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Compile Data Set for Download or QSAR

Found 43 hits of ec50 data for polymerid = 2090   
Target
(Institution)
LigandTarget
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
Diacylglycerol O-acyltransferase 1


(Homo sapiens (human))
BDBM50341770
PNG
(4-{5-[(2-Phenyl-5-trifluoromethyloxazole-4-carbony...)
Show SMILES CCOC(=O)N1CCN(CC1)c1ccc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cn1
Show InChI InChI=1S/C23H22F3N5O4/c1-2-34-22(33)31-12-10-30(11-13-31)17-9-8-16(14-27-17)28-20(32)18-19(23(24,25)26)35-21(29-18)15-6-4-3-5-7-15/h3-9,14H,2,10-13H2,1H3,(H,28,32)
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n/an/an/an/a 93n/an/an/an/a



Hoffmann-La Roche Inc.

Curated by ChEMBL


Assay Description
Inhibition of human DGAT1 expressed in CHO-K1 cells after 1 hr using palmitoyl-1-14C-coenzyme A by phospholipid flashplate assay


Citation and Details
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (human))
BDBM50341769
PNG
(2-Phenyl-5-trifluoromethyloxazole-4-carboxylic Aci...)
Show SMILES FC(F)(F)c1oc(nc1C(=O)Nc1ccc(nc1)N1CCN(CC1)C(=O)C1CC1)-c1ccccc1
Show InChI InChI=1S/C24H22F3N5O3/c25-24(26,27)20-19(30-22(35-20)15-4-2-1-3-5-15)21(33)29-17-8-9-18(28-14-17)31-10-12-32(13-11-31)23(34)16-6-7-16/h1-5,8-9,14,16H,6-7,10-13H2,(H,29,33)
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n/an/an/an/a 138n/an/an/an/a



Hoffmann-La Roche Inc.

Curated by ChEMBL


Assay Description
Inhibition of human DGAT1 expressed in CHO-K1 cells after 1 hr using palmitoyl-1-14C-coenzyme A by phospholipid flashplate assay


Citation and Details
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (human))
BDBM50341775
PNG
(2-Phenyl-5-trifluoromethyloxazole-4-carboxylic Aci...)
Show SMILES FC(F)(F)c1oc(nc1C(=O)Nc1ccc(cc1)N1CCN(CC1)C(=O)C1CC1)-c1ccccc1
Show InChI InChI=1S/C25H23F3N4O3/c26-25(27,28)21-20(30-23(35-21)16-4-2-1-3-5-16)22(33)29-18-8-10-19(11-9-18)31-12-14-32(15-13-31)24(34)17-6-7-17/h1-5,8-11,17H,6-7,12-15H2,(H,29,33)
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Hoffmann-La Roche Inc.

Curated by ChEMBL


Assay Description
Inhibition of human DGAT1 expressed in CHO-K1 cells after 1 hr using palmitoyl-1-14C-coenzyme A by phospholipid flashplate assay


Citation and Details
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (human))
BDBM50341774
PNG
(4-{4-[(2-Phenyl-5-trifluoromethyloxazole-4-carbony...)
Show SMILES COC(=O)N1CCN(CC1)c1ccc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cc1
Show InChI InChI=1S/C23H21F3N4O4/c1-33-22(32)30-13-11-29(12-14-30)17-9-7-16(8-10-17)27-20(31)18-19(23(24,25)26)34-21(28-18)15-5-3-2-4-6-15/h2-10H,11-14H2,1H3,(H,27,31)
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Hoffmann-La Roche Inc.

Curated by ChEMBL


Assay Description
Inhibition of human DGAT1 expressed in CHO-K1 cells after 1 hr using palmitoyl-1-14C-coenzyme A by phospholipid flashplate assay


Citation and Details
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (human))
BDBM50341768
PNG
(4-{5-[(2-Phenyl-5-trifluoromethyloxazole-4-carbony...)
Show SMILES COC(=O)N1CCN(CC1)c1ccc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cn1
Show InChI InChI=1S/C22H20F3N5O4/c1-33-21(32)30-11-9-29(10-12-30)16-8-7-15(13-26-16)27-19(31)17-18(22(23,24)25)34-20(28-17)14-5-3-2-4-6-14/h2-8,13H,9-12H2,1H3,(H,27,31)
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n/an/an/an/a 216n/an/an/an/a



Hoffmann-La Roche Inc.

Curated by ChEMBL


Assay Description
Inhibition of human DGAT1 expressed in CHO-K1 cells after 1 hr using palmitoyl-1-14C-coenzyme A by phospholipid flashplate assay


Citation and Details
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (human))
BDBM50341772
PNG
(5-[(2-Phenyl-5-trifluoromethyloxazole-4-carbonyl)a...)
Show SMILES COC(=O)N1CCC(CC1)c1ccc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cn1
Show InChI InChI=1S/C23H21F3N4O4/c1-33-22(32)30-11-9-14(10-12-30)17-8-7-16(13-27-17)28-20(31)18-19(23(24,25)26)34-21(29-18)15-5-3-2-4-6-15/h2-8,13-14H,9-12H2,1H3,(H,28,31)
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n/an/an/an/a 219n/an/an/an/a



Hoffmann-La Roche Inc.

Curated by ChEMBL


Assay Description
Inhibition of human DGAT1 expressed in CHO-K1 cells after 1 hr using palmitoyl-1-14C-coenzyme A by phospholipid flashplate assay


Citation and Details
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (human))
BDBM50341783
PNG
(4-(4-{4-[(2-Phenyl-5-trifluoromethyloxazole-4-carb...)
Show SMILES OC(=O)[C@H]1CC[C@H](CC1)C(=O)N1CCC(CC1)c1ccc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cc1
Show InChI InChI=1S/C30H30F3N3O5/c31-30(32,33)25-24(35-27(41-25)20-4-2-1-3-5-20)26(37)34-23-12-10-18(11-13-23)19-14-16-36(17-15-19)28(38)21-6-8-22(9-7-21)29(39)40/h1-5,10-13,19,21-22H,6-9,14-17H2,(H,34,37)(H,39,40)/t21-,22+
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n/an/an/an/a 220n/an/an/an/a



Hoffmann-La Roche Inc.

Curated by ChEMBL


Assay Description
Inhibition of human DGAT1 expressed in CHO-K1 cells after 1 hr using palmitoyl-1-14C-coenzyme A by phospholipid flashplate assay


Citation and Details
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (human))
BDBM50341764
PNG
(2-Phenyl-5-trifluoromethyloxazole-4-carboxylic Aci...)
Show SMILES CCOC1CN(C1)c1ccc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cn1
Show InChI InChI=1S/C21H19F3N4O3/c1-2-30-15-11-28(12-15)16-9-8-14(10-25-16)26-19(29)17-18(21(22,23)24)31-20(27-17)13-6-4-3-5-7-13/h3-10,15H,2,11-12H2,1H3,(H,26,29)
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n/an/an/an/a 228n/an/an/an/a



Hoffmann-La Roche Inc.

Curated by ChEMBL


Assay Description
Inhibition of human DGAT1 expressed in CHO-K1 cells after 1 hr using palmitoyl-1-14C-coenzyme A by phospholipid flashplate assay


Citation and Details
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (human))
BDBM50341776
PNG
(CHEMBL1766805 | N-(4-(1-(cyclopropanecarbonyl)pipe...)
Show SMILES FC(F)(F)c1oc(nc1C(=O)Nc1ccc(cc1)C1CCN(CC1)C(=O)C1CC1)-c1ccccc1
Show InChI InChI=1S/C26H24F3N3O3/c27-26(28,29)22-21(31-24(35-22)18-4-2-1-3-5-18)23(33)30-20-10-8-16(9-11-20)17-12-14-32(15-13-17)25(34)19-6-7-19/h1-5,8-11,17,19H,6-7,12-15H2,(H,30,33)
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n/an/an/an/a 362n/an/an/an/a



Hoffmann-La Roche Inc.

Curated by ChEMBL


Assay Description
Inhibition of human DGAT1 expressed in CHO-K1 cells after 1 hr using palmitoyl-1-14C-coenzyme A by phospholipid flashplate assay


Citation and Details
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (human))
BDBM50341781
PNG
(4-(4-{4-[(2-Phenyl-5-trifluoromethyloxazole-4-carb...)
Show SMILES OC(=O)[C@H]1CC[C@H](CC1)C(=O)N1CCN(CC1)c1ccc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cc1
Show InChI InChI=1S/C29H29F3N4O5/c30-29(31,32)24-23(34-26(41-24)18-4-2-1-3-5-18)25(37)33-21-10-12-22(13-11-21)35-14-16-36(17-15-35)27(38)19-6-8-20(9-7-19)28(39)40/h1-5,10-13,19-20H,6-9,14-17H2,(H,33,37)(H,39,40)/t19-,20+
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n/an/an/an/a 365n/an/an/an/a



Hoffmann-La Roche Inc.

Curated by ChEMBL


Assay Description
Inhibition of human DGAT1 expressed in CHO-K1 cells after 1 hr using palmitoyl-1-14C-coenzyme A by phospholipid flashplate assay


Citation and Details
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (human))
BDBM50341777
PNG
(4-{4-[(2-Phenyl-5-trifluoromethyloxazole-4-carbony...)
Show SMILES COC(=O)N1CCC(CC1)c1ccc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cc1
Show InChI InChI=1S/C24H22F3N3O4/c1-33-23(32)30-13-11-16(12-14-30)15-7-9-18(10-8-15)28-21(31)19-20(24(25,26)27)34-22(29-19)17-5-3-2-4-6-17/h2-10,16H,11-14H2,1H3,(H,28,31)
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Hoffmann-La Roche Inc.

Curated by ChEMBL


Assay Description
Inhibition of human DGAT1 expressed in CHO-K1 cells after 1 hr using palmitoyl-1-14C-coenzyme A by phospholipid flashplate assay


Citation and Details
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (human))
BDBM50341773
PNG
(2-Phenyl-5-trifluoromethyloxazole-4-carboxylic Aci...)
Show SMILES FC(F)(F)c1oc(nc1C(=O)Nc1ccc(nc1)C1CCN(CC1)C(=O)C1CC1)-c1ccccc1
Show InChI InChI=1S/C25H23F3N4O3/c26-25(27,28)21-20(31-23(35-21)16-4-2-1-3-5-16)22(33)30-18-8-9-19(29-14-18)15-10-12-32(13-11-15)24(34)17-6-7-17/h1-5,8-9,14-15,17H,6-7,10-13H2,(H,30,33)
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n/an/an/an/a 378n/an/an/an/a



Hoffmann-La Roche Inc.

Curated by ChEMBL


Assay Description
Inhibition of human DGAT1 expressed in CHO-K1 cells after 1 hr using palmitoyl-1-14C-coenzyme A by phospholipid flashplate assay


Citation and Details
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (human))
BDBM50341771
PNG
(4-{5-[(2-Phenyl-5-trifluoromethyloxazole-4-carbony...)
Show SMILES COC(=O)N1CCN(CC1)c1ncc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cn1
Show InChI InChI=1S/C21H19F3N6O4/c1-33-20(32)30-9-7-29(8-10-30)19-25-11-14(12-26-19)27-17(31)15-16(21(22,23)24)34-18(28-15)13-5-3-2-4-6-13/h2-6,11-12H,7-10H2,1H3,(H,27,31)
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n/an/an/an/a 410n/an/an/an/a



Hoffmann-La Roche Inc.

Curated by ChEMBL


Assay Description
Inhibition of human DGAT1 expressed in CHO-K1 cells after 1 hr using palmitoyl-1-14C-coenzyme A by phospholipid flashplate assay


Citation and Details
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (human))
BDBM50358333
PNG
(CHEMBL1922682)
Show SMILES FC(F)(F)c1oc(cc1C(=O)Nc1ccc(nc1)N1CCOCC1)-c1ccccc1
Show InChI InChI=1S/C21H18F3N3O3/c22-21(23,24)19-16(12-17(30-19)14-4-2-1-3-5-14)20(28)26-15-6-7-18(25-13-15)27-8-10-29-11-9-27/h1-7,12-13H,8-11H2,(H,26,28)
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n/an/an/an/a 490n/an/an/an/a



Roche Research Center

Curated by ChEMBL


Assay Description
Inhibition of human DGAT1 expressed in CHOK1 cells using 14C palmitic acid as substrate after 1 hr by TLC analysis


Citation and Details
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (human))
BDBM50341782
PNG
(4-(4-{4-[(2-Phenyl-5-trifluoromethyloxazole-4-carb...)
Show SMILES OC(=O)[C@H]1CC[C@@H](CC1)C(=O)N1CCC(CC1)c1ccc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cc1
Show InChI InChI=1S/C30H30F3N3O5/c31-30(32,33)25-24(35-27(41-25)20-4-2-1-3-5-20)26(37)34-23-12-10-18(11-13-23)19-14-16-36(17-15-19)28(38)21-6-8-22(9-7-21)29(39)40/h1-5,10-13,19,21-22H,6-9,14-17H2,(H,34,37)(H,39,40)/t21-,22-
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Hoffmann-La Roche Inc.

Curated by ChEMBL


Assay Description
Inhibition of human DGAT1 expressed in CHO-K1 cells after 1 hr using palmitoyl-1-14C-coenzyme A by phospholipid flashplate assay


Citation and Details
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (human))
BDBM50341763
PNG
(2-Phenyl-5-trifluoromethyloxazole-4-carboxylic Aci...)
Show SMILES COCCN(C)c1ncc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cn1
Show InChI InChI=1S/C19H18F3N5O3/c1-27(8-9-29-2)18-23-10-13(11-24-18)25-16(28)14-15(19(20,21)22)30-17(26-14)12-6-4-3-5-7-12/h3-7,10-11H,8-9H2,1-2H3,(H,25,28)
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Hoffmann-La Roche Inc.

Curated by ChEMBL


Assay Description
Inhibition of human DGAT1 expressed in CHO-K1 cells after 1 hr using palmitoyl-1-14C-coenzyme A by phospholipid flashplate assay


Citation and Details
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (human))
BDBM50341760
PNG
(2-Phenyl-5-trifluoromethyloxazole-4-carboxylic Aci...)
Show SMILES COCCN(C)c1ccc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cn1
Show InChI InChI=1S/C20H19F3N4O3/c1-27(10-11-29-2)15-9-8-14(12-24-15)25-18(28)16-17(20(21,22)23)30-19(26-16)13-6-4-3-5-7-13/h3-9,12H,10-11H2,1-2H3,(H,25,28)
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Roche Research Center

Curated by ChEMBL


Assay Description
Inhibition of human DGAT1 expressed in CHOK1 cells using 14C palmitic acid as substrate after 1 hr by TLC analysis


Citation and Details
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (human))
BDBM50341760
PNG
(2-Phenyl-5-trifluoromethyloxazole-4-carboxylic Aci...)
Show SMILES COCCN(C)c1ccc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cn1
Show InChI InChI=1S/C20H19F3N4O3/c1-27(10-11-29-2)15-9-8-14(12-24-15)25-18(28)16-17(20(21,22)23)30-19(26-16)13-6-4-3-5-7-13/h3-9,12H,10-11H2,1-2H3,(H,25,28)
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Hoffmann-La Roche Inc.

Curated by ChEMBL


Assay Description
Inhibition of human DGAT1 expressed in CHO-K1 cells after 1 hr using [14C]palmitic acid by TLC analysis


Citation and Details
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (human))
BDBM50341760
PNG
(2-Phenyl-5-trifluoromethyloxazole-4-carboxylic Aci...)
Show SMILES COCCN(C)c1ccc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cn1
Show InChI InChI=1S/C20H19F3N4O3/c1-27(10-11-29-2)15-9-8-14(12-24-15)25-18(28)16-17(20(21,22)23)30-19(26-16)13-6-4-3-5-7-13/h3-9,12H,10-11H2,1-2H3,(H,25,28)
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Hoffmann-La Roche Inc.

Curated by ChEMBL


Assay Description
Inhibition of human DGAT1 expressed in CHO-K1 cells after 1 hr using palmitoyl-1-14C-coenzyme A by phospholipid flashplate assay


Citation and Details
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (human))
BDBM50358328
PNG
(CHEMBL1922677)
Show SMILES FC(F)(F)c1oc(nc1C(=O)Nc1ccc(nc1)N1CCOCC1)-c1ccccc1
Show InChI InChI=1S/C20H17F3N4O3/c21-20(22,23)17-16(26-19(30-17)13-4-2-1-3-5-13)18(28)25-14-6-7-15(24-12-14)27-8-10-29-11-9-27/h1-7,12H,8-11H2,(H,25,28)
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n/an/an/an/a 840n/an/an/an/a



Roche Research Center

Curated by ChEMBL


Assay Description
Inhibition of human DGAT1 expressed in CHOK1 cells using 14C palmitic acid as substrate after 1 hr by TLC analysis


Citation and Details
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (human))
BDBM50358337
PNG
(CHEMBL1922686)
Show SMILES CCN(CC)c1ccc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cn1
Show InChI InChI=1S/C20H19F3N4O2/c1-3-27(4-2)15-11-10-14(12-24-15)25-18(28)16-17(20(21,22)23)29-19(26-16)13-8-6-5-7-9-13/h5-12H,3-4H2,1-2H3,(H,25,28)
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n/an/an/an/a 910n/an/an/an/a



Roche Research Center

Curated by ChEMBL


Assay Description
Inhibition of human DGAT1 expressed in CHOK1 cells using 14C palmitic acid as substrate after 1 hr by TLC analysis


Citation and Details
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (human))
BDBM50341779
PNG
(4-(4-{4-[(2-Phenyl-5-trifluoromethyloxazole-4-carb...)
Show SMILES OC(=O)[C@H]1CC[C@@H](CC1)C(=O)N1CCN(CC1)c1ccc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cc1
Show InChI InChI=1S/C29H29F3N4O5/c30-29(31,32)24-23(34-26(41-24)18-4-2-1-3-5-18)25(37)33-21-10-12-22(13-11-21)35-14-16-36(17-15-35)27(38)19-6-8-20(9-7-19)28(39)40/h1-5,10-13,19-20H,6-9,14-17H2,(H,33,37)(H,39,40)/t19-,20-
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n/an/an/an/a 1.07E+3n/an/an/an/a



Hoffmann-La Roche Inc.

Curated by ChEMBL


Assay Description
Inhibition of human DGAT1 expressed in CHO-K1 cells after 1 hr using palmitoyl-1-14C-coenzyme A by phospholipid flashplate assay


Citation and Details
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (human))
BDBM27947
PNG
(2-[4-(4-{4-amino-7,7-dimethyl-7H-pyrimido[4,5-b][1...)
Show SMILES CC1(C)Oc2ncnc(N)c2N=C1c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1
Show InChI InChI=1S/C22H26N4O3/c1-22(2)19(26-18-20(23)24-12-25-21(18)29-22)16-9-7-15(8-10-16)14-5-3-13(4-6-14)11-17(27)28/h7-10,12-14H,3-6,11H2,1-2H3,(H,27,28)(H2,23,24,25)/t13-,14-
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n/an/an/an/a 1.44E+3n/an/an/an/a



Hoffmann-La Roche Inc.

Curated by ChEMBL


Assay Description
Inhibition of human DGAT1 expressed in CHO-K1 cells after 1 hr using palmitoyl-1-14C-coenzyme A by phospholipid flashplate assay


Citation and Details
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (human))
BDBM50358329
PNG
(CHEMBL1922678)
Show SMILES FC(F)(F)c1oc(nc1C(=O)Nc1cnc(nc1)N1CCOCC1)-c1ccccc1
Show InChI InChI=1S/C19H16F3N5O3/c20-19(21,22)15-14(26-17(30-15)12-4-2-1-3-5-12)16(28)25-13-10-23-18(24-11-13)27-6-8-29-9-7-27/h1-5,10-11H,6-9H2,(H,25,28)
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n/an/an/an/a 1.50E+3n/an/an/an/a



Roche Research Center

Curated by ChEMBL


Assay Description
Inhibition of human DGAT1 expressed in CHOK1 cells using 14C palmitic acid as substrate after 1 hr by TLC analysis


Citation and Details
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (human))
BDBM50341778
PNG
(4-(4-{5-[(2-Phenyl-5-trifluoromethyloxazole-4-carb...)
Show SMILES OC(=O)[C@H]1CC[C@@H](CC1)C(=O)N1CCN(CC1)c1ccc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cn1
Show InChI InChI=1S/C28H28F3N5O5/c29-28(30,31)23-22(34-25(41-23)17-4-2-1-3-5-17)24(37)33-20-10-11-21(32-16-20)35-12-14-36(15-13-35)26(38)18-6-8-19(9-7-18)27(39)40/h1-5,10-11,16,18-19H,6-9,12-15H2,(H,33,37)(H,39,40)/t18-,19-
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n/an/an/an/a 1.76E+3n/an/an/an/a



Hoffmann-La Roche Inc.

Curated by ChEMBL


Assay Description
Inhibition of human DGAT1 expressed in CHO-K1 cells after 1 hr using palmitoyl-1-14C-coenzyme A by phospholipid flashplate assay


Citation and Details
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (human))
BDBM50341762
PNG
(2-Phenyl-5-trifluoromethyloxazole-4-carboxylic Aci...)
Show SMILES COCCN(C)c1ccc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cc1
Show InChI InChI=1S/C21H20F3N3O3/c1-27(12-13-29-2)16-10-8-15(9-11-16)25-19(28)17-18(21(22,23)24)30-20(26-17)14-6-4-3-5-7-14/h3-11H,12-13H2,1-2H3,(H,25,28)
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n/an/an/an/a 1.80E+3n/an/an/an/a



Hoffmann-La Roche Inc.

Curated by ChEMBL


Assay Description
Inhibition of human DGAT1 expressed in CHO-K1 cells after 1 hr using palmitoyl-1-14C-coenzyme A by phospholipid flashplate assay


Citation and Details
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (human))
BDBM50341780
PNG
(4-{5-[(2-Phenyl-5-trifluoromethyloxazole-4-carbony...)
Show SMILES OC(=O)[C@H]1CC[C@@H](CC1)C(=O)N1CCC(CC1)c1ccc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cn1
Show InChI InChI=1S/C29H29F3N4O5/c30-29(31,32)24-23(35-26(41-24)18-4-2-1-3-5-18)25(37)34-21-10-11-22(33-16-21)17-12-14-36(15-13-17)27(38)19-6-8-20(9-7-19)28(39)40/h1-5,10-11,16-17,19-20H,6-9,12-15H2,(H,34,37)(H,39,40)/t19-,20-
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n/an/an/an/a 2.36E+3n/an/an/an/a



Hoffmann-La Roche Inc.

Curated by ChEMBL


Assay Description
Inhibition of human DGAT1 expressed in CHO-K1 cells after 1 hr using palmitoyl-1-14C-coenzyme A by phospholipid flashplate assay


Citation and Details
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (human))
BDBM50358323
PNG
(CHEMBL1922582)
Show SMILES CCCn1[nH]c(=O)c2cc(NC(=O)c3nc(oc3C(F)(F)F)-c3ccccc3)ccc12
Show InChI InChI=1S/C21H17F3N4O3/c1-2-10-28-15-9-8-13(11-14(15)18(29)27-28)25-19(30)16-17(21(22,23)24)31-20(26-16)12-6-4-3-5-7-12/h3-9,11H,2,10H2,1H3,(H,25,30)(H,27,29)
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n/an/an/an/a 2.50E+3n/an/an/an/a



Roche Research Center

Curated by ChEMBL


Assay Description
Inhibition of human DGAT1 expressed in CHOK1 cells using 14C palmitic acid as substrate after 1 hr by TLC analysis


Citation and Details
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (human))
BDBM50358327
PNG
(CHEMBL1922676)
Show SMILES FC(F)(F)c1oc(nc1C(=O)Nc1ccc(cc1)N1CCOCC1)-c1ccccc1
Show InChI InChI=1S/C21H18F3N3O3/c22-21(23,24)18-17(26-20(30-18)14-4-2-1-3-5-14)19(28)25-15-6-8-16(9-7-15)27-10-12-29-13-11-27/h1-9H,10-13H2,(H,25,28)
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n/an/an/an/a 2.70E+3n/an/an/an/a



Roche Research Center

Curated by ChEMBL


Assay Description
Inhibition of human DGAT1 expressed in CHOK1 cells using 14C palmitic acid as substrate after 1 hr by TLC analysis


Citation and Details
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (human))
BDBM50358331
PNG
(CHEMBL1922680)
Show SMILES Clc1oc(nc1C(=O)Nc1ccc(nc1)N1CCOCC1)-c1ccccc1
Show InChI InChI=1S/C19H17ClN4O3/c20-17-16(23-19(27-17)13-4-2-1-3-5-13)18(25)22-14-6-7-15(21-12-14)24-8-10-26-11-9-24/h1-7,12H,8-11H2,(H,22,25)
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n/an/an/an/a 2.99E+3n/an/an/an/a



Roche Research Center

Curated by ChEMBL


Assay Description
Inhibition of human DGAT1 expressed in CHOK1 cells using 14C palmitic acid as substrate after 1 hr by TLC analysis


Citation and Details
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (human))
BDBM50358332
PNG
(CHEMBL1922681)
Show SMILES CCc1oc(nc1C(=O)Nc1ccc(nc1)N1CCOCC1)-c1ccccc1
Show InChI InChI=1S/C21H22N4O3/c1-2-17-19(24-21(28-17)15-6-4-3-5-7-15)20(26)23-16-8-9-18(22-14-16)25-10-12-27-13-11-25/h3-9,14H,2,10-13H2,1H3,(H,23,26)
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n/an/an/an/a 3.42E+3n/an/an/an/a



Roche Research Center

Curated by ChEMBL


Assay Description
Inhibition of human DGAT1 expressed in CHOK1 cells using 14C palmitic acid as substrate after 1 hr by TLC analysis


Citation and Details
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (human))
BDBM50358330
PNG
(CHEMBL1922679)
Show SMILES FC(F)(F)c1oc(nc1C(=O)Nc1cnc(s1)N1CCOCC1)-c1ccccc1
Show InChI InChI=1S/C18H15F3N4O3S/c19-18(20,21)14-13(24-16(28-14)11-4-2-1-3-5-11)15(26)23-12-10-22-17(29-12)25-6-8-27-9-7-25/h1-5,10H,6-9H2,(H,23,26)
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n/an/an/an/a 3.70E+3n/an/an/an/a



Roche Research Center

Curated by ChEMBL


Assay Description
Inhibition of human DGAT1 expressed in CHOK1 cells using 14C palmitic acid as substrate after 1 hr by TLC analysis


Citation and Details
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (human))
BDBM50341765
PNG
((S)-2-Phenyl-5-trifluoromethyloxazole-4-carboxylic...)
Show SMILES O[C@H]1CCN(C1)c1ncc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cn1
Show InChI InChI=1S/C19H16F3N5O3/c20-19(21,22)15-14(26-17(30-15)11-4-2-1-3-5-11)16(29)25-12-8-23-18(24-9-12)27-7-6-13(28)10-27/h1-5,8-9,13,28H,6-7,10H2,(H,25,29)/t13-/m0/s1
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n/an/an/an/a 5.66E+3n/an/an/an/a



Hoffmann-La Roche Inc.

Curated by ChEMBL


Assay Description
Inhibition of human DGAT1 expressed in CHO-K1 cells after 1 hr using palmitoyl-1-14C-coenzyme A by phospholipid flashplate assay


Citation and Details
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (human))
BDBM50358335
PNG
(CHEMBL1922684)
Show SMILES Cc1nc(oc1C(=O)Nc1ccc(nc1)N1CCOCC1)-c1ccccc1
Show InChI InChI=1S/C20H20N4O3/c1-14-18(27-20(22-14)15-5-3-2-4-6-15)19(25)23-16-7-8-17(21-13-16)24-9-11-26-12-10-24/h2-8,13H,9-12H2,1H3,(H,23,25)
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n/an/an/an/a 7.46E+3n/an/an/an/a



Roche Research Center

Curated by ChEMBL


Assay Description
Inhibition of human DGAT1 expressed in CHOK1 cells using 14C palmitic acid as substrate after 1 hr by TLC analysis


Citation and Details
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (human))
BDBM50358339
PNG
(CHEMBL1922688)
Show SMILES CN(CCO)c1ccc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cn1
Show InChI InChI=1S/C19H17F3N4O3/c1-26(9-10-27)14-8-7-13(11-23-14)24-17(28)15-16(19(20,21)22)29-18(25-15)12-5-3-2-4-6-12/h2-8,11,27H,9-10H2,1H3,(H,24,28)
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n/an/an/an/a 8.09E+3n/an/an/an/a



Roche Research Center

Curated by ChEMBL


Assay Description
Inhibition of human DGAT1 expressed in CHOK1 cells using 14C palmitic acid as substrate after 1 hr by TLC analysis


Citation and Details
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (human))
BDBM50358340
PNG
(CHEMBL1922689)
Show SMILES CCN(CCOC)c1ccc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cn1
Show InChI InChI=1S/C21H21F3N4O3/c1-3-28(11-12-30-2)16-10-9-15(13-25-16)26-19(29)17-18(21(22,23)24)31-20(27-17)14-7-5-4-6-8-14/h4-10,13H,3,11-12H2,1-2H3,(H,26,29)
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n/an/an/an/a 8.90E+3n/an/an/an/a



Roche Research Center

Curated by ChEMBL


Assay Description
Inhibition of human DGAT1 expressed in CHOK1 cells using 14C palmitic acid as substrate after 1 hr by TLC analysis


Citation and Details
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (human))
BDBM50358338
PNG
(CHEMBL1922687)
Show SMILES COCCNc1ccc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cn1
Show InChI InChI=1S/C19H17F3N4O3/c1-28-10-9-23-14-8-7-13(11-24-14)25-17(27)15-16(19(20,21)22)29-18(26-15)12-5-3-2-4-6-12/h2-8,11H,9-10H2,1H3,(H,23,24)(H,25,27)
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n/an/an/an/a 1.11E+4n/an/an/an/a



Roche Research Center

Curated by ChEMBL


Assay Description
Inhibition of human DGAT1 expressed in CHOK1 cells using 14C palmitic acid as substrate after 1 hr by TLC analysis


Citation and Details
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (human))
BDBM50358334
PNG
(CHEMBL1922683)
Show SMILES Cc1nc(sc1C(=O)Nc1ccc(nc1)N1CCOCC1)-c1ccccc1
Show InChI InChI=1S/C20H20N4O2S/c1-14-18(27-20(22-14)15-5-3-2-4-6-15)19(25)23-16-7-8-17(21-13-16)24-9-11-26-12-10-24/h2-8,13H,9-12H2,1H3,(H,23,25)
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n/an/an/an/a 1.18E+4n/an/an/an/a



Roche Research Center

Curated by ChEMBL


Assay Description
Inhibition of human DGAT1 expressed in CHOK1 cells using 14C palmitic acid as substrate after 1 hr by TLC analysis


Citation and Details
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (human))
BDBM50341759
PNG
(2-Methyl-5-trifluoromethyloxazole-4-carboxylic Aci...)
Show SMILES COCCN(C)c1ccc(NC(=O)c2nc(C)oc2C(F)(F)F)cn1
Show InChI InChI=1S/C15H17F3N4O3/c1-9-20-12(13(25-9)15(16,17)18)14(23)21-10-4-5-11(19-8-10)22(2)6-7-24-3/h4-5,8H,6-7H2,1-3H3,(H,21,23)
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n/an/an/an/a>2.50E+4n/an/an/an/a



Hoffmann-La Roche Inc.

Curated by ChEMBL


Assay Description
Inhibition of human DGAT1 expressed in CHO-K1 cells after 1 hr using palmitoyl-1-14C-coenzyme A by phospholipid flashplate assay


Citation and Details
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (human))
BDBM50341766
PNG
(2-Phenyl-5-trifluoromethyloxazole-4-carboxylic Aci...)
Show SMILES FC(F)(F)c1oc(nc1C(=O)Nc1ccc(nc1)N1CC(F)(F)C1)-c1ccccc1
Show InChI InChI=1S/C19H13F5N4O2/c20-18(21)9-28(10-18)13-7-6-12(8-25-13)26-16(29)14-15(19(22,23)24)30-17(27-14)11-4-2-1-3-5-11/h1-8H,9-10H2,(H,26,29)
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n/an/an/an/a 2.50E+4n/an/an/an/a



Hoffmann-La Roche Inc.

Curated by ChEMBL


Assay Description
Inhibition of human DGAT1 expressed in CHO-K1 cells after 1 hr using palmitoyl-1-14C-coenzyme A by phospholipid flashplate assay


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More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (human))
BDBM50358341
PNG
(CHEMBL1922690)
Show SMILES COCC(=O)N(C)c1ccc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cn1
Show InChI InChI=1S/C20H17F3N4O4/c1-27(15(28)11-30-2)14-9-8-13(10-24-14)25-18(29)16-17(20(21,22)23)31-19(26-16)12-6-4-3-5-7-12/h3-10H,11H2,1-2H3,(H,25,29)
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n/an/an/an/a>2.50E+4n/an/an/an/a



Roche Research Center

Curated by ChEMBL


Assay Description
Inhibition of human DGAT1 expressed in CHOK1 cells using 14C palmitic acid as substrate after 1 hr by TLC analysis


Citation and Details
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (human))
BDBM50341767
PNG
((1-{5-[(2-Phenyl-5-trifluoromethyloxazole-4-carbon...)
Show SMILES OC(=O)COC1CN(C1)c1ccc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cn1
Show InChI InChI=1S/C21H17F3N4O5/c22-21(23,24)18-17(27-20(33-18)12-4-2-1-3-5-12)19(31)26-13-6-7-15(25-8-13)28-9-14(10-28)32-11-16(29)30/h1-8,14H,9-11H2,(H,26,31)(H,29,30)
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Hoffmann-La Roche Inc.

Curated by ChEMBL


Assay Description
Inhibition of human DGAT1 expressed in CHO-K1 cells after 1 hr using palmitoyl-1-14C-coenzyme A by phospholipid flashplate assay


Citation and Details
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (human))
BDBM50341761
PNG
(2-Phenyl-5-trifluoromethyloxazole-4-carboxylic Aci...)
Show SMILES COCCN(C)c1ccc(cn1)N(C)C(=O)c1nc(oc1C(F)(F)F)-c1ccccc1
Show InChI InChI=1S/C21H21F3N4O3/c1-27(11-12-30-3)16-10-9-15(13-25-16)28(2)20(29)17-18(21(22,23)24)31-19(26-17)14-7-5-4-6-8-14/h4-10,13H,11-12H2,1-3H3
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n/an/an/an/a>2.50E+4n/an/an/an/a



Hoffmann-La Roche Inc.

Curated by ChEMBL


Assay Description
Inhibition of human DGAT1 expressed in CHO-K1 cells after 1 hr using palmitoyl-1-14C-coenzyme A by phospholipid flashplate assay


Citation and Details
More data for this
Ligand-Target Pair