using C10-DAG and C10-CoA as substrate pretre...


ACS Med Chem Lett 9: 103-108 (2018)


Article DOI: 10.1021/acsmedchemlett.7b00450
BindingDB Entry DOI: 10.7270/Q2V127C9
More data for this
Ligand-Target Pair
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