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Patent code US10278968

Compile Data Set for Download or QSAR
Found 15 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
Glutaminase kidney isoform, mitochondrial


(Homo sapiens (Human))
BDBM383200
PNG
(US10278968, Compound 728)
Show SMILES Cc1cccc(CC(=O)Nc2nnc(CCCCc3ccc(NC(=O)Cc4cccc(OC(F)(F)F)c4)nn3)s2)n1
Show InChI InChI=1S/C27H26F3N7O3S/c1-17-6-4-9-20(31-17)16-24(39)33-26-37-36-25(41-26)11-3-2-8-19-12-13-22(35-34-19)32-23(38)15-18-7-5-10-21(14-18)40-27(28,29)30/h4-7,9-10,12-14H,2-3,8,11,15-16H2,1H3,(H,32,35,38)(H,33,37,39)
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n/an/a 12n/an/an/an/an/an/a



Calithera Biosciences, Inc.

US Patent


Assay Description
Compounds were assessed for their ability to inhibit the enzymatic activity of a recombinant form of Glutaminase 1 (GAC) using a biochemical assay th...


US Patent US10278968 (2019)

More data for this
Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial


(Homo sapiens (Human))
BDBM383202
PNG
(US10278968, Compound 730)
Show SMILES Oc1cc(CC(=O)Nc2ccc(CCCCc3nnc(NC(=O)Cc4ccccn4)s3)nn2)cc(OC(F)(F)F)c1
Show InChI InChI=1S/C26H24F3N7O4S/c27-26(28,29)40-20-12-16(11-19(37)15-20)13-22(38)31-21-9-8-17(33-34-21)5-1-2-7-24-35-36-25(41-24)32-23(39)14-18-6-3-4-10-30-18/h3-4,6,8-12,15,37H,1-2,5,7,13-14H2,(H,31,34,38)(H,32,36,39)
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n/an/a 13n/an/an/an/an/an/a



Calithera Biosciences, Inc.

US Patent


Assay Description
Compounds were assessed for their ability to inhibit the enzymatic activity of a recombinant form of Glutaminase 1 (GAC) using a biochemical assay th...


US Patent US10278968 (2019)

More data for this
Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial


(Homo sapiens (Human))
BDBM383201
PNG
(US10278968, Compound 729)
Show SMILES COc1cc(CC(=O)Nc2ccc(CCCCc3nnc(NC(=O)Cc4ccccn4)s3)nn2)cc(OC(F)(F)F)c1
Show InChI InChI=1S/C27H26F3N7O4S/c1-40-20-12-17(13-21(16-20)41-27(28,29)30)14-23(38)32-22-10-9-18(34-35-22)6-2-3-8-25-36-37-26(42-25)33-24(39)15-19-7-4-5-11-31-19/h4-5,7,9-13,16H,2-3,6,8,14-15H2,1H3,(H,32,35,38)(H,33,37,39)
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n/an/a 16n/an/an/an/an/an/a



Calithera Biosciences, Inc.

US Patent


Assay Description
Compounds were assessed for their ability to inhibit the enzymatic activity of a recombinant form of Glutaminase 1 (GAC) using a biochemical assay th...


US Patent US10278968 (2019)

More data for this
Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial


(Homo sapiens (Human))
BDBM383193
PNG
(US10278968, Compound 721)
Show SMILES FC(F)(F)Oc1cc(CC(=O)Nc2ccc(CCCCc3nnc(NC(=O)Cc4ccccn4)s3)nn2)ccc1Cl
Show InChI InChI=1S/C26H23ClF3N7O3S/c27-19-10-8-16(13-20(19)40-26(28,29)30)14-22(38)32-21-11-9-17(34-35-21)5-1-2-7-24-36-37-25(41-24)33-23(39)15-18-6-3-4-12-31-18/h3-4,6,8-13H,1-2,5,7,14-15H2,(H,32,35,38)(H,33,37,39)
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n/an/a 16n/an/an/an/an/an/a



Calithera Biosciences, Inc.

US Patent


Assay Description
Compounds were assessed for their ability to inhibit the enzymatic activity of a recombinant form of Glutaminase 1 (GAC) using a biochemical assay th...


US Patent US10278968 (2019)

More data for this
Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial


(Homo sapiens (Human))
BDBM383192
PNG
(US10278968, Compound 720)
Show SMILES Fc1ccc(OC(F)(F)F)cc1CC(=O)Nc1ccc(CCCCc2nnc(NC(=O)Cc3ccccn3)s2)nn1
Show InChI InChI=1S/C26H23F4N7O3S/c27-20-10-9-19(40-26(28,29)30)13-16(20)14-22(38)32-21-11-8-17(34-35-21)5-1-2-7-24-36-37-25(41-24)33-23(39)15-18-6-3-4-12-31-18/h3-4,6,8-13H,1-2,5,7,14-15H2,(H,32,35,38)(H,33,37,39)
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n/an/a 20n/an/an/an/an/an/a



Calithera Biosciences, Inc.

US Patent


Assay Description
Compounds were assessed for their ability to inhibit the enzymatic activity of a recombinant form of Glutaminase 1 (GAC) using a biochemical assay th...


US Patent US10278968 (2019)

More data for this
Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial


(Homo sapiens (Human))
BDBM109086
PNG
(US8604016, 670 | US9938267, Cmpd ID 670)
Show SMILES FC(F)(F)Oc1cccc(CC(=O)Nc2ccc(CCCCc3nnc(NC(=O)Cc4ccccn4)s3)nn2)c1
Show InChI InChI=1S/C26H24F3N7O3S/c27-26(28,29)39-20-9-5-6-17(14-20)15-22(37)31-21-12-11-18(33-34-21)7-1-2-10-24-35-36-25(40-24)32-23(38)16-19-8-3-4-13-30-19/h3-6,8-9,11-14H,1-2,7,10,15-16H2,(H,31,34,37)(H,32,36,38)
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n/an/a 23n/an/an/an/an/an/a



Calithera Biosciences, Inc.

US Patent


Assay Description
Compounds were assessed for their ability to inhibit the enzymatic activity of a recombinant form of Glutaminase 1 (GAC) using a biochemical assay th...


US Patent US10278968 (2019)

More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Glutaminase kidney isoform, mitochondrial


(Homo sapiens (Human))
BDBM383194
PNG
(US10278968, Compound 722)
Show SMILES COc1ccc(CC(=O)Nc2ccc(CCCCc3nnc(NC(=O)Cc4ccccn4)s3)nn2)cc1OC(F)(F)F
Show InChI InChI=1S/C27H26F3N7O4S/c1-40-20-11-9-17(14-21(20)41-27(28,29)30)15-23(38)32-22-12-10-18(34-35-22)6-2-3-8-25-36-37-26(42-25)33-24(39)16-19-7-4-5-13-31-19/h4-5,7,9-14H,2-3,6,8,15-16H2,1H3,(H,32,35,38)(H,33,37,39)
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UniProtKB/SwissProt

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n/an/a 24n/an/an/an/an/an/a



Calithera Biosciences, Inc.

US Patent


Assay Description
Compounds were assessed for their ability to inhibit the enzymatic activity of a recombinant form of Glutaminase 1 (GAC) using a biochemical assay th...


US Patent US10278968 (2019)

More data for this
Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial


(Homo sapiens (Human))
BDBM383190
PNG
(US10278968, Compound 718)
Show SMILES Oc1ccc(OC(F)(F)F)cc1CC(=O)Nc1ccc(CCCCc2nnc(NC(=O)Cc3ccccn3)s2)nn1
Show InChI InChI=1S/C26H24F3N7O4S/c27-26(28,29)40-19-9-10-20(37)16(13-19)14-22(38)31-21-11-8-17(33-34-21)5-1-2-7-24-35-36-25(41-24)32-23(39)15-18-6-3-4-12-30-18/h3-4,6,8-13,37H,1-2,5,7,14-15H2,(H,31,34,38)(H,32,36,39)
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n/an/a 26n/an/an/an/an/an/a



Calithera Biosciences, Inc.

US Patent


Assay Description
Compounds were assessed for their ability to inhibit the enzymatic activity of a recombinant form of Glutaminase 1 (GAC) using a biochemical assay th...


US Patent US10278968 (2019)

More data for this
Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial


(Homo sapiens (Human))
BDBM383191
PNG
(US10278968, Compound 719)
Show SMILES Fc1ccc(CC(=O)Nc2ccc(CCCCc3nnc(NC(=O)Cc4ccccn4)s3)nn2)cc1OC(F)(F)F
Show InChI InChI=1S/C26H23F4N7O3S/c27-19-10-8-16(13-20(19)40-26(28,29)30)14-22(38)32-21-11-9-17(34-35-21)5-1-2-7-24-36-37-25(41-24)33-23(39)15-18-6-3-4-12-31-18/h3-4,6,8-13H,1-2,5,7,14-15H2,(H,32,35,38)(H,33,37,39)
PDB
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UniProtKB/SwissProt

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n/an/a 33n/an/an/an/an/an/a



Calithera Biosciences, Inc.

US Patent


Assay Description
Compounds were assessed for their ability to inhibit the enzymatic activity of a recombinant form of Glutaminase 1 (GAC) using a biochemical assay th...


US Patent US10278968 (2019)

More data for this
Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial


(Homo sapiens (Human))
BDBM383189
PNG
(US10278968, Compound 717)
Show SMILES COc1ccc(OC(F)(F)F)cc1CC(=O)Nc1ccc(CCCCc2nnc(NC(=O)Cc3ccccn3)s2)nn1
Show InChI InChI=1S/C27H26F3N7O4S/c1-40-21-11-10-20(41-27(28,29)30)14-17(21)15-23(38)32-22-12-9-18(34-35-22)6-2-3-8-25-36-37-26(42-25)33-24(39)16-19-7-4-5-13-31-19/h4-5,7,9-14H,2-3,6,8,15-16H2,1H3,(H,32,35,38)(H,33,37,39)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
UniChem
US Patent
n/an/a 34n/an/an/an/an/an/a



Calithera Biosciences, Inc.

US Patent


Assay Description
Compounds were assessed for their ability to inhibit the enzymatic activity of a recombinant form of Glutaminase 1 (GAC) using a biochemical assay th...


US Patent US10278968 (2019)

More data for this
Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial


(Homo sapiens (Human))
BDBM383195
PNG
(US10278968, Compound 723)
Show SMILES Oc1ccc(CC(=O)Nc2ccc(CCCCc3nnc(NC(=O)Cc4ccccn4)s3)nn2)cc1OC(F)(F)F
Show InChI InChI=1S/C26H24F3N7O4S/c27-26(28,29)40-20-13-16(8-10-19(20)37)14-22(38)31-21-11-9-17(33-34-21)5-1-2-7-24-35-36-25(41-24)32-23(39)15-18-6-3-4-12-30-18/h3-4,6,8-13,37H,1-2,5,7,14-15H2,(H,31,34,38)(H,32,36,39)
PDB
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UniProtKB/SwissProt

B.MOAD
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n/an/a 42n/an/an/an/an/an/a



Calithera Biosciences, Inc.

US Patent


Assay Description
Compounds were assessed for their ability to inhibit the enzymatic activity of a recombinant form of Glutaminase 1 (GAC) using a biochemical assay th...


US Patent US10278968 (2019)

More data for this
Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial


(Homo sapiens (Human))
BDBM383197
PNG
(US10278968, Compound 725)
Show SMILES Nc1cccc(CC(=O)Nc2nnc(CCCCc3ccc(NC(=O)Cc4cccc(OC(F)(F)F)c4)nn3)s2)n1
Show InChI InChI=1S/C26H25F3N8O3S/c27-26(28,29)40-19-8-3-5-16(13-19)14-22(38)32-21-12-11-17(34-35-21)6-1-2-10-24-36-37-25(41-24)33-23(39)15-18-7-4-9-20(30)31-18/h3-5,7-9,11-13H,1-2,6,10,14-15H2,(H2,30,31)(H,32,35,38)(H,33,37,39)
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n/an/a 50n/an/an/an/an/an/a



Calithera Biosciences, Inc.

US Patent


Assay Description
Compounds were assessed for their ability to inhibit the enzymatic activity of a recombinant form of Glutaminase 1 (GAC) using a biochemical assay th...


US Patent US10278968 (2019)

More data for this
Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial


(Homo sapiens (Human))
BDBM383196
PNG
(US10278968, Compound 724)
Show SMILES CC(C)(C)OC(=O)Nc1cccc(CC(=O)Nc2nnc(CCCCc3ccc(NC(=O)Cc4cccc(OC(F)(F)F)c4)nn3)s2)n1
Show InChI InChI=1S/C31H33F3N8O5S/c1-30(2,3)47-29(45)37-23-12-7-10-21(35-23)18-26(44)38-28-42-41-27(48-28)13-5-4-9-20-14-15-24(40-39-20)36-25(43)17-19-8-6-11-22(16-19)46-31(32,33)34/h6-8,10-12,14-16H,4-5,9,13,17-18H2,1-3H3,(H,35,37,45)(H,36,40,43)(H,38,42,44)
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n/an/a 140n/an/an/an/an/an/a



Calithera Biosciences, Inc.

US Patent


Assay Description
Compounds were assessed for their ability to inhibit the enzymatic activity of a recombinant form of Glutaminase 1 (GAC) using a biochemical assay th...


US Patent US10278968 (2019)

More data for this
Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial


(Homo sapiens (Human))
BDBM383188
PNG
(US10278968, Compound 715)
Show SMILES OC(C(=O)Nc1ccc(CCCCc2nnc(NC(=O)Cc3ccccn3)s2)nn1)c1ccccc1
Show InChI InChI=1S/C25H25N7O3S/c33-21(16-19-11-6-7-15-26-19)28-25-32-31-22(36-25)12-5-4-10-18-13-14-20(30-29-18)27-24(35)23(34)17-8-2-1-3-9-17/h1-3,6-9,11,13-15,23,34H,4-5,10,12,16H2,(H,27,30,35)(H,28,32,33)
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n/an/a 190n/an/an/an/an/an/a



Calithera Biosciences, Inc.

US Patent


Assay Description
Compounds were assessed for their ability to inhibit the enzymatic activity of a recombinant form of Glutaminase 1 (GAC) using a biochemical assay th...


US Patent US10278968 (2019)

More data for this
Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial


(Homo sapiens (Human))
BDBM109073
PNG
(US8604016, 657 | US9938267, Cmpd ID 657)
Show SMILES Nc1nnc(CCCCc2ccc(NC(=O)Cc3cccc(OC(F)(F)F)c3)nn2)s1
Show InChI InChI=1S/C19H19F3N6O2S/c20-19(21,22)30-14-6-3-4-12(10-14)11-16(29)24-15-9-8-13(25-26-15)5-1-2-7-17-27-28-18(23)31-17/h3-4,6,8-10H,1-2,5,7,11H2,(H2,23,28)(H,24,26,29)
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n/an/a 540n/an/an/an/an/an/a



Calithera Biosciences, Inc.

US Patent


Assay Description
Compounds were assessed for their ability to inhibit the enzymatic activity of a recombinant form of Glutaminase 1 (GAC) using a biochemical assay th...


US Patent US10278968 (2019)

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