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Compile Data Set for Download or QSAR

Found 436 hits of ec50 data for polymerid = 5923   
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
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM111358
PNG
(US8614253, 29-18 | US9241942, 29-18)
Show SMILES NC(=O)c1cccc(c1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C18H13NO3/c19-18(22)14-3-1-2-11(9-14)12-4-6-15-13(8-12)5-7-17(21)16(15)10-20/h1-10,21H,(H2,19,22)
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n/an/an/an/a 1.00E+3n/an/an/an/a



MannKind Corporation

US Patent


Assay Description
Initial cell-based XBP-1 mRNA splicing assays confirmed IRE-1α inhibition with several potent 5-bromo and 6 bromo o-vanillins. HEK293 cells were...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM111316
PNG
(US8614253, 43-76 | US9241942, 27-76)
Show SMILES COC(=O)c1cccc(c1)-c1ccc(O)c(C=O)c1
Show InChI InChI=1S/C15H12O4/c1-19-15(18)12-4-2-3-10(7-12)11-5-6-14(17)13(8-11)9-16/h2-9,17H,1H3
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MannKind Corporation

US Patent


Assay Description
Initial cell-based XBP-1 mRNA splicing assays confirmed IRE-1α inhibition with several potent 5-bromo and 6 bromo o-vanillins. HEK293 cells were...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM111346
PNG
(US8614253, 29-6 | US8614253, 42-4 | US9241942, 42-...)
Show SMILES CN(C)C(=O)c1ccc(cc1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C20H17NO3/c1-21(2)20(24)14-5-3-13(4-6-14)15-7-9-17-16(11-15)8-10-19(23)18(17)12-22/h3-12,23H,1-2H3
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MannKind Corporation

US Patent


Assay Description
Initial cell-based XBP-1 mRNA splicing assays confirmed IRE-1α inhibition with several potent 5-bromo and 6 bromo o-vanillins. HEK293 cells were...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM111359
PNG
(US8614253, 29-19 | US9241942, 29-19 | US9493435, 1...)
Show SMILES CN(C)C(=O)c1cccc(c1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C20H17NO3/c1-21(2)20(24)16-5-3-4-13(11-16)14-6-8-17-15(10-14)7-9-19(23)18(17)12-22/h3-12,23H,1-2H3
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MannKind Corporation

US Patent


Assay Description
Initial cell-based XBP-1 mRNA splicing assays confirmed IRE-1α inhibition with several potent 5-bromo and 6 bromo o-vanillins. HEK293 cells were...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM111346
PNG
(US8614253, 29-6 | US8614253, 42-4 | US9241942, 42-...)
Show SMILES CN(C)C(=O)c1ccc(cc1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C20H17NO3/c1-21(2)20(24)14-5-3-13(4-6-14)15-7-9-17-16(11-15)8-10-19(23)18(17)12-22/h3-12,23H,1-2H3
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MannKind Corporation

US Patent


Assay Description
Initial cell-based XBP-1 mRNA splicing assays confirmed IRE-1α inhibition with several potent 5-bromo and 6 bromo o-vanillins. HEK293 cells were...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM111343
PNG
(US8614253, 29-3 | US9241942, 29-3)
Show SMILES Oc1ccc2cc(ccc2c1C=O)-c1cncnc1
Show InChI InChI=1S/C15H10N2O2/c18-8-14-13-3-1-10(12-6-16-9-17-7-12)5-11(13)2-4-15(14)19/h1-9,19H
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MannKind Corporation

US Patent


Assay Description
Initial cell-based XBP-1 mRNA splicing assays confirmed IRE-1α inhibition with several potent 5-bromo and 6 bromo o-vanillins. HEK293 cells were...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM111342
PNG
(US8614253, 29-2 | US9241942, 29-2)
Show SMILES Oc1ccc2cc(ccc2c1C=O)-c1cccnc1
Show InChI InChI=1S/C16H11NO2/c18-10-15-14-5-3-11(13-2-1-7-17-9-13)8-12(14)4-6-16(15)19/h1-10,19H
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n/an/an/an/a 5.00E+3n/an/an/an/a



MannKind Corporation

US Patent


Assay Description
Initial cell-based XBP-1 mRNA splicing assays confirmed IRE-1α inhibition with several potent 5-bromo and 6 bromo o-vanillins. HEK293 cells were...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM111368
PNG
(US8614253, 32-4 | US9241942, 32-4 | US9493435, 168)
Show SMILES CC(C)NC(=O)c1cccc(c1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C21H19NO3/c1-13(2)22-21(25)17-5-3-4-14(11-17)15-6-8-18-16(10-15)7-9-20(24)19(18)12-23/h3-13,24H,1-2H3,(H,22,25)
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MannKind Corporation

US Patent


Assay Description
Initial cell-based XBP-1 mRNA splicing assays confirmed IRE-1α inhibition with several potent 5-bromo and 6 bromo o-vanillins. HEK293 cells were...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM111344
PNG
(US8614253, 29-4 | US9241942, 29-4)
Show SMILES Oc1ccc2cc(ccc2c1C=O)-c1cccc(c1)C(=O)N1CCOCC1
Show InChI InChI=1S/C22H19NO4/c24-14-20-19-6-4-16(12-17(19)5-7-21(20)25)15-2-1-3-18(13-15)22(26)23-8-10-27-11-9-23/h1-7,12-14,25H,8-11H2
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MannKind Corporation

US Patent


Assay Description
Initial cell-based XBP-1 mRNA splicing assays confirmed IRE-1α inhibition with several potent 5-bromo and 6 bromo o-vanillins. HEK293 cells were...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM111382
PNG
(US8614253, 34-1 | US9241942, 34-1)
Show SMILES Oc1ccc2ncccc2c1C=O
Show InChI InChI=1S/C10H7NO2/c12-6-8-7-2-1-5-11-9(7)3-4-10(8)13/h1-6,13H
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n/an/an/an/a 7.00E+3n/an/an/an/a



MannKind Corporation

US Patent


Assay Description
Initial cell-based XBP-1 mRNA splicing assays confirmed IRE-1α inhibition with several potent 5-bromo and 6 bromo o-vanillins. HEK293 cells were...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM111347
PNG
(US8614253, 29-7 | US9241942, 29-7)
Show SMILES Oc1ccc2cc(ccc2c1C=O)-c1ccoc1
Show InChI InChI=1S/C15H10O3/c16-8-14-13-3-1-10(12-5-6-18-9-12)7-11(13)2-4-15(14)17/h1-9,17H
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MannKind Corporation

US Patent


Assay Description
Initial cell-based XBP-1 mRNA splicing assays confirmed IRE-1α inhibition with several potent 5-bromo and 6 bromo o-vanillins. HEK293 cells were...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM111341
PNG
(US8614253, 29-1 | US9241942, 29-1)
Show SMILES COC(=O)c1cccc(c1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C19H14O4/c1-23-19(22)15-4-2-3-12(10-15)13-5-7-16-14(9-13)6-8-18(21)17(16)11-20/h2-11,21H,1H3
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MannKind Corporation

US Patent


Assay Description
Initial cell-based XBP-1 mRNA splicing assays confirmed IRE-1α inhibition with several potent 5-bromo and 6 bromo o-vanillins. HEK293 cells were...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM111345
PNG
(US8614253, 29-5 | US9241942, 29-5)
Show SMILES OC(=O)c1cccc(c1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C18H12O4/c19-10-16-15-6-4-12(8-13(15)5-7-17(16)20)11-2-1-3-14(9-11)18(21)22/h1-10,20H,(H,21,22)
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MannKind Corporation

US Patent


Assay Description
Initial cell-based XBP-1 mRNA splicing assays confirmed IRE-1α inhibition with several potent 5-bromo and 6 bromo o-vanillins. HEK293 cells were...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM111348
PNG
(US8614253, 29-8 | US9241942, 29-8)
Show SMILES OCc1ccc(cc1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C18H14O3/c19-10-12-1-3-13(4-2-12)14-5-7-16-15(9-14)6-8-18(21)17(16)11-20/h1-9,11,19,21H,10H2
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MannKind Corporation

US Patent


Assay Description
Initial cell-based XBP-1 mRNA splicing assays confirmed IRE-1α inhibition with several potent 5-bromo and 6 bromo o-vanillins. HEK293 cells were...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM111357
PNG
(US8614253, 29-17 | US9241942, 29-17)
Show SMILES NC(=O)c1ccc(cc1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C18H13NO3/c19-18(22)12-3-1-11(2-4-12)13-5-7-15-14(9-13)6-8-17(21)16(15)10-20/h1-10,21H,(H2,19,22)
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MannKind Corporation

US Patent


Assay Description
Initial cell-based XBP-1 mRNA splicing assays confirmed IRE-1α inhibition with several potent 5-bromo and 6 bromo o-vanillins. HEK293 cells were...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM111364
PNG
(US8614253, 31-2 | US8614253, 32-14 | US8614253, 42...)
Show SMILES OC(=O)c1cccc(n1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C17H11NO4/c19-9-13-12-6-4-11(8-10(12)5-7-16(13)20)14-2-1-3-15(18-14)17(21)22/h1-9,20H,(H,21,22)
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MannKind Corporation

US Patent


Assay Description
Initial cell-based XBP-1 mRNA splicing assays confirmed IRE-1α inhibition with several potent 5-bromo and 6 bromo o-vanillins. HEK293 cells were...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM111384
PNG
(US8614253, 34-3 | US9241942, 34-3)
Show SMILES Oc1ccc2cccnc2c1C=O
Show InChI InChI=1S/C10H7NO2/c12-6-8-9(13)4-3-7-2-1-5-11-10(7)8/h1-6,13H
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n/an/an/an/a 1.00E+4n/an/an/an/a



MannKind Corporation

US Patent


Assay Description
Initial cell-based XBP-1 mRNA splicing assays confirmed IRE-1α inhibition with several potent 5-bromo and 6 bromo o-vanillins. HEK293 cells were...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM111428
PNG
(US8614253, 42-3 | US9241942, 42-3)
Show SMILES Oc1ccc2cc(Br)ccc2c1C=O
Show InChI InChI=1S/C11H7BrO2/c12-8-2-3-9-7(5-8)1-4-11(14)10(9)6-13/h1-6,14H
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MannKind Corporation

US Patent


Assay Description
Initial cell-based XBP-1 mRNA splicing assays confirmed IRE-1α inhibition with several potent 5-bromo and 6 bromo o-vanillins. HEK293 cells were...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM160334
PNG
(US9040714, 1 | US9693992, 1)
Show SMILES Cc1c(Br)c(=O)oc2c(C=O)c(O)ccc12
Show InChI InChI=1S/C11H7BrO4/c1-5-6-2-3-8(14)7(4-13)10(6)16-11(15)9(5)12/h2-4,14H,1H3
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n/an/a<100n/a<1.00E+4n/an/a7.530



MannKind Corporation

US Patent


Assay Description
A fusion protein comprising glutathione S transferase (GST) and human IRE-1α (GST-IRE-1α) obtained from a 500 ml baculovirus-infected ins...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM160335
PNG
(US9040714, 2 | US9693992, 2)
Show SMILES CN1CCN(CC1)C(=O)c1ccc(cc1)-c1c(C)c2ccc(O)c(C=O)c2oc1=O
Show InChI InChI=1S/C23H22N2O5/c1-14-17-7-8-19(27)18(13-26)21(17)30-23(29)20(14)15-3-5-16(6-4-15)22(28)25-11-9-24(2)10-12-25/h3-8,13,27H,9-12H2,1-2H3
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MannKind Corporation

US Patent


Assay Description
A fusion protein comprising glutathione S transferase (GST) and human IRE-1α (GST-IRE-1α) obtained from a 500 ml baculovirus-infected ins...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM51439
PNG
(BDBM160336 | US9040714, 116 | US9693992, 116)
Show SMILES Cc1c(-c2ccc(cc2)C(=O)NCCN2CCOCC2)c(=O)oc2c(C=O)c(O)ccc12
Show InChI InChI=1S/C24H24N2O6/c1-15-18-6-7-20(28)19(14-27)22(18)32-24(30)21(15)16-2-4-17(5-3-16)23(29)25-8-9-26-10-12-31-13-11-26/h2-7,14,28H,8-13H2,1H3,(H,25,29)
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n/an/a<100n/a<1.00E+4n/an/a7.530



MannKind Corporation

US Patent


Assay Description
A fusion protein comprising glutathione S transferase (GST) and human IRE-1α (GST-IRE-1α) obtained from a 500 ml baculovirus-infected ins...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM160337
PNG
(US9040714, 4 | US9693992, 4)
Show SMILES CCN(CC)CCc1c(C)c2ccc(O)c(C=O)c2oc1=O
Show InChI InChI=1S/C17H21NO4/c1-4-18(5-2)9-8-13-11(3)12-6-7-15(20)14(10-19)16(12)22-17(13)21/h6-7,10,20H,4-5,8-9H2,1-3H3
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MannKind Corporation

US Patent


Assay Description
A fusion protein comprising glutathione S transferase (GST) and human IRE-1α (GST-IRE-1α) obtained from a 500 ml baculovirus-infected ins...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM160338
PNG
(US9040714, 5 | US9693992, 5)
Show SMILES CC(C)c1cc(=O)oc2c(C=O)c(O)ccc12
Show InChI InChI=1S/C13H12O4/c1-7(2)9-5-12(16)17-13-8(9)3-4-11(15)10(13)6-14/h3-7,15H,1-2H3
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MannKind Corporation

US Patent


Assay Description
A fusion protein comprising glutathione S transferase (GST) and human IRE-1α (GST-IRE-1α) obtained from a 500 ml baculovirus-infected ins...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM160339
PNG
(US9040714, 6 | US9693992, 6)
Show SMILES COc1cc2c(C)c(Br)c(=O)oc2c(C=O)c1O
Show InChI InChI=1S/C12H9BrO5/c1-5-6-3-8(17-2)10(15)7(4-14)11(6)18-12(16)9(5)13/h3-4,15H,1-2H3
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MannKind Corporation

US Patent


Assay Description
A fusion protein comprising glutathione S transferase (GST) and human IRE-1α (GST-IRE-1α) obtained from a 500 ml baculovirus-infected ins...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM160340
PNG
(US9040714, 7 | US9693992, 7)
Show SMILES Oc1ccc2cc(-c3ccc(Br)cc3)c(=O)oc2c1C=O
Show InChI InChI=1S/C16H9BrO4/c17-11-4-1-9(2-5-11)12-7-10-3-6-14(19)13(8-18)15(10)21-16(12)20/h1-8,19H
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MannKind Corporation

US Patent


Assay Description
A fusion protein comprising glutathione S transferase (GST) and human IRE-1α (GST-IRE-1α) obtained from a 500 ml baculovirus-infected ins...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM160341
PNG
(US9040714, 8 | US9693992, 8)
Show SMILES OC(=O)c1cc2ccc(O)c(C=O)c2oc1=O
Show InChI InChI=1S/C11H6O6/c12-4-7-8(13)2-1-5-3-6(10(14)15)11(16)17-9(5)7/h1-4,13H,(H,14,15)
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MannKind Corporation

US Patent


Assay Description
A fusion protein comprising glutathione S transferase (GST) and human IRE-1α (GST-IRE-1α) obtained from a 500 ml baculovirus-infected ins...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM160342
PNG
(US9040714, 9 | US9693992, 9)
Show SMILES Cc1c(Br)c(=O)oc2c(C=O)c(O)c(F)cc12
Show InChI InChI=1S/C11H6BrFO4/c1-4-5-2-7(13)9(15)6(3-14)10(5)17-11(16)8(4)12/h2-3,15H,1H3
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MannKind Corporation

US Patent


Assay Description
A fusion protein comprising glutathione S transferase (GST) and human IRE-1α (GST-IRE-1α) obtained from a 500 ml baculovirus-infected ins...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM160343
PNG
(US9040714, 10 | US9693992, 10)
Show SMILES CN1CCN(CC1)C(=O)c1cccc(c1)-c1c(C)c2ccc(O)c(C=O)c2oc1=O
Show InChI InChI=1S/C23H22N2O5/c1-14-17-6-7-19(27)18(13-26)21(17)30-23(29)20(14)15-4-3-5-16(12-15)22(28)25-10-8-24(2)9-11-25/h3-7,12-13,27H,8-11H2,1-2H3
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MannKind Corporation

US Patent


Assay Description
A fusion protein comprising glutathione S transferase (GST) and human IRE-1α (GST-IRE-1α) obtained from a 500 ml baculovirus-infected ins...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM160344
PNG
(US9040714, 11 | US9693992, 11)
Show SMILES Cc1c(-c2cccc(c2)C(=O)NCCN2CCOCC2)c(=O)oc2c(C=O)c(O)ccc12
Show InChI InChI=1S/C24H24N2O6/c1-15-18-5-6-20(28)19(14-27)22(18)32-24(30)21(15)16-3-2-4-17(13-16)23(29)25-7-8-26-9-11-31-12-10-26/h2-6,13-14,28H,7-12H2,1H3,(H,25,29)
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MannKind Corporation

US Patent


Assay Description
A fusion protein comprising glutathione S transferase (GST) and human IRE-1α (GST-IRE-1α) obtained from a 500 ml baculovirus-infected ins...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM160345
PNG
(US9040714, 12 | US9693992, 12)
Show SMILES Cc1c(-c2ccc(cc2)C(=O)N2CCOCC2)c(=O)oc2c(C=O)c(O)ccc12
Show InChI InChI=1S/C22H19NO6/c1-13-16-6-7-18(25)17(12-24)20(16)29-22(27)19(13)14-2-4-15(5-3-14)21(26)23-8-10-28-11-9-23/h2-7,12,25H,8-11H2,1H3
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MannKind Corporation

US Patent


Assay Description
A fusion protein comprising glutathione S transferase (GST) and human IRE-1α (GST-IRE-1α) obtained from a 500 ml baculovirus-infected ins...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM160346
PNG
(US9040714, 13 | US9693992, 13)
Show SMILES Cc1c(-c2cccc(c2)C(=O)N2CCOCC2)c(=O)oc2c(C=O)c(O)ccc12
Show InChI InChI=1S/C22H19NO6/c1-13-16-5-6-18(25)17(12-24)20(16)29-22(27)19(13)14-3-2-4-15(11-14)21(26)23-7-9-28-10-8-23/h2-6,11-12,25H,7-10H2,1H3
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MannKind Corporation

US Patent


Assay Description
A fusion protein comprising glutathione S transferase (GST) and human IRE-1α (GST-IRE-1α) obtained from a 500 ml baculovirus-infected ins...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM160347
PNG
(US9040714, 14 | US9693992, 14)
Show SMILES CN1CCN(CC1)c1ccc(cn1)-c1c(C)c2ccc(O)c(C=O)c2oc1=O
Show InChI InChI=1S/C21H21N3O4/c1-13-15-4-5-17(26)16(12-25)20(15)28-21(27)19(13)14-3-6-18(22-11-14)24-9-7-23(2)8-10-24/h3-6,11-12,26H,7-10H2,1-2H3
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MannKind Corporation

US Patent


Assay Description
A fusion protein comprising glutathione S transferase (GST) and human IRE-1α (GST-IRE-1α) obtained from a 500 ml baculovirus-infected ins...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM65602
PNG
(US9693992, 15)
Show SMILES CN1CCN(CC1)C(=O)CCc1c(C)c2ccc(O)c(C=O)c2oc1=O
Show InChI InChI=1S/C19H22N2O5/c1-12-13-3-5-16(23)15(11-22)18(13)26-19(25)14(12)4-6-17(24)21-9-7-20(2)8-10-21/h3,5,11,23H,4,6-10H2,1-2H3
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MannKind Corporation

US Patent


Assay Description
A fusion protein comprising glutathione S transferase (GST) and human IRE-1α (GST-IRE-1α) obtained from a 500 ml baculovirus-infected ins...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM160348
PNG
(US9040714, 16 | US9693992, 16)
Show SMILES Cc1c(Cc2ccccc2)c(=O)oc2c(C=O)c(O)c(O)cc12
Show InChI InChI=1S/C18H14O5/c1-10-12-8-15(20)16(21)14(9-19)17(12)23-18(22)13(10)7-11-5-3-2-4-6-11/h2-6,8-9,20-21H,7H2,1H3
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MannKind Corporation

US Patent


Assay Description
A fusion protein comprising glutathione S transferase (GST) and human IRE-1α (GST-IRE-1α) obtained from a 500 ml baculovirus-infected ins...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM160349
PNG
(US9040714, 17 | US9693992, 17)
Show SMILES CN(C)C(=O)c1ccc(cc1)-c1c(C)c2ccc(O)c(C=O)c2oc1=O
Show InChI InChI=1S/C20H17NO5/c1-11-14-8-9-16(23)15(10-22)18(14)26-20(25)17(11)12-4-6-13(7-5-12)19(24)21(2)3/h4-10,23H,1-3H3
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MannKind Corporation

US Patent


Assay Description
A fusion protein comprising glutathione S transferase (GST) and human IRE-1α (GST-IRE-1α) obtained from a 500 ml baculovirus-infected ins...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM160350
PNG
(US9040714, 18 | US9693992, 18)
Show SMILES Cc1c(-c2ccc(cc2)C(=O)N2CCCC2)c(=O)oc2c(C=O)c(O)ccc12
Show InChI InChI=1S/C22H19NO5/c1-13-16-8-9-18(25)17(12-24)20(16)28-22(27)19(13)14-4-6-15(7-5-14)21(26)23-10-2-3-11-23/h4-9,12,25H,2-3,10-11H2,1H3
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MannKind Corporation

US Patent


Assay Description
A fusion protein comprising glutathione S transferase (GST) and human IRE-1α (GST-IRE-1α) obtained from a 500 ml baculovirus-infected ins...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM160351
PNG
(US9040714, 19 | US9693992, 19)
Show SMILES CC1CCN(CC1)C(=O)c1ccc(cc1)-c1c(C)c2ccc(O)c(C=O)c2oc1=O
Show InChI InChI=1S/C24H23NO5/c1-14-9-11-25(12-10-14)23(28)17-5-3-16(4-6-17)21-15(2)18-7-8-20(27)19(13-26)22(18)30-24(21)29/h3-8,13-14,27H,9-12H2,1-2H3
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MannKind Corporation

US Patent


Assay Description
A fusion protein comprising glutathione S transferase (GST) and human IRE-1α (GST-IRE-1α) obtained from a 500 ml baculovirus-infected ins...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM160352
PNG
(US9040714, 20 | US9693992, 20)
Show SMILES CN(C)C(=O)c1cccc(c1)-c1c(C)c2ccc(O)c(C=O)c2oc1=O
Show InChI InChI=1S/C20H17NO5/c1-11-14-7-8-16(23)15(10-22)18(14)26-20(25)17(11)12-5-4-6-13(9-12)19(24)21(2)3/h4-10,23H,1-3H3
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MannKind Corporation

US Patent


Assay Description
A fusion protein comprising glutathione S transferase (GST) and human IRE-1α (GST-IRE-1α) obtained from a 500 ml baculovirus-infected ins...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM160353
PNG
(US9040714, 21 | US9693992, 21)
Show SMILES Cc1c(-c2cccc(c2)C(=O)N2CCCC2)c(=O)oc2c(C=O)c(O)ccc12
Show InChI InChI=1S/C22H19NO5/c1-13-16-7-8-18(25)17(12-24)20(16)28-22(27)19(13)14-5-4-6-15(11-14)21(26)23-9-2-3-10-23/h4-8,11-12,25H,2-3,9-10H2,1H3
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MannKind Corporation

US Patent


Assay Description
A fusion protein comprising glutathione S transferase (GST) and human IRE-1α (GST-IRE-1α) obtained from a 500 ml baculovirus-infected ins...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM160354
PNG
(US9040714, 22 | US9693992, 22)
Show SMILES Cc1cc(=O)oc2c(C=O)c(O)c(Cl)cc12
Show InChI InChI=1S/C11H7ClO4/c1-5-2-9(14)16-11-6(5)3-8(12)10(15)7(11)4-13/h2-4,15H,1H3
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MannKind Corporation

US Patent


Assay Description
A fusion protein comprising glutathione S transferase (GST) and human IRE-1α (GST-IRE-1α) obtained from a 500 ml baculovirus-infected ins...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM160355
PNG
(US9040714, 23 | US9693992, 23)
Show SMILES Cc1cc(=O)oc2c(C=O)c(O)c(F)cc12
Show InChI InChI=1S/C11H7FO4/c1-5-2-9(14)16-11-6(5)3-8(12)10(15)7(11)4-13/h2-4,15H,1H3
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MannKind Corporation

US Patent


Assay Description
A fusion protein comprising glutathione S transferase (GST) and human IRE-1α (GST-IRE-1α) obtained from a 500 ml baculovirus-infected ins...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM160356
PNG
(US9040714, 24 | US9693992, 24)
Show SMILES CN1CCN(CC1)c1ccc(cc1)-c1c(C)c2cc(F)c(O)c(C=O)c2oc1=O
Show InChI InChI=1S/C22H21FN2O4/c1-13-16-11-18(23)20(27)17(12-26)21(16)29-22(28)19(13)14-3-5-15(6-4-14)25-9-7-24(2)8-10-25/h3-6,11-12,27H,7-10H2,1-2H3
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MannKind Corporation

US Patent


Assay Description
A fusion protein comprising glutathione S transferase (GST) and human IRE-1α (GST-IRE-1α) obtained from a 500 ml baculovirus-infected ins...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM160357
PNG
(US9040714, 25 | US9693992, 25)
Show SMILES COc1cc2c(C)c(-c3ccc(cc3)N3CCN(C)CC3)c(=O)oc2c(C=O)c1O
Show InChI InChI=1S/C23H24N2O5/c1-14-17-12-19(29-3)21(27)18(13-26)22(17)30-23(28)20(14)15-4-6-16(7-5-15)25-10-8-24(2)9-11-25/h4-7,12-13,27H,8-11H2,1-3H3
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MannKind Corporation

US Patent


Assay Description
A fusion protein comprising glutathione S transferase (GST) and human IRE-1α (GST-IRE-1α) obtained from a 500 ml baculovirus-infected ins...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM160358
PNG
(US9040714, 26 | US9693992, 26)
Show SMILES COc1cc2c(C)c(-c3ccc(cc3)C(=O)N3CCOCC3)c(=O)oc2c(C=O)c1O
Show InChI InChI=1S/C23H21NO7/c1-13-16-11-18(29-2)20(26)17(12-25)21(16)31-23(28)19(13)14-3-5-15(6-4-14)22(27)24-7-9-30-10-8-24/h3-6,11-12,26H,7-10H2,1-2H3
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MannKind Corporation

US Patent


Assay Description
A fusion protein comprising glutathione S transferase (GST) and human IRE-1α (GST-IRE-1α) obtained from a 500 ml baculovirus-infected ins...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM160359
PNG
(US9040714, 27 | US9693992, 27)
Show SMILES Cc1nc(sc1C(=O)N1CCOCC1)-c1cc2ccc(O)c(C=O)c2oc1=O
Show InChI InChI=1S/C19H16N2O6S/c1-10-16(18(24)21-4-6-26-7-5-21)28-17(20-10)12-8-11-2-3-14(23)13(9-22)15(11)27-19(12)25/h2-3,8-9,23H,4-7H2,1H3
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n/an/a<100n/a<1.00E+4n/an/a7.530



MannKind Corporation

US Patent


Assay Description
A fusion protein comprising glutathione S transferase (GST) and human IRE-1α (GST-IRE-1α) obtained from a 500 ml baculovirus-infected ins...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM160360
PNG
(US9040714, 28 | US9693992, 28)
Show SMILES Oc1ccc2CN(Cc3ccccc3)CCc2c1C=O
Show InChI InChI=1S/C17H17NO2/c19-12-16-15-8-9-18(10-13-4-2-1-3-5-13)11-14(15)6-7-17(16)20/h1-7,12,20H,8-11H2
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n/an/a<1.00E+4n/a>1.00E+4n/an/a7.530



MannKind Corporation

US Patent


Assay Description
A fusion protein comprising glutathione S transferase (GST) and human IRE-1α (GST-IRE-1α) obtained from a 500 ml baculovirus-infected ins...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM160365
PNG
(US9040714, 33 | US9693992, 33)
Show SMILES CN1CCN(CC1)C(=O)c1cnc(s1)N1CCc2c(C1)ccc(O)c2C=O
Show InChI InChI=1S/C19H22N4O3S/c1-21-6-8-22(9-7-21)18(26)17-10-20-19(27-17)23-5-4-14-13(11-23)2-3-16(25)15(14)12-24/h2-3,10,12,25H,4-9,11H2,1H3
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n/an/a<1.00E+4n/a>1.00E+4n/an/a7.530



MannKind Corporation

US Patent


Assay Description
A fusion protein comprising glutathione S transferase (GST) and human IRE-1α (GST-IRE-1α) obtained from a 500 ml baculovirus-infected ins...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM160366
PNG
(US9040714, 34 | US9693992, 34)
Show SMILES Cc1nc(sc1C(=O)N1CCOCC1)N1CCc2c(C1)ccc(O)c2C=O
Show InChI InChI=1S/C19H21N3O4S/c1-12-17(18(25)21-6-8-26-9-7-21)27-19(20-12)22-5-4-14-13(10-22)2-3-16(24)15(14)11-23/h2-3,11,24H,4-10H2,1H3
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n/an/a<1.00E+4n/a>1.00E+4n/an/a7.530



MannKind Corporation

US Patent


Assay Description
A fusion protein comprising glutathione S transferase (GST) and human IRE-1α (GST-IRE-1α) obtained from a 500 ml baculovirus-infected ins...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM160367
PNG
(US9040714, 35 | US9693992, 35)
Show SMILES Cc1nc(sc1C(=O)NC1CCNCC1)N1CCc2c(C1)ccc(O)c2C=O
Show InChI InChI=1S/C20H24N4O3S/c1-12-18(19(27)23-14-4-7-21-8-5-14)28-20(22-12)24-9-6-15-13(10-24)2-3-17(26)16(15)11-25/h2-3,11,14,21,26H,4-10H2,1H3,(H,23,27)
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n/an/a<100n/a>1.00E+4n/an/a7.530



MannKind Corporation

US Patent


Assay Description
A fusion protein comprising glutathione S transferase (GST) and human IRE-1α (GST-IRE-1α) obtained from a 500 ml baculovirus-infected ins...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM160368
PNG
(US9040714, 36 | US9693992, 36)
Show SMILES CN1CCC(CC1)NC(=O)c1sc(nc1C)N1CCc2c(C1)ccc(O)c2C=O
Show InChI InChI=1S/C21H26N4O3S/c1-13-19(20(28)23-15-5-8-24(2)9-6-15)29-21(22-13)25-10-7-16-14(11-25)3-4-18(27)17(16)12-26/h3-4,12,15,27H,5-11H2,1-2H3,(H,23,28)
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n/an/a<1.00E+3n/a>1.00E+4n/an/a7.530



MannKind Corporation

US Patent


Assay Description
A fusion protein comprising glutathione S transferase (GST) and human IRE-1α (GST-IRE-1α) obtained from a 500 ml baculovirus-infected ins...


Citation and Details
More data for this
Ligand-Target Pair
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