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Patent code US9701672

Compile Data Set for Download or QSAR
Found 77 hits of Enzyme Inhibition Constant Data   
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
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM253625
PNG
(US9701672, 56)
Show SMILES FC(F)(F)CCCOc1ccc(c(Cl)c1)[C@@]1(CC(c2ccc(s2)C2CC2)=C(c2nnn[nH]2)C(=O)N1)C(F)(F)F
Show InChI InChI=1S/C24H20ClF6N5O2S/c25-16-10-13(38-9-1-8-23(26,27)28)4-5-15(16)22(24(29,30)31)11-14(18-7-6-17(39-18)12-2-3-12)19(21(37)32-22)20-33-35-36-34-20/h4-7,10,12H,1-3,8-9,11H2,(H,32,37)(H,33,34,35,36)/t22-/m0/s1
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Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM253635
PNG
(US9701672, 66)
Show SMILES CCc1cnc(s1)C1=C(c2nnn[nH]2)C(=O)N[C@@](C1)(c1ccc(OCCCCCC(F)(F)F)cc1F)C(F)(F)F
Show InChI InChI=1S/C24H23F7N6O2S/c1-2-14-12-32-21(40-14)15-11-22(24(29,30)31,33-20(38)18(15)19-34-36-37-35-19)16-7-6-13(10-17(16)25)39-9-5-3-4-8-23(26,27)28/h6-7,10,12H,2-5,8-9,11H2,1H3,(H,33,38)(H,34,35,36,37)/t22-/m0/s1
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Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM253632
PNG
(US9701672, 63)
Show SMILES FC(F)(F)CCCCCOc1ccc(c(Cl)c1)[C@@]1(CC(c2ncc(s2)C2CC2)=C(c2nnn[nH]2)C(=O)N1)C(F)(F)F
Show InChI InChI=1S/C25H23ClF6N6O2S/c26-17-10-14(40-9-3-1-2-8-24(27,28)29)6-7-16(17)23(25(30,31)32)11-15(22-33-12-18(41-22)13-4-5-13)19(21(39)34-23)20-35-37-38-36-20/h6-7,10,12-13H,1-5,8-9,11H2,(H,34,39)(H,35,36,37,38)/t23-/m0/s1
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Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM247150
PNG
((S,E)-2-Methyl-N-(2,2,2-trifluoro-1-(4-((5,5,5-tri...)
Show SMILES Fc1cc(OCCCC(F)(F)F)ccc1[C@@]1(CC(c2ccc(s2)C2CC2)=C(c2nnn[nH]2)C(=O)N1)C(F)(F)F
Show InChI InChI=1S/C24H20F7N5O2S/c25-16-10-13(38-9-1-8-23(26,27)28)4-5-15(16)22(24(29,30)31)11-14(18-7-6-17(39-18)12-2-3-12)19(21(37)32-22)20-33-35-36-34-20/h4-7,10,12H,1-3,8-9,11H2,(H,32,37)(H,33,34,35,36)/t22-/m0/s1
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Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM253633
PNG
(US9701672, 64)
Show SMILES FC(F)(F)CCCOc1ccc(c(Cl)c1)[C@@]1(CC(c2ncc(s2)C2CC2)=C(c2nnn[nH]2)C(=O)N1)C(F)(F)F
Show InChI InChI=1S/C23H19ClF6N6O2S/c24-15-8-12(38-7-1-6-22(25,26)27)4-5-14(15)21(23(28,29)30)9-13(20-31-10-16(39-20)11-2-3-11)17(19(37)32-21)18-33-35-36-34-18/h4-5,8,10-11H,1-3,6-7,9H2,(H,32,37)(H,33,34,35,36)/t21-/m0/s1
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Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM247150
PNG
((S,E)-2-Methyl-N-(2,2,2-trifluoro-1-(4-((5,5,5-tri...)
Show SMILES Fc1cc(OCCCC(F)(F)F)ccc1[C@@]1(CC(c2ccc(s2)C2CC2)=C(c2nnn[nH]2)C(=O)N1)C(F)(F)F
Show InChI InChI=1S/C24H20F7N5O2S/c25-16-10-13(38-9-1-8-23(26,27)28)4-5-15(16)22(24(29,30)31)11-14(18-7-6-17(39-18)12-2-3-12)19(21(37)32-22)20-33-35-36-34-20/h4-7,10,12H,1-3,8-9,11H2,(H,32,37)(H,33,34,35,36)/t22-/m0/s1
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Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM247168
PNG
(1-(5-Cyclopropylthiazol-2-yl)ethanone | US9701672,...)
Show SMILES FC(F)(F)CCCCc1ccc(cc1)[C@@]1(CC(c2ccn(CC3CC3)n2)=C(c2nnn[nH]2)C(=O)N1)C(F)(F)F
Show InChI InChI=1S/C25H25F6N7O/c26-24(27,28)11-2-1-3-15-6-8-17(9-7-15)23(25(29,30)31)13-18(19-10-12-38(35-19)14-16-4-5-16)20(22(39)32-23)21-33-36-37-34-21/h6-10,12,16H,1-5,11,13-14H2,(H,32,39)(H,33,34,36,37)/t23-/m0/s1
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US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM253628
PNG
(US9701672, 59)
Show SMILES Fc1cc(OCCCC(F)(F)F)ccc1[C@@]1(CC(c2ncc(s2)C2CC2)=C(c2nnn[nH]2)C(=O)N1)C(F)(F)F
Show InChI InChI=1S/C23H19F7N6O2S/c24-15-8-12(38-7-1-6-22(25,26)27)4-5-14(15)21(23(28,29)30)9-13(20-31-10-16(39-20)11-2-3-11)17(19(37)32-21)18-33-35-36-34-18/h4-5,8,10-11H,1-3,6-7,9H2,(H,32,37)(H,33,34,35,36)/t21-/m0/s1
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Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM253626
PNG
(US9701672, 57)
Show SMILES COc1cc(OCCCC(F)(F)F)ccc1[C@@]1(CC(c2ccc(s2)C2CC2)=C(c2nnn[nH]2)C(=O)N1)C(F)(F)F
Show InChI InChI=1S/C25H23F6N5O3S/c1-38-17-11-14(39-10-2-9-24(26,27)28)5-6-16(17)23(25(29,30)31)12-15(19-8-7-18(40-19)13-3-4-13)20(22(37)32-23)21-33-35-36-34-21/h5-8,11,13H,2-4,9-10,12H2,1H3,(H,32,37)(H,33,34,35,36)/t23-/m0/s1
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Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM247154
PNG
(1-(5-Methylthiazol-2-yl)ethanone | US9701672, 8)
Show SMILES FC(F)(F)CCCCCOc1ccc(cc1)[C@@]1(CC(c2ccc(s2)C2CC2)=C(c2nnn[nH]2)C(=O)N1)C(F)(F)F
Show InChI InChI=1S/C26H25F6N5O2S/c27-25(28,29)12-2-1-3-13-39-17-8-6-16(7-9-17)24(26(30,31)32)14-18(20-11-10-19(40-20)15-4-5-15)21(23(38)33-24)22-34-36-37-35-22/h6-11,15H,1-5,12-14H2,(H,33,38)(H,34,35,36,37)/t24-/m0/s1
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Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM253649
PNG
((S)—N-(4-(5-Ethylthiophen-2-yl)-2-oxo-6-(4-((...)
Show SMILES CCc1ccc(s1)C1=C(NC(=O)CS(C)(=O)=O)C(=O)N[C@@](C1)(c1ccc(OCCCCCC(F)(F)F)cc1)C(F)(F)F
Show InChI InChI=1S/C27H30F6N2O5S2/c1-3-19-11-12-21(41-19)20-15-25(27(31,32)33,35-24(37)23(20)34-22(36)16-42(2,38)39)17-7-9-18(10-8-17)40-14-6-4-5-13-26(28,29)30/h7-12H,3-6,13-16H2,1-2H3,(H,34,36)(H,35,37)/t25-/m0/s1
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Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM247169
PNG
(1-(5-Ethylthiazol-2-yl)ethanone | US9701672, 23)
Show SMILES CC(C)n1ccc(n1)C1=C(c2nnn[nH]2)C(=O)N[C@@](C1)(c1ccc(CCCCC(F)(F)F)cc1)C(F)(F)F
Show InChI InChI=1S/C24H25F6N7O/c1-14(2)37-12-10-18(34-37)17-13-22(24(28,29)30,31-21(38)19(17)20-32-35-36-33-20)16-8-6-15(7-9-16)5-3-4-11-23(25,26)27/h6-10,12,14H,3-5,11,13H2,1-2H3,(H,31,38)(H,32,33,35,36)/t22-/m0/s1
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Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM253631
PNG
(US9701672, 62)
Show SMILES CCc1cnc(s1)C1=C(c2nnn[nH]2)C(=O)N[C@@](C1)(c1ccc(OCCCC(F)(F)F)cc1F)C(F)(F)F
Show InChI InChI=1S/C22H19F7N6O2S/c1-2-12-10-30-19(38-12)13-9-20(22(27,28)29,31-18(36)16(13)17-32-34-35-33-17)14-5-4-11(8-15(14)23)37-7-3-6-21(24,25)26/h4-5,8,10H,2-3,6-7,9H2,1H3,(H,31,36)(H,32,33,34,35)/t20-/m0/s1
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Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM247152
PNG
(1-(5-Cyclopropylthiophen-2-yl)ethanone | US9701672...)
Show SMILES CCCCCCC#C[C@@]1(CC(c2ccc(Br)s2)=C(c2nnn[nH]2)C(=O)N1)C(F)(F)F
Show InChI InChI=1S/C19H19BrF3N5OS/c1-2-3-4-5-6-7-10-18(19(21,22)23)11-12(13-8-9-14(20)30-13)15(17(29)24-18)16-25-27-28-26-16/h8-9H,2-6,11H2,1H3,(H,24,29)(H,25,26,27,28)/t18-/m1/s1
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Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM253627
PNG
(US9701672, 58)
Show SMILES CCc1ccc(s1)C1=C(c2nnn[nH]2)C(=O)N[C@@](C1)(c1ccc(OCCCCCC(F)(F)F)cc1)C(F)(F)F
Show InChI InChI=1S/C25H25F6N5O2S/c1-2-17-10-11-19(39-17)18-14-23(25(29,30)31,32-22(37)20(18)21-33-35-36-34-21)15-6-8-16(9-7-15)38-13-5-3-4-12-24(26,27)28/h6-11H,2-5,12-14H2,1H3,(H,32,37)(H,33,34,35,36)/t23-/m0/s1
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Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM247056
PNG
((S,E)-2-Methyl-N-(2,2,2-trifluoro-1-(4-(4,4,4-trif...)
Show SMILES CC(C)(C)[S@](=O)\N=C(/c1ccc(OCCCC(F)(F)F)cc1)C(F)(F)F
Show InChI InChI=1S/C16H19F6NO2S/c1-14(2,3)26(24)23-13(16(20,21)22)11-5-7-12(8-6-11)25-10-4-9-15(17,18)19/h5-8H,4,9-10H2,1-3H3/b23-13+/t26-/m0/s1
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Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM249008
PNG
(US9701672, 30)
Show SMILES FC(F)(F)CCCCCOc1ccc(cc1)[C@@]1(CC(c2ccn(CC3CC3)n2)=C(c2nnn[nH]2)C(=O)N1)C(F)(F)F
Show InChI InChI=1S/C26H27F6N7O2/c27-25(28,29)11-2-1-3-13-41-18-8-6-17(7-9-18)24(26(30,31)32)14-19(20-10-12-39(36-20)15-16-4-5-16)21(23(40)33-24)22-34-37-38-35-22/h6-10,12,16H,1-5,11,13-15H2,(H,33,40)(H,34,35,37,38)/t24-/m0/s1
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Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM252410
PNG
(US9701672, 47)
Show SMILES Fc1cc(CCCCC(F)(F)F)ccc1[C@@]1(CC(c2ccn(n2)C2CCC2)=C(c2nnn[nH]2)C(=O)N1)C(F)(F)F
Show InChI InChI=1S/C25H24F7N7O/c26-18-12-14(4-1-2-10-24(27,28)29)7-8-17(18)23(25(30,31)32)13-16(19-9-11-39(36-19)15-5-3-6-15)20(22(40)33-23)21-34-37-38-35-21/h7-9,11-12,15H,1-6,10,13H2,(H,33,40)(H,34,35,37,38)/t23-/m0/s1
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Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM249861
PNG
(US9701672, 42)
Show SMILES Fc1cc(CCCCC(F)(F)F)ccc1[C@@]1(CC(c2ccn(CC3CC3)n2)=C(c2nnn[nH]2)C(=O)N1)C(F)(F)F
Show InChI InChI=1S/C25H24F7N7O/c26-18-11-14(3-1-2-9-24(27,28)29)6-7-17(18)23(25(30,31)32)12-16(19-8-10-39(36-19)13-15-4-5-15)20(22(40)33-23)21-34-37-38-35-21/h6-8,10-11,15H,1-5,9,12-13H2,(H,33,40)(H,34,35,37,38)/t23-/m0/s1
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n/an/a 3n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM253621
PNG
(US9701672, 52)
Show SMILES Fc1cc(OCCCC(F)(F)F)ccc1[C@@]1(CC(c2ccn(CC3CC3)n2)=C(c2nnn[nH]2)C(=O)N1)C(F)(F)F
Show InChI InChI=1S/C24H22F7N7O2/c25-17-10-14(40-9-1-7-23(26,27)28)4-5-16(17)22(24(29,30)31)11-15(18-6-8-38(35-18)12-13-2-3-13)19(21(39)32-22)20-33-36-37-34-20/h4-6,8,10,13H,1-3,7,9,11-12H2,(H,32,39)(H,33,34,36,37)/t22-/m0/s1
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n/an/a 3.20n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM251745
PNG
(US9701672, 45)
Show SMILES CN(C)c1cnc(s1)C1=C(c2nnn[nH]2)C(=O)N[C@@](C1)(c1ccc(OCCCCC(F)(F)F)cc1)C(F)(F)F
Show InChI InChI=1S/C23H23F6N7O2S/c1-36(2)16-12-30-20(39-16)15-11-21(23(27,28)29,31-19(37)17(15)18-32-34-35-33-18)13-5-7-14(8-6-13)38-10-4-3-9-22(24,25)26/h5-8,12H,3-4,9-11H2,1-2H3,(H,31,37)(H,32,33,34,35)/t21-/m0/s1
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n/an/a 3.5n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM253652
PNG
(US9701672, 76)
Show SMILES COc1ccc(NC(=O)C2=C(C[C@](NC2=O)(c2ccc(OCCCC(F)(F)F)cc2)C(F)(F)F)c2ccn(n2)C2CC2)cc1
Show InChI InChI=1S/C30H28F6N4O4/c1-43-21-11-5-19(6-12-21)37-26(41)25-23(24-13-15-40(39-24)20-7-8-20)17-28(30(34,35)36,38-27(25)42)18-3-9-22(10-4-18)44-16-2-14-29(31,32)33/h3-6,9-13,15,20H,2,7-8,14,16-17H2,1H3,(H,37,41)(H,38,42)/t28-/m0/s1
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n/an/a 4.20n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM253618
PNG
(US9701672, 49)
Show SMILES CCn1ccc(n1)C1=C(c2nnn[nH]2)C(=O)N[C@@](C1)(c1ccc(CCCCC(F)(F)F)cc1F)C(F)(F)F
Show InChI InChI=1S/C23H22F7N7O/c1-2-37-10-8-17(34-37)14-12-21(23(28,29)30,31-20(38)18(14)19-32-35-36-33-19)15-7-6-13(11-16(15)24)5-3-4-9-22(25,26)27/h6-8,10-11H,2-5,9,12H2,1H3,(H,31,38)(H,32,33,35,36)/t21-/m0/s1
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n/an/a 4.5n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM249850
PNG
(US9701672, 40)
Show SMILES Fc1cc(OCCCC(F)(F)F)ccc1[C@@]1(CC(c2ccn(n2)C2CCC2)=C(c2nnn[nH]2)C(=O)N1)C(F)(F)F
Show InChI InChI=1S/C24H22F7N7O2/c25-17-11-14(40-10-2-8-23(26,27)28)5-6-16(17)22(24(29,30)31)12-15(18-7-9-38(35-18)13-3-1-4-13)19(21(39)32-22)20-33-36-37-34-20/h5-7,9,11,13H,1-4,8,10,12H2,(H,32,39)(H,33,34,36,37)/t22-/m0/s1
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n/an/a 6.70n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM253624
PNG
(US9701672, 55)
Show SMILES CCCCCCn1cc(cn1)[C@@]1(CC(c2ccc(s2)C2CC2)=C(c2nnn[nH]2)C(=O)N1)C(F)(F)F
Show InChI InChI=1S/C23H26F3N7OS/c1-2-3-4-5-10-33-13-15(12-27-33)22(23(24,25)26)11-16(18-9-8-17(35-18)14-6-7-14)19(21(34)28-22)20-29-31-32-30-20/h8-9,12-14H,2-7,10-11H2,1H3,(H,28,34)(H,29,30,31,32)/t22-/m0/s1
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n/an/a 7.80n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM247151
PNG
((S,E)-2-Methyl-N-(1,1,1-trifluorodec-3-yn-2-yliden...)
Show SMILES CCCCCCC#C[C@@]1(CC(c2ccc(Cl)s2)=C(c2nnn[nH]2)C(=O)N1)C(F)(F)F
Show InChI InChI=1S/C19H19ClF3N5OS/c1-2-3-4-5-6-7-10-18(19(21,22)23)11-12(13-8-9-14(20)30-13)15(17(29)24-18)16-25-27-28-26-16/h8-9H,2-6,11H2,1H3,(H,24,29)(H,25,26,27,28)/t18-/m1/s1
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n/an/a 7.80n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM253634
PNG
(US9701672, 65)
Show SMILES CCc1ccc(s1)C1=C(c2nnn[nH]2)C(=O)N[C@@](C1)(c1ccc(Br)cc1)C(F)(F)F
Show InChI InChI=1S/C19H15BrF3N5OS/c1-2-12-7-8-14(30-12)13-9-18(19(21,22)23,10-3-5-11(20)6-4-10)24-17(29)15(13)16-25-27-28-26-16/h3-8H,2,9H2,1H3,(H,24,29)(H,25,26,27,28)/t18-/m0/s1
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n/an/a 8.80n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM251746
PNG
(US9701672, 46 | US9701672, 48)
Show SMILES CC(C)n1ccc(n1)C1=C(c2nnn[nH]2)C(=O)N[C@@](C1)(c1ccc(CCCCC(F)(F)F)cc1F)C(F)(F)F
Show InChI InChI=1S/C24H24F7N7O/c1-13(2)38-10-8-18(35-38)15-12-22(24(29,30)31,32-21(39)19(15)20-33-36-37-34-20)16-7-6-14(11-17(16)25)5-3-4-9-23(26,27)28/h6-8,10-11,13H,3-5,9,12H2,1-2H3,(H,32,39)(H,33,34,36,37)/t22-/m0/s1
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n/an/a 8.80n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM247153
PNG
(1-(5-((Dimethylamino)methyl)thiophen-2-yl)ethanone...)
Show SMILES FC(F)(F)CCCOc1ccc(cc1)[C@@]1(CC(c2cc3ccccc3s2)=C(c2nnn[nH]2)C(=O)N1)C(F)(F)F
Show InChI InChI=1S/C25H19F6N5O2S/c26-24(27,28)10-3-11-38-16-8-6-15(7-9-16)23(25(29,30)31)13-17(19-12-14-4-1-2-5-18(14)39-19)20(22(37)32-23)21-33-35-36-34-21/h1-2,4-9,12H,3,10-11,13H2,(H,32,37)(H,33,34,35,36)/t23-/m0/s1
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n/an/a 9n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM253619
PNG
(US9701672, 50)
Show SMILES CC(C)Cn1ccc(n1)C1=C(c2nnn[nH]2)C(=O)N[C@@](C1)(c1ccc(CCCCC(F)(F)F)cc1F)C(F)(F)F
Show InChI InChI=1S/C25H26F7N7O/c1-14(2)13-39-10-8-19(36-39)16-12-23(25(30,31)32,33-22(40)20(16)21-34-37-38-35-21)17-7-6-15(11-18(17)26)5-3-4-9-24(27,28)29/h6-8,10-11,14H,3-5,9,12-13H2,1-2H3,(H,33,40)(H,34,35,37,38)/t23-/m0/s1
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n/an/a 9.40n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM253643
PNG
(US9701672, 72)
Show SMILES COc1ccc(cn1)C1=C(C#N)C(=O)N[C@@](C1)(c1ccc(OCCCCCC(F)(F)F)cc1)C(F)(F)F
Show InChI InChI=1S/C25H23F6N3O3/c1-36-21-10-5-16(15-33-21)19-13-23(25(29,30)31,34-22(35)20(19)14-32)17-6-8-18(9-7-17)37-12-4-2-3-11-24(26,27)28/h5-10,15H,2-4,11-13H2,1H3,(H,34,35)/t23-/m0/s1
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Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM251746
PNG
(US9701672, 46 | US9701672, 48)
Show SMILES CC(C)n1ccc(n1)C1=C(c2nnn[nH]2)C(=O)N[C@@](C1)(c1ccc(CCCCC(F)(F)F)cc1F)C(F)(F)F
Show InChI InChI=1S/C24H24F7N7O/c1-13(2)38-10-8-18(35-38)15-12-22(24(29,30)31,32-21(39)19(15)20-33-36-37-34-20)16-7-6-14(11-17(16)25)5-3-4-9-23(26,27)28/h6-8,10-11,13H,3-5,9,12H2,1-2H3,(H,32,39)(H,33,34,36,37)/t22-/m0/s1
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Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM249130
PNG
(US9701672, 35)
Show SMILES CN(C)c1cnc(s1)C1=C(c2nnn[nH]2)C(=O)N[C@@](C1)(c1ccc(OCCCC(F)(F)F)cc1)C(F)(F)F
Show InChI InChI=1S/C22H21F6N7O2S/c1-35(2)15-11-29-19(38-15)14-10-20(22(26,27)28,30-18(36)16(14)17-31-33-34-32-17)12-4-6-13(7-5-12)37-9-3-8-21(23,24)25/h4-7,11H,3,8-10H2,1-2H3,(H,30,36)(H,31,32,33,34)/t20-/m0/s1
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Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM249535
PNG
(US9701672, 36 | US9701672, 37)
Show SMILES Cc1ccc(nc1)C1=C(c2nnn[nH]2)C(=O)N[C@@](C1)(c1ccc(OCCCC(F)(F)F)cc1)C(F)(F)F
Show InChI InChI=1S/C23H20F6N6O2/c1-13-3-8-17(30-12-13)16-11-21(23(27,28)29,31-20(36)18(16)19-32-34-35-33-19)14-4-6-15(7-5-14)37-10-2-9-22(24,25)26/h3-8,12H,2,9-11H2,1H3,(H,31,36)(H,32,33,34,35)/t21-/m0/s1
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n/an/a 12.5n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM247172
PNG
(US9701672, 26 | US9701672, 32)
Show SMILES CC(C)n1ccc(n1)C1=C(c2nnn[nH]2)C(=O)N[C@@](C1)(c1ccc(OCCCCCC(F)(F)F)cc1)C(F)(F)F
Show InChI InChI=1S/C25H27F6N7O2/c1-15(2)38-12-10-19(35-38)18-14-23(25(29,30)31,32-22(39)20(18)21-33-36-37-34-21)16-6-8-17(9-7-16)40-13-5-3-4-11-24(26,27)28/h6-10,12,15H,3-5,11,13-14H2,1-2H3,(H,32,39)(H,33,34,36,37)/t23-/m0/s1
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Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM247161
PNG
(1-(1-Isopropyl-1H-pyrazol-3-yl)ethanone | US970167...)
Show SMILES Fc1cc(OCCCCCC(F)(F)F)ccc1[C@@]1(CC(c2cnn(c2)C2CC2)=C(c2nnn[nH]2)C(=O)N1)C(F)(F)F
Show InChI InChI=1S/C25H24F7N7O2/c26-19-10-16(41-9-3-1-2-8-24(27,28)29)6-7-18(19)23(25(30,31)32)11-17(14-12-33-39(13-14)15-4-5-15)20(22(40)34-23)21-35-37-38-36-21/h6-7,10,12-13,15H,1-5,8-9,11H2,(H,34,40)(H,35,36,37,38)/t23-/m0/s1
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n/an/a 14.5n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM253645
PNG
((S)-4-(5-Cyclopropylthiophen-2-yl)-2-oxo-6-(4-(4,4...)
Show SMILES FC(F)(F)CCCOc1ccc(cc1)[C@@]1(CC(c2ccc(s2)C2CC2)=C(C#N)C(=O)N1)C(F)(F)F
Show InChI InChI=1S/C24H20F6N2O2S/c25-23(26,27)10-1-11-34-16-6-4-15(5-7-16)22(24(28,29)30)12-17(18(13-31)21(33)32-22)20-9-8-19(35-20)14-2-3-14/h4-9,14H,1-3,10-12H2,(H,32,33)/t22-/m0/s1
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n/an/a 15n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM251563
PNG
(US9701672, 44)
Show SMILES FC(F)(F)CCCCOc1ccc(cc1)[C@@]1(CC(c2ccc(s2)C2CC2)=C(c2nnn[nH]2)C(=O)N1)C(F)(F)F
Show InChI InChI=1S/C25H23F6N5O2S/c26-24(27,28)11-1-2-12-38-16-7-5-15(6-8-16)23(25(29,30)31)13-17(19-10-9-18(39-19)14-3-4-14)20(22(37)32-23)21-33-35-36-34-21/h5-10,14H,1-4,11-13H2,(H,32,37)(H,33,34,35,36)/t23-/m0/s1
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n/an/a 15.2n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM247163
PNG
((S,E)-2-Methyl-N-(2,2,2-trifluoro-1-(4-(5,5,5-trif...)
Show SMILES FC(F)(F)CCCOc1ccc(cc1)[C@@]1(CC(c2ccn(n2)C2CC2)=C(c2nnn[nH]2)C(=O)N1)C(F)(F)F
Show InChI InChI=1S/C23H21F6N7O2/c24-22(25,26)9-1-11-38-15-6-2-13(3-7-15)21(23(27,28)29)12-16(17-8-10-36(33-17)14-4-5-14)18(20(37)30-21)19-31-34-35-32-19/h2-3,6-8,10,14H,1,4-5,9,11-12H2,(H,30,37)(H,31,32,34,35)/t21-/m0/s1
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n/an/a 16.6n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM249801
PNG
(US9701672, 39)
Show SMILES CC(C)n1ccc(n1)C1=C(c2nnn[nH]2)C(=O)N[C@@](C1)(c1ccc(OCCCC(F)(F)F)cc1F)C(F)(F)F
Show InChI InChI=1S/C23H22F7N7O2/c1-12(2)37-8-6-17(34-37)14-11-21(23(28,29)30,31-20(38)18(14)19-32-35-36-33-19)15-5-4-13(10-16(15)24)39-9-3-7-22(25,26)27/h4-6,8,10,12H,3,7,9,11H2,1-2H3,(H,31,38)(H,32,33,35,36)/t21-/m0/s1
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n/an/a 16.6n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM247174
PNG
(US9701672, 28)
Show SMILES CN(C)c1ccc(nc1)C1=C(c2nnn[nH]2)C(=O)N[C@@](C1)(c1ccc(OCCCC(F)(F)F)cc1)C(F)(F)F
Show InChI InChI=1S/C24H23F6N7O2/c1-37(2)15-6-9-18(31-13-15)17-12-22(24(28,29)30,32-21(38)19(17)20-33-35-36-34-20)14-4-7-16(8-5-14)39-11-3-10-23(25,26)27/h4-9,13H,3,10-12H2,1-2H3,(H,32,38)(H,33,34,35,36)/t22-/m0/s1
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n/an/a 17.6n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM247159
PNG
(1-(1-Cyclobutyl-1H-pyrazol-3-yl)ethanone | US97016...)
Show SMILES Cc1cnc(s1)C1=C(c2nnn[nH]2)C(=O)N[C@@](C1)(c1ccc(OCCCC(F)(F)F)cc1)C(F)(F)F
Show InChI InChI=1S/C21H18F6N6O2S/c1-11-10-28-18(36-11)14-9-19(21(25,26)27,29-17(34)15(14)16-30-32-33-31-16)12-3-5-13(6-4-12)35-8-2-7-20(22,23)24/h3-6,10H,2,7-9H2,1H3,(H,29,34)(H,30,31,32,33)/t19-/m0/s1
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n/an/a 19.4n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM251547
PNG
(US9701672, 43)
Show SMILES CCn1ccc(n1)C1=C(c2nnn[nH]2)C(=O)N[C@@](C1)(c1ccc(OCCCC(F)(F)F)cc1F)C(F)(F)F
Show InChI InChI=1S/C22H20F7N7O2/c1-2-36-8-6-16(33-36)13-11-20(22(27,28)29,30-19(37)17(13)18-31-34-35-32-18)14-5-4-12(10-15(14)23)38-9-3-7-21(24,25)26/h4-6,8,10H,2-3,7,9,11H2,1H3,(H,30,37)(H,31,32,34,35)/t20-/m0/s1
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n/an/a 20.2n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM247170
PNG
(US9701672, 24)
Show SMILES FC(F)(F)CCCCc1ccc(cc1)[C@@]1(CC(c2ccn(n2)C2CC2)=C(c2nnn[nH]2)C(=O)N1)C(F)(F)F
Show InChI InChI=1S/C24H23F6N7O/c25-23(26,27)11-2-1-3-14-4-6-15(7-5-14)22(24(28,29)30)13-17(18-10-12-37(34-18)16-8-9-16)19(21(38)31-22)20-32-35-36-33-20/h4-7,10,12,16H,1-3,8-9,11,13H2,(H,31,38)(H,32,33,35,36)/t22-/m0/s1
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n/an/a 22.9n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM247164
PNG
((S,E)-N-(1-(2-Chloro-4-(4,4,4-trifluorobutoxy)phen...)
Show SMILES FC(F)(F)CCCOc1ccc(cc1)[C@@]1(CC(c2cnn(c2)C2CC2)=C(c2nnn[nH]2)C(=O)N1)C(F)(F)F
Show InChI InChI=1S/C23H21F6N7O2/c24-22(25,26)8-1-9-38-16-6-2-14(3-7-16)21(23(27,28)29)10-17(13-11-30-36(12-13)15-4-5-15)18(20(37)31-21)19-32-34-35-33-19/h2-3,6-7,11-12,15H,1,4-5,8-10H2,(H,31,37)(H,32,33,34,35)/t21-/m0/s1
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n/an/a 24.5n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM253637
PNG
(US9701672, 68)
Show SMILES FC(F)(F)CCCOc1ccc(cc1)[C@@]1(CC(c2ccc(Cl)s2)=C(C#N)C(=O)N1)C(F)(F)F
Show InChI InChI=1S/C21H15ClF6N2O2S/c22-17-7-6-16(33-17)14-10-19(21(26,27)28,30-18(31)15(14)11-29)12-2-4-13(5-3-12)32-9-1-8-20(23,24)25/h2-7H,1,8-10H2,(H,30,31)/t19-/m0/s1
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n/an/a 30.2n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM253642
PNG
(US9701672, 71)
Show SMILES Cc1ccc(s1)C1=C(C#N)C(=O)N[C@@](C1)(c1ccc(OCCCCCC(F)(F)F)cc1)C(F)(F)F
Show InChI InChI=1S/C24H22F6N2O2S/c1-15-5-10-20(35-15)18-13-22(24(28,29)30,32-21(33)19(18)14-31)16-6-8-17(9-7-16)34-12-4-2-3-11-23(25,26)27/h5-10H,2-4,11-13H2,1H3,(H,32,33)/t22-/m0/s1
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n/an/a 31.5n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM247165
PNG
((S,E)-2-Methyl-N-(2,2,2-trifluoro-1-(2-methoxy-4-(...)
Show SMILES FC(F)(F)CCCOc1ccc(cc1)[C@@]1(CC(c2ccn(CC3CC3)n2)=C(c2nnn[nH]2)C(=O)N1)C(F)(F)F
Show InChI InChI=1S/C24H23F6N7O2/c25-23(26,27)9-1-11-39-16-6-4-15(5-7-16)22(24(28,29)30)12-17(18-8-10-37(34-18)13-14-2-3-14)19(21(38)31-22)20-32-35-36-33-20/h4-8,10,14H,1-3,9,11-13H2,(H,31,38)(H,32,33,35,36)/t22-/m0/s1
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n/an/a 31.8n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM247155
PNG
(1-(6-(Dimethylamino)pyridin-3-yl)ethanone | US9701...)
Show SMILES CCc1ccc(s1)C1=C(c2nnn[nH]2)C(=O)N[C@@](C1)(c1ccc(OCCCC(F)(F)F)cc1)C(F)(F)F
Show InChI InChI=1S/C23H21F6N5O2S/c1-2-15-8-9-17(37-15)16-12-21(23(27,28)29,30-20(35)18(16)19-31-33-34-32-19)13-4-6-14(7-5-13)36-11-3-10-22(24,25)26/h4-9H,2-3,10-12H2,1H3,(H,30,35)(H,31,32,33,34)/t21-/m0/s1
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n/an/a 32n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM253641
PNG
(US9701672, 70)
Show SMILES COc1ccc(cn1)C1=C(C#N)C(=O)N[C@@](C1)(c1ccc(OCCCCC(F)(F)F)cc1)C(F)(F)F
Show InChI InChI=1S/C24H21F6N3O3/c1-35-20-9-4-15(14-32-20)18-12-22(24(28,29)30,33-21(34)19(18)13-31)16-5-7-17(8-6-16)36-11-3-2-10-23(25,26)27/h4-9,14H,2-3,10-12H2,1H3,(H,33,34)/t22-/m0/s1
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n/an/a 32.3n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM247162
PNG
(1-(1-(tert-Butyl)-1H-pyrazol-3-yl)ethanone | US970...)
Show SMILES Fc1cc(OCCCCCC(F)(F)F)ccc1[C@@]1(CC(c2ccn(n2)C2CC2)=C(c2nnn[nH]2)C(=O)N1)C(F)(F)F
Show InChI InChI=1S/C25H24F7N7O2/c26-18-12-15(41-11-3-1-2-9-24(27,28)29)6-7-17(18)23(25(30,31)32)13-16(19-8-10-39(36-19)14-4-5-14)20(22(40)33-23)21-34-37-38-35-21/h6-8,10,12,14H,1-5,9,11,13H2,(H,33,40)(H,34,35,37,38)/t23-/m0/s1
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n/an/a 34n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM249799
PNG
(US9701672, 38)
Show SMILES Cc1cnc(nc1)C1=C(c2nnn[nH]2)C(=O)N[C@@](C1)(c1ccc(OCCCC(F)(F)F)cc1)C(F)(F)F
Show InChI InChI=1S/C22H19F6N7O2/c1-12-10-29-17(30-11-12)15-9-20(22(26,27)28,31-19(36)16(15)18-32-34-35-33-18)13-3-5-14(6-4-13)37-8-2-7-21(23,24)25/h3-6,10-11H,2,7-9H2,1H3,(H,31,36)(H,32,33,34,35)/t20-/m0/s1
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n/an/a 34.3n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM247148
PNG
((S,E)-2-Methyl-N-(2,2,2-trifluoro-1-(4-(6,6,6-trif...)
Show SMILES Cc1ccc(s1)C1=C(c2nnn[nH]2)C(=O)N[C@@](C1)(c1ccc(OCCCC(F)(F)F)cc1)C(F)(F)F
Show InChI InChI=1S/C22H19F6N5O2S/c1-12-3-8-16(36-12)15-11-20(22(26,27)28,29-19(34)17(15)18-30-32-33-31-18)13-4-6-14(7-5-13)35-10-2-9-21(23,24)25/h3-8H,2,9-11H2,1H3,(H,29,34)(H,30,31,32,33)/t20-/m0/s1
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n/an/a 41n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM247172
PNG
(US9701672, 26 | US9701672, 32)
Show SMILES CC(C)n1ccc(n1)C1=C(c2nnn[nH]2)C(=O)N[C@@](C1)(c1ccc(OCCCCCC(F)(F)F)cc1)C(F)(F)F
Show InChI InChI=1S/C25H27F6N7O2/c1-15(2)38-12-10-19(35-38)18-14-23(25(29,30)31,32-22(39)20(18)21-33-36-37-34-21)16-6-8-17(9-7-16)40-13-5-3-4-11-24(26,27)28/h6-10,12,15H,3-5,11,13-14H2,1-2H3,(H,32,39)(H,33,34,36,37)/t23-/m0/s1
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n/an/a 43.7n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM253622
PNG
(US9701672, 53)
Show SMILES Fc1cc(OCCCC(F)(F)F)ccc1[C@@]1(CC(c2ccn(CC3CCC3)n2)=C(c2nnn[nH]2)C(=O)N1)C(F)(F)F
Show InChI InChI=1S/C25H24F7N7O2/c26-18-11-15(41-10-2-8-24(27,28)29)5-6-17(18)23(25(30,31)32)12-16(20(22(40)33-23)21-34-37-38-35-21)19-7-9-39(36-19)13-14-3-1-4-14/h5-7,9,11,14H,1-4,8,10,12-13H2,(H,33,40)(H,34,35,37,38)/t23-/m0/s1
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Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM248102
PNG
(US9701672, 29)
Show SMILES CCn1ccc(n1)C1=C(c2nnn[nH]2)C(=O)N[C@@](C1)(c1ccc(OCCCCCC(F)(F)F)cc1)C(F)(F)F
Show InChI InChI=1S/C24H25F6N7O2/c1-2-37-12-10-18(34-37)17-14-22(24(28,29)30,31-21(38)19(17)20-32-35-36-33-20)15-6-8-16(9-7-15)39-13-5-3-4-11-23(25,26)27/h6-10,12H,2-5,11,13-14H2,1H3,(H,31,38)(H,32,33,35,36)/t22-/m0/s1
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Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM249013
PNG
(US9701672, 31)
Show SMILES CC(C)Cn1ccc(n1)C1=C(c2nnn[nH]2)C(=O)N[C@@](C1)(c1ccc(OCCCCCC(F)(F)F)cc1)C(F)(F)F
Show InChI InChI=1S/C26H29F6N7O2/c1-16(2)15-39-12-10-20(36-39)19-14-24(26(30,31)32,33-23(40)21(19)22-34-37-38-35-22)17-6-8-18(9-7-17)41-13-5-3-4-11-25(27,28)29/h6-10,12,16H,3-5,11,13-15H2,1-2H3,(H,33,40)(H,34,35,37,38)/t24-/m0/s1
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n/an/a 61.9n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM247160
PNG
(1-(1-(Cyclobutylmethyl)-1H-pyrazol-3-yl)ethanone |...)
Show SMILES CN(C)c1ccc(cn1)C1=C(c2nnn[nH]2)C(=O)N[C@@](C1)(c1ccc(OCCCC(F)(F)F)cc1)C(F)(F)F
Show InChI InChI=1S/C24H23F6N7O2/c1-37(2)18-9-4-14(13-31-18)17-12-22(24(28,29)30,32-21(38)19(17)20-33-35-36-34-20)15-5-7-16(8-6-15)39-11-3-10-23(25,26)27/h4-9,13H,3,10-12H2,1-2H3,(H,32,38)(H,33,34,35,36)/t22-/m0/s1
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n/an/a 72.1n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM249858
PNG
(US9701672, 41)
Show SMILES Fc1cc(OCCCC(F)(F)F)ccc1[C@@]1(CC(c2ccn(n2)C2CC2)=C(c2nnn[nH]2)C(=O)N1)C(F)(F)F
Show InChI InChI=1S/C23H20F7N7O2/c24-16-10-13(39-9-1-7-22(25,26)27)4-5-15(16)21(23(28,29)30)11-14(17-6-8-37(34-17)12-2-3-12)18(20(38)31-21)19-32-35-36-33-19/h4-6,8,10,12H,1-3,7,9,11H2,(H,31,38)(H,32,33,35,36)/t21-/m0/s1
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n/an/a 73.6n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM247166
PNG
(1-(1-Ethyl-1H-pyrazol-3-yl)ethanone | US9701672, 2...)
Show SMILES FC(F)(F)CCCOc1ccc(cc1)[C@@]1(CC(c2ccn(n2)C2CCC2)=C(c2nnn[nH]2)C(=O)N1)C(F)(F)F
Show InChI InChI=1S/C24H23F6N7O2/c25-23(26,27)10-2-12-39-16-7-5-14(6-8-16)22(24(28,29)30)13-17(18-9-11-37(34-18)15-3-1-4-15)19(21(38)31-22)20-32-35-36-33-20/h5-9,11,15H,1-4,10,12-13H2,(H,31,38)(H,32,33,35,36)/t22-/m0/s1
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n/an/a 74.7n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM249535
PNG
(US9701672, 36 | US9701672, 37)
Show SMILES Cc1ccc(nc1)C1=C(c2nnn[nH]2)C(=O)N[C@@](C1)(c1ccc(OCCCC(F)(F)F)cc1)C(F)(F)F
Show InChI InChI=1S/C23H20F6N6O2/c1-13-3-8-17(30-12-13)16-11-21(23(27,28)29,31-20(36)18(16)19-32-34-35-33-19)14-4-6-15(7-5-14)37-10-2-9-22(24,25)26/h3-8,12H,2,9-11H2,1H3,(H,31,36)(H,32,33,34,35)/t21-/m0/s1
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n/an/a 79.2n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM249128
PNG
(US9701672, 34)
Show SMILES CC(C)n1cc(C2=C(c3nnn[nH]3)C(=O)N[C@@](C2)(c2ccc(OCCCCCC(F)(F)F)cc2)C(F)(F)F)c2ccccc12
Show InChI InChI=1S/C30H30F6N6O2/c1-18(2)42-17-23(21-8-4-5-9-24(21)42)22-16-28(30(34,35)36,37-27(43)25(22)26-38-40-41-39-26)19-10-12-20(13-11-19)44-15-7-3-6-14-29(31,32)33/h4-5,8-13,17-18H,3,6-7,14-16H2,1-2H3,(H,37,43)(H,38,39,40,41)/t28-/m0/s1
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n/an/a 86.9n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM253620
PNG
(US9701672, 51)
Show SMILES CC(C)Cn1ccc(n1)C1=C(c2nnn[nH]2)C(=O)N[C@@](C1)(c1ccc(OCCCC(F)(F)F)cc1F)C(F)(F)F
Show InChI InChI=1S/C24H24F7N7O2/c1-13(2)12-38-8-6-18(35-38)15-11-22(24(29,30)31,32-21(39)19(15)20-33-36-37-34-20)16-5-4-14(10-17(16)25)40-9-3-7-23(26,27)28/h4-6,8,10,13H,3,7,9,11-12H2,1-2H3,(H,32,39)(H,33,34,36,37)/t22-/m0/s1
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n/an/a 97.4n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM253636
PNG
((S)-4-(5-Methylthiophen-2-yl)-2-oxo-6-(4-(4,4,4-tr...)
Show SMILES Cc1ccc(s1)C1=C(C#N)C(=O)N[C@@](C1)(c1ccc(OCCCC(F)(F)F)cc1)C(F)(F)F
Show InChI InChI=1S/C22H18F6N2O2S/c1-13-3-8-18(33-13)16-11-20(22(26,27)28,30-19(31)17(16)12-29)14-4-6-15(7-5-14)32-10-2-9-21(23,24)25/h3-8H,2,9-11H2,1H3,(H,30,31)/t20-/m0/s1
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n/an/a 97.6n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM247171
PNG
(US9701672, 25)
Show SMILES FC(F)(F)CCCCCOc1ccc(cc1)[C@@]1(CC(c2ccn(n2)C2CC2)=C(c2nnn[nH]2)C(=O)N1)C(F)(F)F
Show InChI InChI=1S/C25H25F6N7O2/c26-24(27,28)11-2-1-3-13-40-17-8-4-15(5-9-17)23(25(29,30)31)14-18(19-10-12-38(35-19)16-6-7-16)20(22(39)32-23)21-33-36-37-34-21/h4-5,8-10,12,16H,1-3,6-7,11,13-14H2,(H,32,39)(H,33,34,36,37)/t23-/m0/s1
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n/an/a 102n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM253630
PNG
(US9701672, 61)
Show SMILES FC(F)(F)CCCOc1ccc(c(Cl)c1)[C@@]1(CC(c2ccn(n2)C2CC2)=C(c2nnn[nH]2)C(=O)N1)C(F)(F)F
Show InChI InChI=1S/C23H20ClF6N7O2/c24-16-10-13(39-9-1-7-22(25,26)27)4-5-15(16)21(23(28,29)30)11-14(17-6-8-37(34-17)12-2-3-12)18(20(38)31-21)19-32-35-36-33-19/h4-6,8,10,12H,1-3,7,9,11H2,(H,31,38)(H,32,33,35,36)/t21-/m0/s1
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n/an/a 120n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM253644
PNG
(US9701672, 73)
Show SMILES COc1ccc(cn1)C1=C(C#N)C(=O)N[C@@](C1)(c1ccc(OCCCC(F)(F)F)cc1)C(F)(F)F
Show InChI InChI=1S/C23H19F6N3O3/c1-34-19-8-3-14(13-31-19)17-11-21(23(27,28)29,32-20(33)18(17)12-30)15-4-6-16(7-5-15)35-10-2-9-22(24,25)26/h3-8,13H,2,9-11H2,1H3,(H,32,33)/t21-/m0/s1
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n/an/a 135n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM247167
PNG
(1-(1-Isobutyl-1H-pyrazol-3-yl)ethanone | US9701672...)
Show SMILES FC(F)(F)CCCOc1ccc(cc1)[C@@]1(CC(c2ccn(CC3CCC3)n2)=C(c2nnn[nH]2)C(=O)N1)C(F)(F)F
Show InChI InChI=1S/C25H25F6N7O2/c26-24(27,28)10-2-12-40-17-7-5-16(6-8-17)23(25(29,30)31)13-18(20(22(39)32-23)21-33-36-37-34-21)19-9-11-38(35-19)14-15-3-1-4-15/h5-9,11,15H,1-4,10,12-14H2,(H,32,39)(H,33,34,36,37)/t23-/m0/s1
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Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM253629
PNG
(US9701672, 60)
Show SMILES FC(F)(F)CCCCCOc1ccc(cc1)[C@@]1(CC(c2nc3ccccc3s2)=C(c2nnn[nH]2)C(=O)N1)C(F)(F)F
Show InChI InChI=1S/C26H22F6N6O2S/c27-25(28,29)12-4-1-5-13-40-16-10-8-15(9-11-16)24(26(30,31)32)14-17(20(22(39)34-24)21-35-37-38-36-21)23-33-18-6-2-3-7-19(18)41-23/h2-3,6-11H,1,4-5,12-14H2,(H,34,39)(H,35,36,37,38)/t24-/m0/s1
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Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM253640
PNG
(US9701672, 69)
Show SMILES Cc1csc(c1)C1=C(C#N)C(=O)N[C@@](C1)(c1ccc(OCCCC(F)(F)F)cc1)C(F)(F)F
Show InChI InChI=1S/C22H18F6N2O2S/c1-13-9-18(33-12-13)16-10-20(22(26,27)28,30-19(31)17(16)11-29)14-3-5-15(6-4-14)32-8-2-7-21(23,24)25/h3-6,9,12H,2,7-8,10H2,1H3,(H,30,31)/t20-/m0/s1
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n/an/a 148n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM247173
PNG
(US9701672, 27)
Show SMILES CC(C)(C)n1ccc(n1)C1=C(c2nnn[nH]2)C(=O)N[C@@](C1)(c1ccc(OCCCCCC(F)(F)F)cc1)C(F)(F)F
Show InChI InChI=1S/C26H29F6N7O2/c1-23(2,3)39-13-11-19(36-39)18-15-24(26(30,31)32,33-22(40)20(18)21-34-37-38-35-21)16-7-9-17(10-8-16)41-14-6-4-5-12-25(27,28)29/h7-11,13H,4-6,12,14-15H2,1-3H3,(H,33,40)(H,34,35,37,38)/t24-/m0/s1
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Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM247158
PNG
(1-(1-(Cyclopropylmethyl)-1H-pyrazol-3-yl)ethanone ...)
Show SMILES CN(C)Cc1ccc(s1)C1=C(c2nnn[nH]2)C(=O)N[C@@](C1)(c1ccc(OCCCC(F)(F)F)cc1)C(F)(F)F
Show InChI InChI=1S/C24H24F6N6O2S/c1-36(2)13-16-8-9-18(39-16)17-12-22(24(28,29)30,31-21(37)19(17)20-32-34-35-33-20)14-4-6-15(7-5-14)38-11-3-10-23(25,26)27/h4-9H,3,10-13H2,1-2H3,(H,31,37)(H,32,33,34,35)/t22-/m0/s1
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Bristol-Myers Squibb Company

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Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM247149
PNG
((S,E)-2-Methyl-N-(2,2,2-trifluoro-1-(2-fluoro-4-((...)
Show SMILES FC(F)(F)CCCOc1ccc(cc1)[C@@]1(CC(c2ccc(Cl)s2)=C(c2nnn[nH]2)C(=O)N1)C(F)(F)F
Show InChI InChI=1S/C21H16ClF6N5O2S/c22-15-7-6-14(36-15)13-10-19(21(26,27)28,29-18(34)16(13)17-30-32-33-31-17)11-2-4-12(5-3-11)35-9-1-8-20(23,24)25/h2-7H,1,8-10H2,(H,29,34)(H,30,31,32,33)/t19-/m0/s1
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Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM254007
PNG
(((S)-4-(4-Methyl-1H-pyrazol-1-yl)-2-oxo-6-(4-(4,4,...)
Show SMILES Cc1cnn(c1)C1=C(C#N)C(=O)N[C@@](C1)(c1ccc(OCCCC(F)(F)F)cc1)C(F)(F)F
Show InChI InChI=1S/C21H18F6N4O2/c1-13-11-29-31(12-13)17-9-19(21(25,26)27,30-18(32)16(17)10-28)14-3-5-15(6-4-14)33-8-2-7-20(22,23)24/h3-6,11-12H,2,7-9H2,1H3,(H,30,32)/t19-/m0/s1
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Bristol-Myers Squibb Company

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Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM247157
PNG
(1-(1-Cyclopropyl-1H-pyrazol-3-yl)ethanone | US9701...)
Show SMILES Cc1ccsc1C1=C(c2nnn[nH]2)C(=O)N[C@@](C1)(c1ccc(OCCCC(F)(F)F)cc1)C(F)(F)F
Show InChI InChI=1S/C22H19F6N5O2S/c1-12-7-10-36-17(12)15-11-20(22(26,27)28,29-19(34)16(15)18-30-32-33-31-18)13-3-5-14(6-4-13)35-9-2-8-21(23,24)25/h3-7,10H,2,8-9,11H2,1H3,(H,29,34)(H,30,31,32,33)/t20-/m0/s1
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US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM249122
PNG
(US9701672, 33)
Show SMILES CC(C)n1nc(C2=C(c3nnn[nH]3)C(=O)N[C@@](C2)(c2ccc(OCCCCCC(F)(F)F)cc2)C(F)(F)F)c2ccccc12
Show InChI InChI=1S/C29H29F6N7O2/c1-17(2)42-22-9-5-4-8-20(22)24(39-42)21-16-27(29(33,34)35,36-26(43)23(21)25-37-40-41-38-25)18-10-12-19(13-11-18)44-15-7-3-6-14-28(30,31)32/h4-5,8-13,17H,3,6-7,14-16H2,1-2H3,(H,36,43)(H,37,38,40,41)/t27-/m0/s1
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
Article
US Patent
n/an/a 950n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM247156
PNG
(1-(1-Cyclopropyl-1H-pyrazol-4-yl)ethanone | US9701...)
Show SMILES Cc1csc(c1)C1=C(c2nnn[nH]2)C(=O)N[C@@](C1)(c1ccc(OCCCC(F)(F)F)cc1)C(F)(F)F
Show InChI InChI=1S/C22H19F6N5O2S/c1-12-9-16(36-11-12)15-10-20(22(26,27)28,29-19(34)17(15)18-30-32-33-31-18)13-3-5-14(6-4-13)35-8-2-7-21(23,24)25/h3-6,9,11H,2,7-8,10H2,1H3,(H,29,34)(H,30,31,32,33)/t20-/m0/s1
PDB

UniProtKB/SwissProt

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UniChem
Article
US Patent
n/an/a>2.00E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well polypropylene plates, in a total volume of 60 μL of 50 mM potassium phosphat...


US Patent US9701672 (2017)

More data for this
Ligand-Target Pair
* indicates data uncertainty>20%