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Patent code US9693992

Compile Data Set for Download or QSAR

Found 251 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
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM160416
PNG
(US9040714, 121 | US9693992, 121)
Show SMILES COCCOc1cc(O)c(C=O)c2oc(=O)cc(C)c12
Show InChI InChI=1S/C14H14O6/c1-8-5-12(17)20-14-9(7-15)10(16)6-11(13(8)14)19-4-3-18-2/h5-7,16H,3-4H2,1-2H3
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n/an/a<100n/a<1.00E+4n/an/an/an/a



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))
BDBM160417
PNG
(US9040714, 127 | US9693992, 127)
Show SMILES COCCOCCc1c(C)c2cc(OC)c(O)c(C=O)c2oc1=O
Show InChI InChI=1S/C17H20O7/c1-10-11(4-5-23-7-6-21-2)17(20)24-16-12(10)8-14(22-3)15(19)13(16)9-18/h8-9,19H,4-7H2,1-3H3
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n/an/a<100n/a<1.00E+4n/an/an/an/a



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))
BDBM160425
PNG
(US9040714, 137 | US9693992, 137)
Show SMILES COCc1c(C)c(=O)oc2c(C=O)c(O)ccc12
Show InChI InChI=1S/C13H12O5/c1-7-10(6-17-2)8-3-4-11(15)9(5-14)12(8)18-13(7)16/h3-5,15H,6H2,1-2H3
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n/an/a<100n/a<1.00E+4n/an/an/an/a



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))
BDBM160439
PNG
(US9040714, 153 | US9693992, 153)
Show SMILES COCCOc1cc(O)c(C=O)c2oc(=O)c(CCC(=O)N3CCOCC3)c(C)c12
Show InChI InChI=1S/C21H25NO8/c1-13-14(3-4-18(25)22-5-7-28-8-6-22)21(26)30-20-15(12-23)16(24)11-17(19(13)20)29-10-9-27-2/h11-12,24H,3-10H2,1-2H3
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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))
BDBM160446
PNG
(US9040714, 168 | US9693992, 168)
Show SMILES COc1cc2c(C)c(CC(=O)N3CCN(C)CC3)c(=O)oc2c(C=O)c1O
Show InChI InChI=1S/C19H22N2O6/c1-11-12-8-15(26-3)17(24)14(10-22)18(12)27-19(25)13(11)9-16(23)21-6-4-20(2)5-7-21/h8,10,24H,4-7,9H2,1-3H3
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n/an/a<100n/a<1.00E+4n/an/an/an/a



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))
BDBM160447
PNG
(US9040714, 169 | US9693992, 169)
Show SMILES CCNC(=O)Cc1c(C)c2cc(OC)c(O)c(C=O)c2oc1=O
Show InChI InChI=1S/C16H17NO6/c1-4-17-13(19)6-10-8(2)9-5-12(22-3)14(20)11(7-18)15(9)23-16(10)21/h5,7,20H,4,6H2,1-3H3,(H,17,19)
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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))
BDBM160465
PNG
(US9040714, 194 | US9693992, 194)
Show SMILES COCCNC(=O)CCc1c(C)c2c(OC)cc(O)c(C=O)c2oc1=O
Show InChI InChI=1S/C18H21NO7/c1-10-11(4-5-15(22)19-6-7-24-2)18(23)26-17-12(9-20)13(21)8-14(25-3)16(10)17/h8-9,21H,4-7H2,1-3H3,(H,19,22)
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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))
BDBM160470
PNG
(US9040714, 200 | US9693992, 200)
Show SMILES COc1cc2c(C)c(C(C)C)c(=O)oc2c(C=O)c1O
Show InChI InChI=1S/C15H16O5/c1-7(2)12-8(3)9-5-11(19-4)13(17)10(6-16)14(9)20-15(12)18/h5-7,17H,1-4H3
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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))
BDBM160379
PNG
(US9040714, 47 | US9693992, 47)
Show SMILES CC1CCN(CC1)C(=O)c1ccc(cc1)-c1ccc2c(C=O)c(O)ccc2n1
Show InChI InChI=1S/C23H22N2O3/c1-15-10-12-25(13-11-15)23(28)17-4-2-16(3-5-17)20-7-6-18-19(14-26)22(27)9-8-21(18)24-20/h2-9,14-15,27H,10-13H2,1H3
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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))
BDBM160382
PNG
(US9040714, 50 | US9693992, 50)
Show SMILES Oc1ccc2nc(ccc2c1C=O)N1CCC(C1)NC(=O)CN1CCOCC1
Show InChI InChI=1S/C20H24N4O4/c25-13-16-15-1-4-19(22-17(15)2-3-18(16)26)24-6-5-14(11-24)21-20(27)12-23-7-9-28-10-8-23/h1-4,13-14,26H,5-12H2,(H,21,27)
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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))
BDBM160385
PNG
(US9040714, 53 | US9693992, 53)
Show SMILES CN1CCN(CC1)C(=O)c1ccc(cc1)-c1nc2ccc(O)c(C=O)c2s1
Show InChI InChI=1S/C20H19N3O3S/c1-22-8-10-23(11-9-22)20(26)14-4-2-13(3-5-14)19-21-16-6-7-17(25)15(12-24)18(16)27-19/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))
BDBM65666
PNG
(US9693992, 65)
Show SMILES COC(=O)c1cccc(c1)-c1nc2ccc(O)c(C=O)c2[nH]1
Show InChI InChI=1S/C16H12N2O4/c1-22-16(21)10-4-2-3-9(7-10)15-17-12-5-6-13(20)11(8-19)14(12)18-15/h2-8,20H,1H3,(H,17,18)
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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))
BDBM160400
PNG
(US9040714, 69 | US9693992, 69)
Show SMILES Cc1c(CCC(=O)N2CCOCC2)c(=O)oc2c(C=O)c(O)ccc12
Show InChI InChI=1S/C18H19NO6/c1-11-12-2-4-15(21)14(10-20)17(12)25-18(23)13(11)3-5-16(22)19-6-8-24-9-7-19/h2,4,10,21H,3,5-9H2,1H3
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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))
BDBM160405
PNG
(US9040714, 109 | US9693992, 109)
Show SMILES Cc1nc(sc1C(=O)NCCN1CCOCC1)-c1cc2ccc(O)c(C=O)c2oc1=O
Show InChI InChI=1S/C21H21N3O6S/c1-12-18(19(27)22-4-5-24-6-8-29-9-7-24)31-20(23-12)14-10-13-2-3-16(26)15(11-25)17(13)30-21(14)28/h2-3,10-11,26H,4-9H2,1H3,(H,22,27)
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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))
BDBM160408
PNG
(US9040714, 112 | US9693992, 112)
Show SMILES CN1CCN(CC1)C(=O)\C=C\c1c(C)c2ccc(O)c(C=O)c2oc1=O
Show InChI InChI=1S/C19H20N2O5/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/h3-6,11,23H,7-10H2,1-2H3/b6-4+
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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))
BDBM160409
PNG
(US9040714, 113 | US9693992, 113)
Show SMILES COc1cc2c(C)c(-c3ccc(nc3)N3CCN(C)CC3)c(=O)oc2c(C=O)c1O
Show InChI InChI=1S/C22H23N3O5/c1-13-15-10-17(29-3)20(27)16(12-26)21(15)30-22(28)19(13)14-4-5-18(23-11-14)25-8-6-24(2)7-9-25/h4-5,10-12,27H,6-9H2,1-3H3
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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))
BDBM160420
PNG
(US9040714, 130 | US9693992, 130)
Show SMILES CN1CCN(CC1)C(=O)Cc1c(C)c2ccc(O)c(C=O)c2oc1=O
Show InChI InChI=1S/C18H20N2O5/c1-11-12-3-4-15(22)14(10-21)17(12)25-18(24)13(11)9-16(23)20-7-5-19(2)6-8-20/h3-4,10,22H,5-9H2,1-2H3
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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))
BDBM160455
PNG
(US9040714, 177 | US9693992, 177)
Show SMILES COc1cc(O)c(C=O)c2oc(=O)c(CC(=O)N3CCOCC3)c(C)c12
Show InChI InChI=1S/C18H19NO7/c1-10-11(7-15(22)19-3-5-25-6-4-19)18(23)26-17-12(9-20)13(21)8-14(24-2)16(10)17/h8-9,21H,3-7H2,1-2H3
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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))
BDBM160459
PNG
(US9040714, 182 | US9693992, 182)
Show SMILES COCCOc1cc2c(C)c(CCC(=O)N3CCN(C)CC3)c(=O)oc2c(C=O)c1O
Show InChI InChI=1S/C22H28N2O7/c1-14-15(4-5-19(26)24-8-6-23(2)7-9-24)22(28)31-21-16(14)12-18(30-11-10-29-3)20(27)17(21)13-25/h12-13,27H,4-11H2,1-3H3
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n/an/a<100n/a<1.00E+4n/an/an/an/a



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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n/an/a<100n/a<1.00E+4n/an/an/an/a



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))
BDBM160388
PNG
(US9040714, 56 | US9693992, 56)
Show SMILES CN1CCN(CC1)C(=O)c1ccc(s1)-c1nc2ccc(O)c(C=O)c2s1
Show InChI InChI=1S/C18H17N3O3S2/c1-20-6-8-21(9-7-20)18(24)15-5-4-14(25-15)17-19-12-2-3-13(23)11(10-22)16(12)26-17/h2-5,10,23H,6-9H2,1H3
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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))
BDBM160393
PNG
(US9040714, 61 | US9693992, 61)
Show SMILES Oc1ccc2nc([nH]c2c1C=O)-c1ccc(cc1)C(=O)N1CCOCC1
Show InChI InChI=1S/C19H17N3O4/c23-11-14-16(24)6-5-15-17(14)21-18(20-15)12-1-3-13(4-2-12)19(25)22-7-9-26-10-8-22/h1-6,11,24H,7-10H2,(H,20,21)
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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))
BDBM160407
PNG
(US9040714, 111 | US9693992, 111)
Show SMILES COc1cc2c(C)c(-c3ccc(cc3)C(=O)N3CCN(C)CC3)c(=O)oc2c(C=O)c1O
Show InChI InChI=1S/C24H24N2O6/c1-14-17-12-19(31-3)21(28)18(13-27)22(17)32-24(30)20(14)15-4-6-16(7-5-15)23(29)26-10-8-25(2)9-11-26/h4-7,12-13,28H,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))
BDBM160434
PNG
(US9040714, 148 | US9693992, 148)
Show SMILES COc1cc2c(C)c(CC(=O)NCCO)c(=O)oc2c(C=O)c1O
Show InChI InChI=1S/C16H17NO7/c1-8-9-5-12(23-2)14(21)11(7-19)15(9)24-16(22)10(8)6-13(20)17-3-4-18/h5,7,18,21H,3-4,6H2,1-2H3,(H,17,20)
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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))
BDBM160466
PNG
(US9040714, 196 | US9693992, 196)
Show SMILES COc1cc(O)c(C=O)c2oc(=O)c(CCC(=O)NCCN3CCOCC3)c(C)c12
Show InChI InChI=1S/C21H26N2O7/c1-13-14(3-4-18(26)22-5-6-23-7-9-29-10-8-23)21(27)30-20-15(12-24)16(25)11-17(28-2)19(13)20/h11-12,25H,3-10H2,1-2H3,(H,22,26)
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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))
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))
BDBM160369
PNG
(US9040714, 37 | US9693992, 37)
Show SMILES Cc1nc(sc1C(=O)NCCN1CCOCC1)N1CCc2c(C1)ccc(O)c2C=O
Show InChI InChI=1S/C21H26N4O4S/c1-14-19(20(28)22-5-7-24-8-10-29-11-9-24)30-21(23-14)25-6-4-16-15(12-25)2-3-18(27)17(16)13-26/h2-3,13,27H,4-12H2,1H3,(H,22,28)
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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))
BDBM65645
PNG
(US9693992, 49)
Show SMILES Oc1ccc2nc(ccc2c1C=O)-c1cccc(c1)C(=O)N1CCCC1
Show InChI InChI=1S/C21H18N2O3/c24-13-17-16-6-7-18(22-19(16)8-9-20(17)25)14-4-3-5-15(12-14)21(26)23-10-1-2-11-23/h3-9,12-13,25H,1-2,10-11H2
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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))
BDBM160383
PNG
(US9040714, 51 | US9693992, 51)
Show SMILES CC(=O)NC1CCN(C1)c1ccc2c(C=O)c(O)ccc2n1
Show InChI InChI=1S/C16H17N3O3/c1-10(21)17-11-6-7-19(8-11)16-5-2-12-13(9-20)15(22)4-3-14(12)18-16/h2-5,9,11,22H,6-8H2,1H3,(H,17,21)
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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))
BDBM160387
PNG
(US9040714, 55 | US9693992, 55)
Show SMILES CC(C)N1CCN(CC1)c1nc2ccc(O)c(C=O)c2s1
Show InChI InChI=1S/C15H19N3O2S/c1-10(2)17-5-7-18(8-6-17)15-16-12-3-4-13(20)11(9-19)14(12)21-15/h3-4,9-10,20H,5-8H2,1-2H3
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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))
BDBM160389
PNG
(US9040714, 57 | US9693992, 57)
Show SMILES CC1CCN(CC1)C(=O)c1ccc(cc1)-c1nc2ccc(O)c(C=O)c2s1
Show InChI InChI=1S/C21H20N2O3S/c1-13-8-10-23(11-9-13)21(26)15-4-2-14(3-5-15)20-22-17-6-7-18(25)16(12-24)19(17)27-20/h2-7,12-13,25H,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))
BDBM160401
PNG
(US9040714, 70 | US9693992, 70)
Show SMILES Cc1c(CC(O)=O)c(=O)oc2c(C=O)c(O)ccc12
Show InChI InChI=1S/C13H10O6/c1-6-7-2-3-10(15)9(5-14)12(7)19-13(18)8(6)4-11(16)17/h2-3,5,15H,4H2,1H3,(H,16,17)
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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))
BDBM160404
PNG
(US9040714, 108 | US9693992, 108)
Show SMILES CN1CCN(CC1)C(=O)c1sc(nc1C)-c1cc2ccc(O)c(C=O)c2oc1=O
Show InChI InChI=1S/C20H19N3O5S/c1-11-17(19(26)23-7-5-22(2)6-8-23)29-18(21-11)13-9-12-3-4-15(25)14(10-24)16(12)28-20(13)27/h3-4,9-10,25H,5-8H2,1-2H3
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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))
BDBM160419
PNG
(US9040714, 129 | US9693992, 129)
Show SMILES Cc1c(CC(=O)N2CCOCC2)c(=O)oc2c(C=O)c(O)ccc12
Show InChI InChI=1S/C17H17NO6/c1-10-11-2-3-14(20)13(9-19)16(11)24-17(22)12(10)8-15(21)18-4-6-23-7-5-18/h2-3,9,20H,4-8H2,1H3
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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))
BDBM160445
PNG
(US9040714, 167 | US9693992, 167)
Show SMILES COc1cc2c(C)c(CC(=O)N3CCOCC3)c(=O)oc2c(C=O)c1O
Show InChI InChI=1S/C18H19NO7/c1-10-11-7-14(24-2)16(22)13(9-20)17(11)26-18(23)12(10)8-15(21)19-3-5-25-6-4-19/h7,9,22H,3-6,8H2,1-2H3
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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))
BDBM160449
PNG
(US9040714, 171 | US9693992, 171)
Show SMILES COCCNC(=O)CCc1c(C)c2cc(OC)c(O)c(C=O)c2oc1=O
Show InChI InChI=1S/C18H21NO7/c1-10-11(4-5-15(21)19-6-7-24-2)18(23)26-17-12(10)8-14(25-3)16(22)13(17)9-20/h8-9,22H,4-7H2,1-3H3,(H,19,21)
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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))
BDBM160450
PNG
(US9040714, 172 | US9693992, 172)
Show SMILES COc1cc2c(C)c(CCC(=O)N3CCOCC3)c(=O)oc2c(C=O)c1O
Show InChI InChI=1S/C19H21NO7/c1-11-12(3-4-16(22)20-5-7-26-8-6-20)19(24)27-18-13(11)9-15(25-2)17(23)14(18)10-21/h9-10,23H,3-8H2,1-2H3
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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))
BDBM160452
PNG
(US9040714, 174 | US9693992, 174)
Show SMILES CCNC(=O)CCc1c(C)c2cc(OC)c(O)c(C=O)c2oc1=O
Show InChI InChI=1S/C17H19NO6/c1-4-18-14(20)6-5-10-9(2)11-7-13(23-3)15(21)12(8-19)16(11)24-17(10)22/h7-8,21H,4-6H2,1-3H3,(H,18,20)
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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))
BDBM160454
PNG
(US9040714, 176 | US9693992, 176)
Show SMILES COCCNC(=O)Cc1c(C)c2c(OC)cc(O)c(C=O)c2oc1=O
Show InChI InChI=1S/C17H19NO7/c1-9-10(6-14(21)18-4-5-23-2)17(22)25-16-11(8-19)12(20)7-13(24-3)15(9)16/h7-8,20H,4-6H2,1-3H3,(H,18,21)
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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))
BDBM160457
PNG
(US9040714, 180 | US9693992, 180)
Show SMILES COc1cc(O)c(C=O)c2oc(=O)c(CC(=O)NCCN(C)C)c(C)c12
Show InChI InChI=1S/C18H22N2O6/c1-10-11(7-15(23)19-5-6-20(2)3)18(24)26-17-12(9-21)13(22)8-14(25-4)16(10)17/h8-9,22H,5-7H2,1-4H3,(H,19,23)
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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))
BDBM160461
PNG
(US9040714, 185 | US9693992, 185)
Show SMILES COCCOc1cc2c(C)c(CCC(=O)NCCN(C)C)c(=O)oc2c(C=O)c1O
Show InChI InChI=1S/C21H28N2O7/c1-13-14(5-6-18(25)22-7-8-23(2)3)21(27)30-20-15(13)11-17(29-10-9-28-4)19(26)16(20)12-24/h11-12,26H,5-10H2,1-4H3,(H,22,25)
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n/an/a<100n/a>1.00E+4n/an/an/an/a



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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n/an/a<100n/a>1.00E+4n/an/an/an/a



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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n/an/a<100n/a>1.00E+4n/an/an/an/a



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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n/an/a<100n/a>1.00E+4n/an/an/an/a



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))
BDBM160378
PNG
(US9040714, 46 | US9693992, 46)
Show SMILES Oc1ccc2nc(ccc2c1C=O)-c1cccc(c1)C(=O)NCCN1CCOCC1
Show InChI InChI=1S/C23H23N3O4/c27-15-19-18-4-5-20(25-21(18)6-7-22(19)28)16-2-1-3-17(14-16)23(29)24-8-9-26-10-12-30-13-11-26/h1-7,14-15,28H,8-13H2,(H,24,29)
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n/an/a<100n/a<1.00E+4n/an/an/an/a



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))
BDBM160380
PNG
(US9040714, 48 | US9693992, 48)
Show SMILES Oc1ccc2nc(ccc2c1C=O)-c1ccc(cc1)C(=O)N1CCCC1
Show InChI InChI=1S/C21H18N2O3/c24-13-17-16-7-8-18(22-19(16)9-10-20(17)25)14-3-5-15(6-4-14)21(26)23-11-1-2-12-23/h3-10,13,25H,1-2,11-12H2
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n/an/a<100n/a<1.00E+4n/an/an/an/a



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))
BDBM160394
PNG
(US9040714, 62 | US9693992, 62)
Show SMILES CN1CCN(CC1)C(=O)c1ccc(cc1)-c1nc2ccc(O)c(C=O)c2[nH]1
Show InChI InChI=1S/C20H20N4O3/c1-23-8-10-24(11-9-23)20(27)14-4-2-13(3-5-14)19-21-16-6-7-17(26)15(12-25)18(16)22-19/h2-7,12,26H,8-11H2,1H3,(H,21,22)
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n/an/a<100n/a>1.00E+4n/an/an/an/a



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))
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/an/an/a



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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* indicates data uncertainty>20%