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50 similar compounds to monomer 50400050

Compile data set for download or QSAR
Wt: 526.6
BDBM47226
Wt: 556.6
BDBM47191
Wt: 554.7
BDBM47187
Wt: 574.7
BDBM108641
Wt: 682.8
BDBM108642
Wt: 584.7
BDBM108644
Wt: 593.5
BDBM108675
Wt: 621.6
BDBM108681
Wt: 580.7
BDBM108682
Wt: 626.7
BDBM108688
Wt: 682.4
BDBM108690
Wt: 554.7
BDBM108536
Wt: 560.6
BDBM108539
Wt: 580.7
BDBM108579
Wt: 574.7
BDBM108582
Displayed 1 to 15 (of 50 total )  |  Next  |  Last  >>

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 26 hits for monomerid = 47226,47191,47187,108641,108642,108644,108675,108681,108682,108688,108690,108536,108539,108579,108582   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Glutaminase kidney isoform, mitochondrial


(Homo sapiens (Human))
BDBM47187
PNG
(US8604016, 47 | US9938267, Cmpd ID 47)
Show SMILES N[C@@H](C(=O)Nc1nnc(CCSCCc2nnc(NC(=O)[C@H](N)c3ccccc3)s2)s1)c1ccccc1
Show InChI InChI=1S/C24H26N8O2S3/c25-19(15-7-3-1-4-8-15)21(33)27-23-31-29-17(36-23)11-13-35-14-12-18-30-32-24(37-18)28-22(34)20(26)16-9-5-2-6-10-16/h1-10,19-20H,11-14,25-26H2,(H,27,31,33)(H,28,32,34)/t19-,20-/m1/s1
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n/an/a 8.30E+3n/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 US8604016 (2013)


BindingDB Entry DOI: 10.7270/Q2CC0ZBW
More data for this
Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial


(Homo sapiens (Human))
BDBM108644
PNG
(US8604016, 219 | US9938267, Cmpd ID 219)
Show SMILES COc1ccccc1CC(=O)Nc1nnc(CCSCCc2nnc(NC(=O)Cc3ccccc3OC)s2)s1
Show InChI InChI=1S/C26H28N6O4S3/c1-35-19-9-5-3-7-17(19)15-21(33)27-25-31-29-23(38-25)11-13-37-14-12-24-30-32-26(39-24)28-22(34)16-18-8-4-6-10-20(18)36-2/h3-10H,11-16H2,1-2H3,(H,27,31,33)(H,28,32,34)
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n/an/a 170n/an/an/an/an/an/a



Calithera Biosciences Inc

US Patent


Assay Description
No preinc (Column 4).


US Patent US9938267 (2018)


BindingDB Entry DOI: 10.7270/Q2JS9SQV
More data for this
Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial


(Homo sapiens (Human))
BDBM47226
PNG
(US8604016, 638 | US9938267, Cmpd ID 638)
Show SMILES O=C(Cc1cccnc1)Nc1nnc(CCSCCc2nnc(NC(=O)Cc3cccnc3)s2)s1
Show InChI InChI=1S/C22H22N8O2S3/c31-17(11-15-3-1-7-23-13-15)25-21-29-27-19(34-21)5-9-33-10-6-20-28-30-22(35-20)26-18(32)12-16-4-2-8-24-14-16/h1-4,7-8,13-14H,5-6,9-12H2,(H,25,29,31)(H,26,30,32)
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n/an/a 480n/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 US8604016 (2013)


BindingDB Entry DOI: 10.7270/Q2CC0ZBW
More data for this
Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial


(Homo sapiens (Human))
BDBM108690
PNG
(US8604016, 270)
Show SMILES Brc1cccc(CC(=O)Nc2nnc(CCSCCc3nnc(NC(=O)Cc4cccc(Br)c4)s3)s2)c1
Show InChI InChI=1S/C24H22Br2N6O2S3/c25-17-5-1-3-15(11-17)13-19(33)27-23-31-29-21(36-23)7-9-35-10-8-22-30-32-24(37-22)28-20(34)14-16-4-2-6-18(26)12-16/h1-6,11-12H,7-10,13-14H2,(H,27,31,33)(H,28,32,34)
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n/an/a>5.00E+3n/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 US8604016 (2013)


BindingDB Entry DOI: 10.7270/Q2CC0ZBW
More data for this
Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial


(Homo sapiens (Human))
BDBM108536
PNG
(US8604016, 99 | US9938267, Cmpd ID 99)
Show SMILES Nc1cccc(CC(=O)Nc2nnc(CCSCCc3nnc(NC(=O)Cc4cccc(N)c4)s3)s2)c1
Show InChI InChI=1S/C24H26N8O2S3/c25-17-5-1-3-15(11-17)13-19(33)27-23-31-29-21(36-23)7-9-35-10-8-22-30-32-24(37-22)28-20(34)14-16-4-2-6-18(26)12-16/h1-6,11-12H,7-10,13-14,25-26H2,(H,27,31,33)(H,28,32,34)
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n/an/a 2.70E+3n/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 US8604016 (2013)


BindingDB Entry DOI: 10.7270/Q2CC0ZBW
More data for this
Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial


(Homo sapiens (Human))
BDBM108539
PNG
(US8604016, 102 | US9938267, Cmpd ID 102)
Show SMILES Fc1cccc(CC(=O)Nc2nnc(CCSCCc3nnc(NC(=O)Cc4cccc(F)c4)s3)s2)c1
Show InChI InChI=1S/C24H22F2N6O2S3/c25-17-5-1-3-15(11-17)13-19(33)27-23-31-29-21(36-23)7-9-35-10-8-22-30-32-24(37-22)28-20(34)14-16-4-2-6-18(26)12-16/h1-6,11-12H,7-10,13-14H2,(H,27,31,33)(H,28,32,34)
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n/an/a 240n/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 US8604016 (2013)


BindingDB Entry DOI: 10.7270/Q2CC0ZBW
More data for this
Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial


(Homo sapiens (Human))
BDBM108579
PNG
(US8604016, 260 | US9938267, Cmpd ID 150)
Show SMILES CCN(C(=O)Cc1ccccc1)c1nnc(CCSCCc2nnc(s2)N(CC)C(=O)Cc2ccccc2)s1
Show InChI InChI=1S/C28H32N6O2S3/c1-3-33(25(35)19-21-11-7-5-8-12-21)27-31-29-23(38-27)15-17-37-18-16-24-30-32-28(39-24)34(4-2)26(36)20-22-13-9-6-10-14-22/h5-14H,3-4,15-20H2,1-2H3
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n/an/a>2.00E+4n/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 US8604016 (2013)


BindingDB Entry DOI: 10.7270/Q2CC0ZBW
More data for this
Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial


(Homo sapiens (Human))
BDBM108582
PNG
(US8604016, 155 | US9938267, Cmpd ID 155)
Show SMILES O=C(Cc1cccc(c1)C#N)Nc1nnc(CCSCCc2nnc(NC(=O)Cc3cccc(c3)C#N)s2)s1
Show InChI InChI=1S/C26H22N8O2S3/c27-15-19-5-1-3-17(11-19)13-21(35)29-25-33-31-23(38-25)7-9-37-10-8-24-32-34-26(39-24)30-22(36)14-18-4-2-6-20(12-18)16-28/h1-6,11-12H,7-10,13-14H2,(H,29,33,35)(H,30,34,36)
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n/an/a 270n/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 US8604016 (2013)


BindingDB Entry DOI: 10.7270/Q2CC0ZBW
More data for this
Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial


(Homo sapiens (Human))
BDBM108641
PNG
(US8604016, 216 | US9938267, Cmpd ID 216)
Show SMILES O=C(Cc1ccc(cc1)C#N)Nc1nnc(CCSCCc2nnc(NC(=O)Cc3ccc(cc3)C#N)s2)s1
Show InChI InChI=1S/C26H22N8O2S3/c27-15-19-5-1-17(2-6-19)13-21(35)29-25-33-31-23(38-25)9-11-37-12-10-24-32-34-26(39-24)30-22(36)14-18-3-7-20(16-28)8-4-18/h1-8H,9-14H2,(H,29,33,35)(H,30,34,36)
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n/an/a 890n/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 US8604016 (2013)


BindingDB Entry DOI: 10.7270/Q2CC0ZBW
More data for this
Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial


(Homo sapiens (Human))
BDBM108642
PNG
(US8604016, 217 | US9938267, Cmpd ID 217)
Show SMILES NS(=O)(=O)c1ccc(CC(=O)Nc2nnc(CCSCCc3nnc(NC(=O)Cc4ccc(cc4)S(N)(=O)=O)s3)s2)cc1
Show InChI InChI=1S/C24H26N8O6S5/c25-42(35,36)17-5-1-15(2-6-17)13-19(33)27-23-31-29-21(40-23)9-11-39-12-10-22-30-32-24(41-22)28-20(34)14-16-3-7-18(8-4-16)43(26,37)38/h1-8H,9-14H2,(H2,25,35,36)(H2,26,37,38)(H,27,31,33)(H,28,32,34)
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n/an/a 240n/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 US8604016 (2013)


BindingDB Entry DOI: 10.7270/Q2CC0ZBW
More data for this
Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial


(Homo sapiens (Human))
BDBM108644
PNG
(US8604016, 219 | US9938267, Cmpd ID 219)
Show SMILES COc1ccccc1CC(=O)Nc1nnc(CCSCCc2nnc(NC(=O)Cc3ccccc3OC)s2)s1
Show InChI InChI=1S/C26H28N6O4S3/c1-35-19-9-5-3-7-17(19)15-21(33)27-25-31-29-23(38-25)11-13-37-14-12-24-30-32-26(39-24)28-22(34)16-18-8-4-6-10-20(18)36-2/h3-10H,11-16H2,1-2H3,(H,27,31,33)(H,28,32,34)
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n/an/a 170n/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 US8604016 (2013)


BindingDB Entry DOI: 10.7270/Q2CC0ZBW
More data for this
Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial


(Homo sapiens (Human))
BDBM108675
PNG
(US8604016, 255)
Show SMILES Clc1ccccc1CC(=O)Nc1nnc(CCSCCc2nnc(NC(=O)Cc3ccccc3Cl)s2)s1
Show InChI InChI=1S/C24H22Cl2N6O2S3/c25-17-7-3-1-5-15(17)13-19(33)27-23-31-29-21(36-23)9-11-35-12-10-22-30-32-24(37-22)28-20(34)14-16-6-2-4-8-18(16)26/h1-8H,9-14H2,(H,27,31,33)(H,28,32,34)
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n/an/a 380n/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 US8604016 (2013)


BindingDB Entry DOI: 10.7270/Q2CC0ZBW
More data for this
Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial


(Homo sapiens (Human))
BDBM108681
PNG
(US8604016, 261)
Show SMILES CC(C(=O)Nc1nnc(CCSCCc2nnc(NC(=O)C(C)c3ccccc3Cl)s2)s1)c1ccccc1Cl
Show InChI InChI=1S/C26H26Cl2N6O2S3/c1-15(17-7-3-5-9-19(17)27)23(35)29-25-33-31-21(38-25)11-13-37-14-12-22-32-34-26(39-22)30-24(36)16(2)18-8-4-6-10-20(18)28/h3-10,15-16H,11-14H2,1-2H3,(H,29,33,35)(H,30,34,36)
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n/an/a 700n/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 US8604016 (2013)


BindingDB Entry DOI: 10.7270/Q2CC0ZBW
More data for this
Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial


(Homo sapiens (Human))
BDBM108682
PNG
(US8604016, 262)
Show SMILES CC(C(=O)Nc1nnc(CCSCCc2nnc(NC(=O)C(C)c3ccccc3C)s2)s1)c1ccccc1C
Show InChI InChI=1S/C28H32N6O2S3/c1-17-9-5-7-11-21(17)19(3)25(35)29-27-33-31-23(38-27)13-15-37-16-14-24-32-34-28(39-24)30-26(36)20(4)22-12-8-6-10-18(22)2/h5-12,19-20H,13-16H2,1-4H3,(H,29,33,35)(H,30,34,36)
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n/an/a 360n/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 US8604016 (2013)


BindingDB Entry DOI: 10.7270/Q2CC0ZBW
More data for this
Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial


(Homo sapiens (Human))
BDBM108688
PNG
(US8604016, 268)
Show SMILES O=C(Cc1ccc2ncccc2c1)Nc1nnc(CCSCCc2nnc(NC(=O)Cc3ccc4ncccc4c3)s2)s1
Show InChI InChI=1S/C30H26N8O2S3/c39-25(17-19-5-7-23-21(15-19)3-1-11-31-23)33-29-37-35-27(42-29)9-13-41-14-10-28-36-38-30(43-28)34-26(40)18-20-6-8-24-22(16-20)4-2-12-32-24/h1-8,11-12,15-16H,9-10,13-14,17-18H2,(H,33,37,39)(H,34,38,40)
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n/an/a 600n/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 US8604016 (2013)


BindingDB Entry DOI: 10.7270/Q2CC0ZBW
More data for this
Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial


(Homo sapiens (Human))
BDBM108690
PNG
(US8604016, 270)
Show SMILES Brc1cccc(CC(=O)Nc2nnc(CCSCCc3nnc(NC(=O)Cc4cccc(Br)c4)s3)s2)c1
Show InChI InChI=1S/C24H22Br2N6O2S3/c25-17-5-1-3-15(11-17)13-19(33)27-23-31-29-21(36-23)7-9-35-10-8-22-30-32-24(37-22)28-20(34)14-16-4-2-6-18(26)12-16/h1-6,11-12H,7-10,13-14H2,(H,27,31,33)(H,28,32,34)
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n/an/a 7.40E+3n/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 US8604016 (2013)


BindingDB Entry DOI: 10.7270/Q2CC0ZBW
More data for this
Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial


(Homo sapiens (Human))
BDBM47226
PNG
(US8604016, 638 | US9938267, Cmpd ID 638)
Show SMILES O=C(Cc1cccnc1)Nc1nnc(CCSCCc2nnc(NC(=O)Cc3cccnc3)s2)s1
Show InChI InChI=1S/C22H22N8O2S3/c31-17(11-15-3-1-7-23-13-15)25-21-29-27-19(34-21)5-9-33-10-6-20-28-30-22(35-20)26-18(32)12-16-4-2-8-24-14-16/h1-4,7-8,13-14H,5-6,9-12H2,(H,25,29,31)(H,26,30,32)
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n/an/a 480n/an/an/an/an/an/a



Calithera Biosciences Inc

US Patent


Assay Description
No preinc (Column 4).


US Patent US9938267 (2018)


BindingDB Entry DOI: 10.7270/Q2JS9SQV
More data for this
Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial


(Homo sapiens (Human))
BDBM47187
PNG
(US8604016, 47 | US9938267, Cmpd ID 47)
Show SMILES N[C@@H](C(=O)Nc1nnc(CCSCCc2nnc(NC(=O)[C@H](N)c3ccccc3)s2)s1)c1ccccc1
Show InChI InChI=1S/C24H26N8O2S3/c25-19(15-7-3-1-4-8-15)21(33)27-23-31-29-17(36-23)11-13-35-14-12-18-30-32-24(37-18)28-22(34)20(26)16-9-5-2-6-10-16/h1-10,19-20H,11-14,25-26H2,(H,27,31,33)(H,28,32,34)/t19-,20-/m1/s1
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n/an/a 8.30E+3n/an/an/an/an/an/a



Calithera Biosciences Inc

US Patent


Assay Description
No preinc (Column 4).


US Patent US9938267 (2018)


BindingDB Entry DOI: 10.7270/Q2JS9SQV
More data for this
Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial


(Homo sapiens (Human))
BDBM47191
PNG
(US8604016, 81 | US9938267, Cmpd ID 81)
Show SMILES O[C@@H](C(=O)Nc1nnc(CCSCCc2nnc(NC(=O)[C@H](O)c3ccccc3)s2)s1)c1ccccc1
Show InChI InChI=1S/C24H24N6O4S3/c31-19(15-7-3-1-4-8-15)21(33)25-23-29-27-17(36-23)11-13-35-14-12-18-28-30-24(37-18)26-22(34)20(32)16-9-5-2-6-10-16/h1-10,19-20,31-32H,11-14H2,(H,25,29,33)(H,26,30,34)/t19-,20-/m1/s1
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US Patent
n/an/a 1.00E+4n/an/an/an/an/an/a



Calithera Biosciences Inc

US Patent


Assay Description
No preinc (Column 4).


US Patent US9938267 (2018)


BindingDB Entry DOI: 10.7270/Q2JS9SQV
More data for this
Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial


(Homo sapiens (Human))
BDBM108536
PNG
(US8604016, 99 | US9938267, Cmpd ID 99)
Show SMILES Nc1cccc(CC(=O)Nc2nnc(CCSCCc3nnc(NC(=O)Cc4cccc(N)c4)s3)s2)c1
Show InChI InChI=1S/C24H26N8O2S3/c25-17-5-1-3-15(11-17)13-19(33)27-23-31-29-21(36-23)7-9-35-10-8-22-30-32-24(37-22)28-20(34)14-16-4-2-6-18(26)12-16/h1-6,11-12H,7-10,13-14,25-26H2,(H,27,31,33)(H,28,32,34)
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n/an/a 2.70E+3n/an/an/an/an/an/a



Calithera Biosciences Inc

US Patent


Assay Description
No preinc (Column 4).


US Patent US9938267 (2018)


BindingDB Entry DOI: 10.7270/Q2JS9SQV
More data for this
Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial


(Homo sapiens (Human))
BDBM108539
PNG
(US8604016, 102 | US9938267, Cmpd ID 102)
Show SMILES Fc1cccc(CC(=O)Nc2nnc(CCSCCc3nnc(NC(=O)Cc4cccc(F)c4)s3)s2)c1
Show InChI InChI=1S/C24H22F2N6O2S3/c25-17-5-1-3-15(11-17)13-19(33)27-23-31-29-21(36-23)7-9-35-10-8-22-30-32-24(37-22)28-20(34)14-16-4-2-6-18(26)12-16/h1-6,11-12H,7-10,13-14H2,(H,27,31,33)(H,28,32,34)
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n/an/a 240n/an/an/an/an/an/a



Calithera Biosciences Inc

US Patent


Assay Description
No preinc (Column 4).


US Patent US9938267 (2018)


BindingDB Entry DOI: 10.7270/Q2JS9SQV
More data for this
Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial


(Homo sapiens (Human))
BDBM108579
PNG
(US8604016, 260 | US9938267, Cmpd ID 150)
Show SMILES CCN(C(=O)Cc1ccccc1)c1nnc(CCSCCc2nnc(s2)N(CC)C(=O)Cc2ccccc2)s1
Show InChI InChI=1S/C28H32N6O2S3/c1-3-33(25(35)19-21-11-7-5-8-12-21)27-31-29-23(38-27)15-17-37-18-16-24-30-32-28(39-24)34(4-2)26(36)20-22-13-9-6-10-14-22/h5-14H,3-4,15-20H2,1-2H3
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n/an/a>2.00E+4n/an/an/an/an/an/a



Calithera Biosciences Inc

US Patent


Assay Description
No preinc (Column 4).


US Patent US9938267 (2018)


BindingDB Entry DOI: 10.7270/Q2JS9SQV
More data for this
Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial


(Homo sapiens (Human))
BDBM108582
PNG
(US8604016, 155 | US9938267, Cmpd ID 155)
Show SMILES O=C(Cc1cccc(c1)C#N)Nc1nnc(CCSCCc2nnc(NC(=O)Cc3cccc(c3)C#N)s2)s1
Show InChI InChI=1S/C26H22N8O2S3/c27-15-19-5-1-3-17(11-19)13-21(35)29-25-33-31-23(38-25)7-9-37-10-8-24-32-34-26(39-24)30-22(36)14-18-4-2-6-20(12-18)16-28/h1-6,11-12H,7-10,13-14H2,(H,29,33,35)(H,30,34,36)
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n/an/a 270n/an/an/an/an/an/a



Calithera Biosciences Inc

US Patent


Assay Description
No preinc (Column 4).


US Patent US9938267 (2018)


BindingDB Entry DOI: 10.7270/Q2JS9SQV
More data for this
Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial


(Homo sapiens (Human))
BDBM108641
PNG
(US8604016, 216 | US9938267, Cmpd ID 216)
Show SMILES O=C(Cc1ccc(cc1)C#N)Nc1nnc(CCSCCc2nnc(NC(=O)Cc3ccc(cc3)C#N)s2)s1
Show InChI InChI=1S/C26H22N8O2S3/c27-15-19-5-1-17(2-6-19)13-21(35)29-25-33-31-23(38-25)9-11-37-12-10-24-32-34-26(39-24)30-22(36)14-18-3-7-20(16-28)8-4-18/h1-8H,9-14H2,(H,29,33,35)(H,30,34,36)
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n/an/a 890n/an/an/an/an/an/a



Calithera Biosciences Inc

US Patent


Assay Description
No preinc (Column 4).


US Patent US9938267 (2018)


BindingDB Entry DOI: 10.7270/Q2JS9SQV
More data for this
Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial


(Homo sapiens (Human))
BDBM108642
PNG
(US8604016, 217 | US9938267, Cmpd ID 217)
Show SMILES NS(=O)(=O)c1ccc(CC(=O)Nc2nnc(CCSCCc3nnc(NC(=O)Cc4ccc(cc4)S(N)(=O)=O)s3)s2)cc1
Show InChI InChI=1S/C24H26N8O6S5/c25-42(35,36)17-5-1-15(2-6-17)13-19(33)27-23-31-29-21(40-23)9-11-39-12-10-22-30-32-24(41-22)28-20(34)14-16-3-7-18(8-4-16)43(26,37)38/h1-8H,9-14H2,(H2,25,35,36)(H2,26,37,38)(H,27,31,33)(H,28,32,34)
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n/an/a 240n/an/an/an/an/an/a



Calithera Biosciences Inc

US Patent


Assay Description
No preinc (Column 4).


US Patent US9938267 (2018)


BindingDB Entry DOI: 10.7270/Q2JS9SQV
More data for this
Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial


(Homo sapiens (Human))
BDBM47191
PNG
(US8604016, 81 | US9938267, Cmpd ID 81)
Show SMILES O[C@@H](C(=O)Nc1nnc(CCSCCc2nnc(NC(=O)[C@H](O)c3ccccc3)s2)s1)c1ccccc1
Show InChI InChI=1S/C24H24N6O4S3/c31-19(15-7-3-1-4-8-15)21(33)25-23-29-27-17(36-23)11-13-35-14-12-18-28-30-24(37-18)26-22(34)20(32)16-9-5-2-6-10-16/h1-10,19-20,31-32H,11-14H2,(H,25,29,33)(H,26,30,34)/t19-,20-/m1/s1
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n/an/a 1.00E+4n/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 US8604016 (2013)


BindingDB Entry DOI: 10.7270/Q2CC0ZBW
More data for this
Ligand-Target Pair