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Patent code US9493435

Compile Data Set for Download or QSAR
Found 182 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257068
PNG
(US9493435, 86)
Show SMILES CN1CCN(CC1)C1CCN(CC1)c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C21H27N3O2/c1-22-10-12-24(13-11-22)17-6-8-23(9-7-17)18-3-4-19-16(14-18)2-5-21(26)20(19)15-25/h2-5,14-15,17,26H,6-13H2,1H3
PDB

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UniChem
US Patent
n/an/a<10n/an/an/an/an/an/a



MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257067
PNG
(US9493435, 85)
Show SMILES CN(C)C1CCN(CC1)c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C18H22N2O2/c1-19(2)14-7-9-20(10-8-14)15-4-5-16-13(11-15)3-6-18(22)17(16)12-21/h3-6,11-12,14,22H,7-10H2,1-2H3
PDB

UniProtKB/SwissProt
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DrugBank
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PC cid
PC sid
UniChem
US Patent
n/an/a<10n/an/an/an/an/an/a



MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM256987
PNG
(US9493435, 4)
Show SMILES COCCNC(=O)c1cccc(c1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C21H19NO4/c1-26-10-9-22-21(25)17-4-2-3-14(12-17)15-5-7-18-16(11-15)6-8-20(24)19(18)13-23/h2-8,11-13,24H,9-10H2,1H3,(H,22,25)
PDB

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UniChem
US Patent
n/an/a<100n/an/an/an/an/an/a



MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM256991
PNG
(US9493435, 8)
Show SMILES CNC(=O)c1cccc(c1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C19H15NO3/c1-20-19(23)15-4-2-3-12(10-15)13-5-7-16-14(9-13)6-8-18(22)17(16)11-21/h2-11,22H,1H3,(H,20,23)
PDB

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UniChem
US Patent
n/an/a<100n/an/an/an/an/an/a



MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257004
PNG
(US9493435, 21)
Show SMILES Cc1cc(sc1-c1ccc2c(CO)c(O)ccc2c1)C(O)=O
Show InChI InChI=1S/C17H14O4S/c1-9-6-15(17(20)21)22-16(9)11-2-4-12-10(7-11)3-5-14(19)13(12)8-18/h2-7,18-19H,8H2,1H3,(H,20,21)
PDB

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US Patent
n/an/a 100n/an/an/an/an/an/a



MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257055
PNG
(US9493435, 73)
Show SMILES Oc1ccc2cc(ccc2c1C=O)-c1ccc(s1)C(=O)NC1CCNC1
Show InChI InChI=1S/C20H18N2O3S/c23-11-16-15-3-1-13(9-12(15)2-4-17(16)24)18-5-6-19(26-18)20(25)22-14-7-8-21-10-14/h1-6,9,11,14,21,24H,7-8,10H2,(H,22,25)
PDB

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US Patent
n/an/a<100n/an/an/an/an/an/a



MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257062
PNG
(US9493435, 80)
Show SMILES CN1CCN(CC1)c1ncc(cn1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C20H20N4O2/c1-23-6-8-24(9-7-23)20-21-11-16(12-22-20)14-2-4-17-15(10-14)3-5-19(26)18(17)13-25/h2-5,10-13,26H,6-9H2,1H3
PDB

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UniChem
US Patent
n/an/a<100n/an/an/an/an/an/a



MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257103
PNG
(US9493435, 121)
Show SMILES CN1CCN(CC1)c1ncc(s1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C19H19N3O2S/c1-21-6-8-22(9-7-21)19-20-11-18(25-19)14-2-4-15-13(10-14)3-5-17(24)16(15)12-23/h2-5,10-12,24H,6-9H2,1H3
PDB

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UniChem
US Patent
n/an/a<100n/an/an/an/an/an/a



MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM256984
PNG
(US9493435, 1)
Show SMILES Oc1ccc2cc(ccc2c1C=O)-c1cccc(c1)C(=O)N1CCCC1
Show InChI InChI=1S/C22H19NO3/c24-14-20-19-8-6-16(12-17(19)7-9-21(20)25)15-4-3-5-18(13-15)22(26)23-10-1-2-11-23/h3-9,12-14,25H,1-2,10-11H2
PDB

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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257014
PNG
(US9493435, 31)
Show SMILES CN(C)C(=O)\C=C\c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C16H15NO3/c1-17(2)16(20)8-4-11-3-6-13-12(9-11)5-7-15(19)14(13)10-18/h3-10,19H,1-2H3/b8-4+
PDB

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US Patent
n/an/a<100n/an/an/an/an/an/a



MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257019
PNG
(US9493435, 36)
Show SMILES Oc1ccc2cc(ccc2c1C=O)-c1ccc(s1)C(=O)NCCN1CCOCC1
Show InChI InChI=1S/C22H22N2O4S/c25-14-18-17-3-1-16(13-15(17)2-4-19(18)26)20-5-6-21(29-20)22(27)23-7-8-24-9-11-28-12-10-24/h1-6,13-14,26H,7-12H2,(H,23,27)
PDB

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UniChem
US Patent
n/an/a<100n/an/an/an/an/an/a



MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257025
PNG
(US9493435, 42)
Show SMILES Oc1ccc2cc(ccc2c1C=O)-c1ccc(s1)C(=O)NCC1CCCNC1
Show InChI InChI=1S/C22H22N2O3S/c25-13-18-17-5-3-16(10-15(17)4-6-19(18)26)20-7-8-21(28-20)22(27)24-12-14-2-1-9-23-11-14/h3-8,10,13-14,23,26H,1-2,9,11-12H2,(H,24,27)
PDB

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UniChem
US Patent
n/an/a<100n/an/an/an/an/an/a



MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257031
PNG
(US9493435, 48)
Show SMILES Oc1ccc2cc(ccc2c1C=O)-c1ccc(cc1)C(=O)NC1CCNCC1
Show InChI InChI=1S/C23H22N2O3/c26-14-21-20-7-5-17(13-18(20)6-8-22(21)27)15-1-3-16(4-2-15)23(28)25-19-9-11-24-12-10-19/h1-8,13-14,19,24,27H,9-12H2,(H,25,28)
PDB

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US Patent
n/an/a<100n/an/an/an/an/an/a



MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257047
PNG
(US9493435, 65)
Show SMILES CN1CCN(CC1)C(=O)c1sc(nc1C)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C21H21N3O3S/c1-13-19(21(27)24-9-7-23(2)8-10-24)28-20(22-13)15-3-5-16-14(11-15)4-6-18(26)17(16)12-25/h3-6,11-12,26H,7-10H2,1-2H3
PDB

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UniChem
US Patent
n/an/a<100n/an/an/an/an/an/a



MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257107
PNG
(US9493435, 125)
Show SMILES COCCNCCNC(=O)c1ccc(cn1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C22H23N3O4/c1-29-11-10-23-8-9-24-22(28)20-6-3-17(13-25-20)15-2-5-18-16(12-15)4-7-21(27)19(18)14-26/h2-7,12-14,23,27H,8-11H2,1H3,(H,24,28)
PDB

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UniChem
US Patent
n/an/a<100n/an/an/an/an/an/a



MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257124
PNG
(US9493435, 142)
Show SMILES Cc1nc(sc1C(=O)NCCN1CCOCC1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C22H23N3O4S/c1-14-20(21(28)23-6-7-25-8-10-29-11-9-25)30-22(24-14)16-2-4-17-15(12-16)3-5-19(27)18(17)13-26/h2-5,12-13,27H,6-11H2,1H3,(H,23,28)
PDB

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UniChem
US Patent
n/an/a<100n/an/an/an/an/an/a



MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257017
PNG
(US9493435, 34)
Show SMILES CN1CCN(CC1)C(=O)c1cc(C)c(s1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C22H22N2O3S/c1-14-11-20(22(27)24-9-7-23(2)8-10-24)28-21(14)16-3-5-17-15(12-16)4-6-19(26)18(17)13-25/h3-6,11-13,26H,7-10H2,1-2H3
PDB

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UniChem
US Patent
n/an/a<100n/an/an/an/an/an/a



MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257042
PNG
(US9493435, 60)
Show SMILES CN1CCN(CC1)C(=O)c1csc(n1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C20H19N3O3S/c1-22-6-8-23(9-7-22)20(26)17-12-27-19(21-17)14-2-4-15-13(10-14)3-5-18(25)16(15)11-24/h2-5,10-12,25H,6-9H2,1H3
PDB

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UniChem
US Patent
n/an/a<100n/an/an/an/an/an/a



MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257044
PNG
(US9493435, 62)
Show SMILES CN1CCCCC1CNC(=O)c1ccc(s1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C23H24N2O3S/c1-25-11-3-2-4-17(25)13-24-23(28)22-10-9-21(29-22)16-5-7-18-15(12-16)6-8-20(27)19(18)14-26/h5-10,12,14,17,27H,2-4,11,13H2,1H3,(H,24,28)
PDB

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US Patent
n/an/a<100n/an/an/an/an/an/a



MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257053
PNG
(US9493435, 71)
Show SMILES Oc1ccc2cc(ccc2c1C=O)-c1ccc(o1)C(=O)NCCN1CCOCC1
Show InChI InChI=1S/C22H22N2O5/c25-14-18-17-3-1-16(13-15(17)2-4-19(18)26)20-5-6-21(29-20)22(27)23-7-8-24-9-11-28-12-10-24/h1-6,13-14,26H,7-12H2,(H,23,27)
PDB

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UniChem
US Patent
n/an/a<100n/an/an/an/an/an/a



MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257054
PNG
(US9493435, 72)
Show SMILES CN(C)CCNC(=O)c1ccc(s1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C20H20N2O3S/c1-22(2)10-9-21-20(25)19-8-7-18(26-19)14-3-5-15-13(11-14)4-6-17(24)16(15)12-23/h3-8,11-12,24H,9-10H2,1-2H3,(H,21,25)
PDB

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UniChem
US Patent
n/an/a<100n/an/an/an/an/an/a



MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257060
PNG
(US9493435, 78)
Show SMILES CN1CCCC(C1)NC(=O)c1ccc(s1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C22H22N2O3S/c1-24-10-2-3-16(12-24)23-22(27)21-9-8-20(28-21)15-4-6-17-14(11-15)5-7-19(26)18(17)13-25/h4-9,11,13,16,26H,2-3,10,12H2,1H3,(H,23,27)
PDB

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UniChem
US Patent
n/an/a<100n/an/an/an/an/an/a



MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257121
PNG
(US9493435, 139)
Show SMILES Oc1ccc2cc(ccc2c1C=O)-c1ccc(cc1)C(=O)NCCN1CCOCC1
Show InChI InChI=1S/C24H24N2O4/c27-16-22-21-7-5-19(15-20(21)6-8-23(22)28)17-1-3-18(4-2-17)24(29)25-9-10-26-11-13-30-14-12-26/h1-8,15-16,28H,9-14H2,(H,25,29)
PDB

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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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM111370
PNG
(US8614253, 32-6 | US9241942, 32-6 | US9493435, 180)
Show SMILES CC(C)NC(=O)c1cccc(n1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C20H18N2O3/c1-12(2)21-20(25)18-5-3-4-17(22-18)14-6-8-15-13(10-14)7-9-19(24)16(15)11-23/h3-12,24H,1-2H3,(H,21,25)
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MannKing Corporation

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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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257008
PNG
(US9493435, 25)
Show SMILES Cc1cc(sc1-c1ccc2c(C=O)c(O)ccc2c1)C(=O)N1CCOCC1
Show InChI InChI=1S/C21H19NO4S/c1-13-10-19(21(25)22-6-8-26-9-7-22)27-20(13)15-2-4-16-14(11-15)3-5-18(24)17(16)12-23/h2-5,10-12,24H,6-9H2,1H3
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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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257020
PNG
(US9493435, 37)
Show SMILES Oc1ccc2cc(ccc2c1C=O)-c1ccc(s1)C(=O)NCCCN1CCOCC1
Show InChI InChI=1S/C23H24N2O4S/c26-15-19-18-4-2-17(14-16(18)3-5-20(19)27)21-6-7-22(30-21)23(28)24-8-1-9-25-10-12-29-13-11-25/h2-7,14-15,27H,1,8-13H2,(H,24,28)
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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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257026
PNG
(US9493435, 43)
Show SMILES Oc1ccc2cc(ccc2c1C=O)-c1ccc(s1)C(=O)NCC1CCNCC1
Show InChI InChI=1S/C22H22N2O3S/c25-13-18-17-3-1-16(11-15(17)2-4-19(18)26)20-5-6-21(28-20)22(27)24-12-14-7-9-23-10-8-14/h1-6,11,13-14,23,26H,7-10,12H2,(H,24,27)
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MannKing Corporation

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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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257030
PNG
(US9493435, 47)
Show SMILES Oc1ccc2cc(ccc2c1C=O)-c1ccc(s1)C(=O)NC1CCCNC1
Show InChI InChI=1S/C21H20N2O3S/c24-12-17-16-5-3-14(10-13(16)4-6-18(17)25)19-7-8-20(27-19)21(26)23-15-2-1-9-22-11-15/h3-8,10,12,15,22,25H,1-2,9,11H2,(H,23,26)
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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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257057
PNG
(US9493435, 75)
Show SMILES Oc1ccc2cc(ccc2c1C=O)-c1ccc(s1)C(=O)N1CC2CC1CN2
Show InChI InChI=1S/C21H18N2O3S/c24-11-17-16-3-1-13(7-12(16)2-4-18(17)25)19-5-6-20(27-19)21(26)23-10-14-8-15(23)9-22-14/h1-7,11,14-15,22,25H,8-10H2
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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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257123
PNG
(US9493435, 141)
Show SMILES COCCNC(=O)c1sc(nc1C)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C19H18N2O4S/c1-11-17(18(24)20-7-8-25-2)26-19(21-11)13-3-5-14-12(9-13)4-6-16(23)15(14)10-22/h3-6,9-10,23H,7-8H2,1-2H3,(H,20,24)
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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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257160
PNG
(US9493435, 182)
Show SMILES OC(=O)c1ccc(Oc2ccc3c(C=O)c(O)ccc3c2)cc1
Show InChI InChI=1S/C18H12O5/c19-10-16-15-7-6-14(9-12(15)3-8-17(16)20)23-13-4-1-11(2-5-13)18(21)22/h1-10,20H,(H,21,22)
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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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM256999
PNG
(US9493435, 16)
Show SMILES CCCNC(=O)c1cccc(n1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C20H18N2O3/c1-2-10-21-20(25)18-5-3-4-17(22-18)14-6-8-15-13(11-14)7-9-19(24)16(15)12-23/h3-9,11-12,24H,2,10H2,1H3,(H,21,25)
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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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257016
PNG
(US9493435, 33)
Show SMILES CN(C)C(=O)c1cc(C)c(s1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C19H17NO3S/c1-11-8-17(19(23)20(2)3)24-18(11)13-4-6-14-12(9-13)5-7-16(22)15(14)10-21/h4-10,22H,1-3H3
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MannKing Corporation

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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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257091
PNG
(US9493435, 109)
Show SMILES Cc1nc(sc1C(=O)N1CCOCC1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C20H18N2O4S/c1-12-18(20(25)22-6-8-26-9-7-22)27-19(21-12)14-2-4-15-13(10-14)3-5-17(24)16(15)11-23/h2-5,10-11,24H,6-9H2,1H3
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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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257108
PNG
(US9493435, 126)
Show SMILES Oc1ccc2cc(ccc2c1C=O)-c1ccc(nc1)C(=O)NCCN1CCOCC1
Show InChI InChI=1S/C23H23N3O4/c27-15-20-19-4-1-16(13-17(19)3-6-22(20)28)18-2-5-21(25-14-18)23(29)24-7-8-26-9-11-30-12-10-26/h1-6,13-15,28H,7-12H2,(H,24,29)
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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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257150
PNG
(US9493435, 171)
Show SMILES Oc1ccc2cc(ccc2c1C=O)-c1ccc(o1)C(=O)NC1CCCNC1
Show InChI InChI=1S/C21H20N2O4/c24-12-17-16-5-3-14(10-13(16)4-6-18(17)25)19-7-8-20(27-19)21(26)23-15-2-1-9-22-11-15/h3-8,10,12,15,22,25H,1-2,9,11H2,(H,23,26)
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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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM256988
PNG
(US9493435, 5)
Show SMILES CN1CCN(CC1)C(=O)c1ccc(cc1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C23H22N2O3/c1-24-10-12-25(13-11-24)23(28)17-4-2-16(3-5-17)18-6-8-20-19(14-18)7-9-22(27)21(20)15-26/h2-9,14-15,27H,10-13H2,1H3
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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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257043
PNG
(US9493435, 61)
Show SMILES CN1CCN(CC1)C(=O)c1cnc(s1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C20H19N3O3S/c1-22-6-8-23(9-7-22)20(26)18-11-21-19(27-18)14-2-4-15-13(10-14)3-5-17(25)16(15)12-24/h2-5,10-12,25H,6-9H2,1H3
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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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257051
PNG
(US9493435, 69)
Show SMILES CN1CCCC(CNC(=O)c2ccc(s2)-c2ccc3c(C=O)c(O)ccc3c2)C1
Show InChI InChI=1S/C23H24N2O3S/c1-25-10-2-3-15(13-25)12-24-23(28)22-9-8-21(29-22)17-4-6-18-16(11-17)5-7-20(27)19(18)14-26/h4-9,11,14-15,27H,2-3,10,12-13H2,1H3,(H,24,28)
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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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257061
PNG
(US9493435, 79)
Show SMILES CN1CCC(C1)NC(=O)c1ccc(s1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C21H20N2O3S/c1-23-9-8-15(11-23)22-21(26)20-7-6-19(27-20)14-2-4-16-13(10-14)3-5-18(25)17(16)12-24/h2-7,10,12,15,25H,8-9,11H2,1H3,(H,22,26)
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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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM256989
PNG
(US9493435, 6)
Show SMILES COCCNC(=O)c1cccc(n1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C20H18N2O4/c1-26-10-9-21-20(25)18-4-2-3-17(22-18)14-5-7-15-13(11-14)6-8-19(24)16(15)12-23/h2-8,11-12,24H,9-10H2,1H3,(H,21,25)
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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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM256997
PNG
(US9493435, 14)
Show SMILES Oc1ccc2cc(ccc2c1C=O)-c1cccc(n1)C(=O)N1CCCC1
Show InChI InChI=1S/C21H18N2O3/c24-13-17-16-8-6-15(12-14(16)7-9-20(17)25)18-4-3-5-19(22-18)21(26)23-10-1-2-11-23/h3-9,12-13,25H,1-2,10-11H2
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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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257018
PNG
(US9493435, 35)
Show SMILES CN(C)C(=O)c1ccc(o1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C18H15NO4/c1-19(2)18(22)17-8-7-16(23-17)12-3-5-13-11(9-12)4-6-15(21)14(13)10-20/h3-10,21H,1-2H3
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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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257024
PNG
(US9493435, 41)
Show SMILES Oc1ccc2cc(ccc2c1C=O)-c1ccc(s1)C(=O)NCC1CCCCN1
Show InChI InChI=1S/C22H22N2O3S/c25-13-18-17-6-4-15(11-14(17)5-7-19(18)26)20-8-9-21(28-20)22(27)24-12-16-3-1-2-10-23-16/h4-9,11,13,16,23,26H,1-3,10,12H2,(H,24,27)
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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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257029
PNG
(US9493435, 46)
Show SMILES Oc1ccc2cc(ccc2c1C=O)-c1ccc(s1)C(=O)NC1CCNCC1
Show InChI InChI=1S/C21H20N2O3S/c24-12-17-16-3-1-14(11-13(16)2-4-18(17)25)19-5-6-20(27-19)21(26)23-15-7-9-22-10-8-15/h1-6,11-12,15,22,25H,7-10H2,(H,23,26)
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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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257032
PNG
(US9493435, 49)
Show SMILES Oc1ccc2cc(ccc2c1C=O)-c1ccc(cc1)C(=O)NC1CCCNC1
Show InChI InChI=1S/C23H22N2O3/c26-14-21-20-9-7-17(12-18(20)8-10-22(21)27)15-3-5-16(6-4-15)23(28)25-19-2-1-11-24-13-19/h3-10,12,14,19,24,27H,1-2,11,13H2,(H,25,28)
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MannKing Corporation

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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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257122
PNG
(US9493435, 140)
Show SMILES Cc1nc(sc1C(=O)N1CCCC1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C20H18N2O3S/c1-12-18(20(25)22-8-2-3-9-22)26-19(21-12)14-4-6-15-13(10-14)5-7-17(24)16(15)11-23/h4-7,10-11,24H,2-3,8-9H2,1H3
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MannKing Corporation

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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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM256996
PNG
(US9493435, 13)
Show SMILES CNC(=O)c1cccc(n1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C18H14N2O3/c1-19-18(23)16-4-2-3-15(20-16)12-5-7-13-11(9-12)6-8-17(22)14(13)10-21/h2-10,22H,1H3,(H,19,23)
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MannKing Corporation

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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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257002
PNG
(US9493435, 19)
Show SMILES OCc1c(O)ccc2cc(ccc12)-c1cc(ccc1Cl)C(O)=O
Show InChI InChI=1S/C18H13ClO4/c19-16-5-2-12(18(22)23)8-14(16)11-1-4-13-10(7-11)3-6-17(21)15(13)9-20/h1-8,20-21H,9H2,(H,22,23)
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MannKing Corporation

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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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257015
PNG
(US9493435, 32)
Show SMILES Oc1ccc2cc(\C=C\C(=O)N3CCOCC3)ccc2c1C=O
Show InChI InChI=1S/C18H17NO4/c20-12-16-15-4-1-13(11-14(15)3-5-17(16)21)2-6-18(22)19-7-9-23-10-8-19/h1-6,11-12,21H,7-10H2/b6-2+
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MannKing Corporation

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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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257126
PNG
(US9493435, 144)
Show SMILES Cc1nc(sc1C(=O)NC1CCNCC1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C21H21N3O3S/c1-12-19(20(27)24-15-6-8-22-9-7-15)28-21(23-12)14-2-4-16-13(10-14)3-5-18(26)17(16)11-25/h2-5,10-11,15,22,26H,6-9H2,1H3,(H,24,27)
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MannKing Corporation

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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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM111373
PNG
(US8614253, 32-9 | US8614253, 42-6 | US9241942, 32-...)
Show SMILES Oc1ccc2cc(ccc2c1C=O)-c1cccc(n1)C(=O)NCCN1CCOCC1
Show InChI InChI=1S/C23H23N3O4/c27-15-19-18-6-4-17(14-16(18)5-7-22(19)28)20-2-1-3-21(25-20)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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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257098
PNG
(BDBM257153 | US9493435, 116)
Show SMILES Oc1ccc2cc(ccc2c1C=O)N1CCC(CC1)NCc1cccnc1
Show InChI InChI=1S/C22H23N3O2/c26-15-21-20-5-4-19(12-17(20)3-6-22(21)27)25-10-7-18(8-11-25)24-14-16-2-1-9-23-13-16/h1-6,9,12-13,15,18,24,27H,7-8,10-11,14H2
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MannKing Corporation

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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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257135
PNG
(US9493435, 153)
Show SMILES Oc1ccc2cc(ccc2c1C=O)N1CCC(C1)NCc1ccccc1
Show InChI InChI=1S/C22H22N2O2/c25-15-21-20-8-7-19(12-17(20)6-9-22(21)26)24-11-10-18(14-24)23-13-16-4-2-1-3-5-16/h1-9,12,15,18,23,26H,10-11,13-14H2
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MannKing Corporation

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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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257079
PNG
(BDBM257151 | US9493435, 97)
Show SMILES Oc1ccc2cc(ccc2c1C=O)N1CCC(CC1)NCc1ccccc1
Show InChI InChI=1S/C23H24N2O2/c26-16-22-21-8-7-20(14-18(21)6-9-23(22)27)25-12-10-19(11-13-25)24-15-17-4-2-1-3-5-17/h1-9,14,16,19,24,27H,10-13,15H2
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MannKing Corporation

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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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257155
PNG
(US9493435, 176)
Show SMILES CN1CCN(CC(=O)NC2CCN(C2)c2ccc3c(C=O)c(O)ccc3c2)CC1
Show InChI InChI=1S/C22H28N4O3/c1-24-8-10-25(11-9-24)14-22(29)23-17-6-7-26(13-17)18-3-4-19-16(12-18)2-5-21(28)20(19)15-27/h2-5,12,15,17,28H,6-11,13-14H2,1H3,(H,23,29)
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MannKing Corporation

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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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257156
PNG
(US9493435, 177)
Show SMILES Oc1ccc2ccc(OS(=O)(=O)C(F)(F)F)cc2c1C=O
Show InChI InChI=1S/C12H7F3O5S/c13-12(14,15)21(18,19)20-8-3-1-7-2-4-11(17)10(6-16)9(7)5-8/h1-6,17H
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MannKing Corporation

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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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM256994
PNG
(US9493435, 11)
Show SMILES CNC(=O)c1ccc(s1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C17H13NO3S/c1-18-17(21)16-7-6-15(22-16)11-2-4-12-10(8-11)3-5-14(20)13(12)9-19/h2-9,20H,1H3,(H,18,21)
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MannKing Corporation

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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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257005
PNG
(US9493435, 22)
Show SMILES CCOC(=O)\C=C\c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C16H14O4/c1-2-20-16(19)8-4-11-3-6-13-12(9-11)5-7-15(18)14(13)10-17/h3-10,18H,2H2,1H3/b8-4+
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MannKing Corporation

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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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257012
PNG
(US9493435, 29)
Show SMILES Oc1ccc2cc(ccc2c1C=O)-c1ccc(cc1Cl)C(=O)N1CCOCC1
Show InChI InChI=1S/C22H18ClNO4/c23-20-12-16(22(27)24-7-9-28-10-8-24)2-5-18(20)15-1-4-17-14(11-15)3-6-21(26)19(17)13-25/h1-6,11-13,26H,7-10H2
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MannKing Corporation

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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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257021
PNG
(US9493435, 38)
Show SMILES CN1CCC(CC1)NC(=O)c1ccc(s1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C22H22N2O3S/c1-24-10-8-16(9-11-24)23-22(27)21-7-6-20(28-21)15-2-4-17-14(12-15)3-5-19(26)18(17)13-25/h2-7,12-13,16,26H,8-11H2,1H3,(H,23,27)
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MannKing Corporation

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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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257045
PNG
(US9493435, 63)
Show SMILES CN1CCN(CC1)C(=O)\C=C\c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C19H20N2O3/c1-20-8-10-21(11-9-20)19(24)7-3-14-2-5-16-15(12-14)4-6-18(23)17(16)13-22/h2-7,12-13,23H,8-11H2,1H3/b7-3+
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MannKing Corporation

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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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257050
PNG
(US9493435, 68)
Show SMILES CN1CCN(CC1)C(=O)c1ccnc(c1)-c1ccc2c(CO)c(O)ccc2c1
Show InChI InChI=1S/C22H23N3O3/c1-24-8-10-25(11-9-24)22(28)17-6-7-23-20(13-17)16-2-4-18-15(12-16)3-5-21(27)19(18)14-26/h2-7,12-13,26-27H,8-11,14H2,1H3
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MannKing Corporation

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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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257064
PNG
(US9493435, 82)
Show SMILES Oc1ccc2cc(ccc2c1C=O)N1CCC(CC1)N1CCOCC1
Show InChI InChI=1S/C20H24N2O3/c23-14-19-18-3-2-17(13-15(18)1-4-20(19)24)21-7-5-16(6-8-21)22-9-11-25-12-10-22/h1-4,13-14,16,24H,5-12H2
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MannKing Corporation

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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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257076
PNG
(US9493435, 94)
Show SMILES CS(=O)(=O)NC1CCCN(C1)c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C17H20N2O4S/c1-24(22,23)18-13-3-2-8-19(10-13)14-5-6-15-12(9-14)4-7-17(21)16(15)11-20/h4-7,9,11,13,18,21H,2-3,8,10H2,1H3
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257081
PNG
(US9493435, 99)
Show SMILES CC(C)N1CCN(CC1)c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C18H22N2O2/c1-13(2)19-7-9-20(10-8-19)15-4-5-16-14(11-15)3-6-18(22)17(16)12-21/h3-6,11-13,22H,7-10H2,1-2H3
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MannKing Corporation

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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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257084
PNG
(US9493435, 102)
Show SMILES OCc1c(O)ccc2cc(ccc12)-c1ccc(nc1)C(=O)N1CCOCC1
Show InChI InChI=1S/C21H20N2O4/c24-13-18-17-4-1-14(11-15(17)3-6-20(18)25)16-2-5-19(22-12-16)21(26)23-7-9-27-10-8-23/h1-6,11-12,24-25H,7-10,13H2
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MannKing Corporation

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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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257094
PNG
(US9493435, 112)
Show SMILES CN1CCN(CC1)C(=O)C1CCN(C1)c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C21H25N3O3/c1-22-8-10-23(11-9-22)21(27)16-6-7-24(13-16)17-3-4-18-15(12-17)2-5-20(26)19(18)14-25/h2-5,12,14,16,26H,6-11,13H2,1H3
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257096
PNG
(BDBM257152 | US9493435, 114)
Show SMILES Oc1ccc2cc(ccc2c1C=O)N1CCC(CC1)NCc1ccccn1
Show InChI InChI=1S/C22H23N3O2/c26-15-21-20-6-5-19(13-16(20)4-7-22(21)27)25-11-8-17(9-12-25)24-14-18-3-1-2-10-23-18/h1-7,10,13,15,17,24,27H,8-9,11-12,14H2
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257102
PNG
(US9493435, 120)
Show SMILES CN1CCN(CC1)c1nc(cs1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C19H19N3O2S/c1-21-6-8-22(9-7-21)19-20-17(12-25-19)14-2-4-15-13(10-14)3-5-18(24)16(15)11-23/h2-5,10-12,24H,6-9H2,1H3
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257104
PNG
(US9493435, 122)
Show SMILES CNC1CCN(C1)c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C16H18N2O2/c1-17-12-6-7-18(9-12)13-3-4-14-11(8-13)2-5-16(20)15(14)10-19/h2-5,8,10,12,17,20H,6-7,9H2,1H3
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257110
PNG
(US9493435, 128)
Show SMILES CN(C)C(=O)C1CCN(C1)c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C18H20N2O3/c1-19(2)18(23)13-7-8-20(10-13)14-4-5-15-12(9-14)3-6-17(22)16(15)11-21/h3-6,9,11,13,22H,7-8,10H2,1-2H3
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257119
PNG
(US9493435, 137)
Show SMILES Oc1ccc2ccc(cc2c1C=O)N1CCC(C1)N1CCCCC1
Show InChI InChI=1S/C20H24N2O2/c23-14-19-18-12-16(6-4-15(18)5-7-20(19)24)22-11-8-17(13-22)21-9-2-1-3-10-21/h4-7,12,14,17,24H,1-3,8-11,13H2
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257130
PNG
(US9493435, 148)
Show SMILES CN(Cc1ccncc1)C(=O)C1CCN(C1)c1ccc2ccc(O)c(C=O)c2c1
Show InChI InChI=1S/C23H23N3O3/c1-25(13-16-6-9-24-10-7-16)23(29)18-8-11-26(14-18)19-4-2-17-3-5-22(28)21(15-27)20(17)12-19/h2-7,9-10,12,15,18,28H,8,11,13-14H2,1H3
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257140
PNG
(US9493435, 158)
Show SMILES CN(Cc1ccncc1)C(=O)C1CCN(C1)c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C23H23N3O3/c1-25(13-16-6-9-24-10-7-16)23(29)18-8-11-26(14-18)19-3-4-20-17(12-19)2-5-22(28)21(20)15-27/h2-7,9-10,12,15,18,28H,8,11,13-14H2,1H3
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM256993
PNG
(BDBM257149 | US9493435, 10)
Show SMILES COCCNC(=O)c1ccc(cc1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C21H19NO4/c1-26-11-10-22-21(25)15-4-2-14(3-5-15)16-6-8-18-17(12-16)7-9-20(24)19(18)13-23/h2-9,12-13,24H,10-11H2,1H3,(H,22,25)
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257159
PNG
(US9493435, 181)
Show SMILES Oc1ccc2cc(Oc3ccc(cc3)C#N)ccc2c1C=O
Show InChI InChI=1S/C18H11NO3/c19-10-12-1-4-14(5-2-12)22-15-6-7-16-13(9-15)3-8-18(21)17(16)11-20/h1-9,11,21H
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM256990
PNG
(US9493435, 7)
Show SMILES CCN(CC)C(=O)c1cccc(n1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C21H20N2O3/c1-3-23(4-2)21(26)19-7-5-6-18(22-19)15-8-10-16-14(12-15)9-11-20(25)17(16)13-24/h5-13,25H,3-4H2,1-2H3
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257000
PNG
(US9493435, 17)
Show SMILES COc1ccc(CNC(=O)c2cccc(n2)-c2ccc3c(C=O)c(O)ccc3c2)cc1
Show InChI InChI=1S/C25H20N2O4/c1-31-19-9-5-16(6-10-19)14-26-25(30)23-4-2-3-22(27-23)18-7-11-20-17(13-18)8-12-24(29)21(20)15-28/h2-13,15,29H,14H2,1H3,(H,26,30)
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257001
PNG
(US9493435, 18)
Show SMILES OCc1c(O)ccc2ccc(cc12)-c1cncnc1
Show InChI InChI=1S/C15H12N2O2/c18-8-14-13-5-11(12-6-16-9-17-7-12)2-1-10(13)3-4-15(14)19/h1-7,9,18-19H,8H2
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257003
PNG
(US9493435, 20)
Show SMILES OCc1c(O)ccc2cc(ccc12)-c1ccc(cc1Cl)C(O)=O
Show InChI InChI=1S/C18H13ClO4/c19-16-8-12(18(22)23)2-5-14(16)11-1-4-13-10(7-11)3-6-17(21)15(13)9-20/h1-8,20-21H,9H2,(H,22,23)
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257010
PNG
(BDBM257013 | US9493435, 27)
Show SMILES CN1CCN(CC1)C(=O)c1ccc(Cl)c(c1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C23H21ClN2O3/c1-25-8-10-26(11-9-25)23(29)17-3-6-21(24)19(13-17)16-2-5-18-15(12-16)4-7-22(28)20(18)14-27/h2-7,12-14,28H,8-11H2,1H3
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257049
PNG
(US9493435, 67)
Show SMILES CN1CCN(CC1)C(=O)c1cncc(c1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C22H21N3O3/c1-24-6-8-25(9-7-24)22(28)18-11-17(12-23-13-18)15-2-4-19-16(10-15)3-5-21(27)20(19)14-26/h2-5,10-14,27H,6-9H2,1H3
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257052
PNG
(US9493435, 70)
Show SMILES OCc1c(O)ccc2cc(ccc12)-c1ccc(o1)C(=O)NC1CCCNC1
Show InChI InChI=1S/C21H22N2O4/c24-12-17-16-5-3-14(10-13(16)4-6-18(17)25)19-7-8-20(27-19)21(26)23-15-2-1-9-22-11-15/h3-8,10,15,22,24-25H,1-2,9,11-12H2,(H,23,26)
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257070
PNG
(US9493435, 88)
Show SMILES Oc1ccc2ccc(cc2c1C=O)N1CCOCC1
Show InChI InChI=1S/C15H15NO3/c17-10-14-13-9-12(16-5-7-19-8-6-16)3-1-11(13)2-4-15(14)18/h1-4,9-10,18H,5-8H2
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257074
PNG
(US9493435, 92)
Show SMILES CS(=O)(=O)N1CCN(CC1)c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C16H18N2O4S/c1-23(21,22)18-8-6-17(7-9-18)13-3-4-14-12(10-13)2-5-16(20)15(14)11-19/h2-5,10-11,20H,6-9H2,1H3
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257090
PNG
(BDBM257097 | US9493435, 108)
Show SMILES Oc1ccc2cc(ccc2c1C=O)N1CCCC(C1)NCc1ccccn1
Show InChI InChI=1S/C22H23N3O2/c26-15-21-20-8-7-19(12-16(20)6-9-22(21)27)25-11-3-5-18(14-25)24-13-17-4-1-2-10-23-17/h1-2,4,6-10,12,15,18,24,27H,3,5,11,13-14H2
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257118
PNG
(US9493435, 136)
Show SMILES OCc1c(O)ccc2ccc(cc12)N1CCC(C1)N1CCCCC1
Show InChI InChI=1S/C20H26N2O2/c23-14-19-18-12-16(6-4-15(18)5-7-20(19)24)22-11-8-17(13-22)21-9-2-1-3-10-21/h4-7,12,17,23-24H,1-3,8-11,13-14H2
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257125
PNG
(US9493435, 143)
Show SMILES CN1CCC(CC1)NC(=O)c1ccc(cc1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C24H24N2O3/c1-26-12-10-20(11-13-26)25-24(29)17-4-2-16(3-5-17)18-6-8-21-19(14-18)7-9-23(28)22(21)15-27/h2-9,14-15,20,28H,10-13H2,1H3,(H,25,29)
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257133
PNG
(US9493435, 151)
Show SMILES Oc1ccc2cc(ccc2c1C=O)-c1ccc(nc1)C(=O)NC1CCNCC1
Show InChI InChI=1S/C22H21N3O3/c26-13-19-18-4-1-14(11-15(18)3-6-21(19)27)16-2-5-20(24-12-16)22(28)25-17-7-9-23-10-8-17/h1-6,11-13,17,23,27H,7-10H2,(H,25,28)
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257134
PNG
(US9493435, 152)
Show SMILES CN(Cc1ccccc1)C1CCN(C1)c1ccc2ccc(O)c(C=O)c2c1
Show InChI InChI=1S/C23H24N2O2/c1-24(14-17-5-3-2-4-6-17)20-11-12-25(15-20)19-9-7-18-8-10-23(27)22(16-26)21(18)13-19/h2-10,13,16,20,27H,11-12,14-15H2,1H3
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257139
PNG
(US9493435, 157)
Show SMILES CN(C1CCN(C1)c1ccc2ccc(O)c(C=O)c2c1)C(C)=O
Show InChI InChI=1S/C18H20N2O3/c1-12(22)19(2)15-7-8-20(10-15)14-5-3-13-4-6-18(23)17(11-21)16(13)9-14/h3-6,9,11,15,23H,7-8,10H2,1-2H3
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257146
PNG
(US9493435, 164)
Show SMILES CN(C)CCNC(=O)COc1ccc2ccc(O)c(C=O)c2c1
Show InChI InChI=1S/C17H20N2O4/c1-19(2)8-7-18-17(22)11-23-13-5-3-12-4-6-16(21)15(10-20)14(12)9-13/h3-6,9-10,21H,7-8,11H2,1-2H3,(H,18,22)
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(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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n/an/a<1.00E+3n/an/an/an/an/an/a



MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257098
PNG
(BDBM257153 | US9493435, 116)
Show SMILES Oc1ccc2cc(ccc2c1C=O)N1CCC(CC1)NCc1cccnc1
Show InChI InChI=1S/C22H23N3O2/c26-15-21-20-5-4-19(12-17(20)3-6-22(21)27)25-10-7-18(8-11-25)24-14-16-2-1-9-23-13-16/h1-6,9,12-13,15,18,24,27H,7-8,10-11,14H2
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257157
PNG
(US9493435, 178)
Show SMILES OC(=O)COc1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C13H10O5/c14-6-11-10-3-2-9(18-7-13(16)17)5-8(10)1-4-12(11)15/h1-6,15H,7H2,(H,16,17)
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM256992
PNG
(US9493435, 9)
Show SMILES CNC(=O)c1ccc(cc1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C19H15NO3/c1-20-19(23)13-4-2-12(3-5-13)14-6-8-16-15(10-14)7-9-18(22)17(16)11-21/h2-11,22H,1H3,(H,20,23)
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257007
PNG
(US9493435, 24)
Show SMILES Oc1ccc2cc(ccc2c1C=O)-c1cc(ccc1Cl)C(=O)N1CCOCC1
Show InChI InChI=1S/C22H18ClNO4/c23-20-5-2-16(22(27)24-7-9-28-10-8-24)12-18(20)15-1-4-17-14(11-15)3-6-21(26)19(17)13-25/h1-6,11-13,26H,7-10H2
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257040
PNG
(US9493435, 58)
Show SMILES CN1CCN(CC1)c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C16H18N2O2/c1-17-6-8-18(9-7-17)13-3-4-14-12(10-13)2-5-16(20)15(14)11-19/h2-5,10-11,20H,6-9H2,1H3
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257065
PNG
(US9493435, 83)
Show SMILES CC(=O)N1CCN(CC1)c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C17H18N2O3/c1-12(21)18-6-8-19(9-7-18)14-3-4-15-13(10-14)2-5-17(22)16(15)11-20/h2-5,10-11,22H,6-9H2,1H3
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257075
PNG
(BDBM257154 | US9493435, 93)
Show SMILES CS(=O)(=O)NC1CCN(CC1)c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C17H20N2O4S/c1-24(22,23)18-13-6-8-19(9-7-13)14-3-4-15-12(10-14)2-5-17(21)16(15)11-20/h2-5,10-11,13,18,21H,6-9H2,1H3
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257093
PNG
(US9493435, 111)
Show SMILES Oc1ccc2cc(ccc2c1C=O)N1CCC(C1)C(=O)N1CCOCC1
Show InChI InChI=1S/C20H22N2O4/c23-13-18-17-3-2-16(11-14(17)1-4-19(18)24)22-6-5-15(12-22)20(25)21-7-9-26-10-8-21/h1-4,11,13,15,24H,5-10,12H2
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257095
PNG
(US9493435, 113)
Show SMILES Oc1ccc2cc(ccc2c1C=O)N1CCN(CC1)C1CCNCC1
Show InChI InChI=1S/C20H25N3O2/c24-14-19-18-3-2-17(13-15(18)1-4-20(19)25)23-11-9-22(10-12-23)16-5-7-21-8-6-16/h1-4,13-14,16,21,25H,5-12H2
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257111
PNG
(US9493435, 129)
Show SMILES Oc1ccc2cc(ccc2c1C=O)N1CCC(C1)C(=O)N1CCCCC1
Show InChI InChI=1S/C21H24N2O3/c24-14-19-18-6-5-17(12-15(18)4-7-20(19)25)23-11-8-16(13-23)21(26)22-9-2-1-3-10-22/h4-7,12,14,16,25H,1-3,8-11,13H2
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257117
PNG
(US9493435, 135)
Show SMILES CN(C)C1CCN(C1)c1ccc2ccc(O)c(C=O)c2c1
Show InChI InChI=1S/C17H20N2O2/c1-18(2)14-7-8-19(10-14)13-5-3-12-4-6-17(21)16(11-20)15(12)9-13/h3-6,9,11,14,21H,7-8,10H2,1-2H3
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257131
PNG
(US9493435, 149)
Show SMILES Oc1ccc2ccc(cc2c1C=O)N1CCC(C1)C(=O)N1CCOCC1
Show InChI InChI=1S/C20H22N2O4/c23-13-18-17-11-16(3-1-14(17)2-4-19(18)24)22-6-5-15(12-22)20(25)21-7-9-26-10-8-21/h1-4,11,13,15,24H,5-10,12H2
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257136
PNG
(US9493435, 154)
Show SMILES CC(=O)NC1CCN(C1)c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C17H18N2O3/c1-11(21)18-13-6-7-19(9-13)14-3-4-15-12(8-14)2-5-17(22)16(15)10-20/h2-5,8,10,13,22H,6-7,9H2,1H3,(H,18,21)
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257142
PNG
(US9493435, 160)
Show SMILES CN1CCN(CC1)C(=O)COc1ccc2ccc(O)c(C=O)c2c1
Show InChI InChI=1S/C18H20N2O4/c1-19-6-8-20(9-7-19)18(23)12-24-14-4-2-13-3-5-17(22)16(11-21)15(13)10-14/h2-5,10-11,22H,6-9,12H2,1H3
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257006
PNG
(US9493435, 23)
Show SMILES OC(=O)\C=C\c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C14H10O4/c15-8-12-11-4-1-9(2-6-14(17)18)7-10(11)3-5-13(12)16/h1-8,16H,(H,17,18)/b6-2+
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257010
PNG
(BDBM257013 | US9493435, 27)
Show SMILES CN1CCN(CC1)C(=O)c1ccc(Cl)c(c1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C23H21ClN2O3/c1-25-8-10-26(11-9-25)23(29)17-3-6-21(24)19(13-17)16-2-5-18-15(12-16)4-7-22(28)20(18)14-27/h2-7,12-14,28H,8-11H2,1H3
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257022
PNG
(US9493435, 39)
Show SMILES OC(=O)CCc1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C14H12O4/c15-8-12-11-4-1-9(2-6-14(17)18)7-10(11)3-5-13(12)16/h1,3-5,7-8,16H,2,6H2,(H,17,18)
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257027
PNG
(US9493435, 44)
Show SMILES CN1CCN(CC1)c1ccc(cc1)-c1ccc2ccc(O)c(CO)c2c1
Show InChI InChI=1S/C22H24N2O2/c1-23-10-12-24(13-11-23)19-7-4-16(5-8-19)18-3-2-17-6-9-22(26)21(15-25)20(17)14-18/h2-9,14,25-26H,10-13,15H2,1H3
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257034
PNG
(US9493435, 51)
Show SMILES CN(C)C(=O)CCc1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C16H17NO3/c1-17(2)16(20)8-4-11-3-6-13-12(9-11)5-7-15(19)14(13)10-18/h3,5-7,9-10,19H,4,8H2,1-2H3
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257035
PNG
(US9493435, 52)
Show SMILES Oc1ccc2cc(CCC(=O)N3CCOCC3)ccc2c1C=O
Show InChI InChI=1S/C18H19NO4/c20-12-16-15-4-1-13(11-14(15)3-5-17(16)21)2-6-18(22)19-7-9-23-10-8-19/h1,3-5,11-12,21H,2,6-10H2
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257037
PNG
(US9493435, 54)
Show SMILES OCc1c(O)ccc2cc(ccc12)N1CCOCC1
Show InChI InChI=1S/C15H17NO3/c17-10-14-13-3-2-12(16-5-7-19-8-6-16)9-11(13)1-4-15(14)18/h1-4,9,17-18H,5-8,10H2
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n/an/a>1.00E+3n/an/an/an/an/an/a



MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257071
PNG
(US9493435, 89)
Show SMILES CN1CCN(CC1)C1CCN(CC1)c1ccc2ccc(O)c(C=O)c2c1
Show InChI InChI=1S/C21H27N3O2/c1-22-10-12-24(13-11-22)17-6-8-23(9-7-17)18-4-2-16-3-5-21(26)20(15-25)19(16)14-18/h2-5,14-15,17,26H,6-13H2,1H3
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n/an/a>1.00E+3n/an/an/an/an/an/a



MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257073
PNG
(US9493435, 91)
Show SMILES CN1CCN(CC1)C(=O)C1CCN(CC1)c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C22H27N3O3/c1-23-10-12-25(13-11-23)22(28)16-6-8-24(9-7-16)18-3-4-19-17(14-18)2-5-21(27)20(19)15-26/h2-5,14-16,27H,6-13H2,1H3
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n/an/a>1.00E+3n/an/an/an/an/an/a



MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257083
PNG
(US9493435, 101)
Show SMILES Oc1ccc2cc(ccc2c1C=O)-c1ccc(cn1)C(=O)N1CCOCC1
Show InChI InChI=1S/C21H18N2O4/c24-13-18-17-4-1-15(11-14(17)3-6-20(18)25)19-5-2-16(12-22-19)21(26)23-7-9-27-10-8-23/h1-6,11-13,25H,7-10H2
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257101
PNG
(US9493435, 119)
Show SMILES CN(Cc1ccccn1)C1CCCN(C1)c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C23H25N3O2/c1-25(14-18-5-2-3-11-24-18)20-6-4-12-26(15-20)19-8-9-21-17(13-19)7-10-23(28)22(21)16-27/h2-3,5,7-11,13,16,20,28H,4,6,12,14-15H2,1H3
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n/an/a>1.00E+3n/an/an/an/an/an/a



MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257109
PNG
(US9493435, 127)
Show SMILES CNC(=O)C1CCN(C1)c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C17H18N2O3/c1-18-17(22)12-6-7-19(9-12)13-3-4-14-11(8-13)2-5-16(21)15(14)10-20/h2-5,8,10,12,21H,6-7,9H2,1H3,(H,18,22)
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257138
PNG
(US9493435, 156)
Show SMILES CC(=O)NC1CCN(C1)c1ccc2ccc(O)c(C=O)c2c1
Show InChI InChI=1S/C17H18N2O3/c1-11(21)18-13-6-7-19(9-13)14-4-2-12-3-5-17(22)16(10-20)15(12)8-14/h2-5,8,10,13,22H,6-7,9H2,1H3,(H,18,21)
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257144
PNG
(US9493435, 162)
Show SMILES CN1CCC(CC1)NC(=O)COc1ccc2ccc(O)c(C=O)c2c1
Show InChI InChI=1S/C19H22N2O4/c1-21-8-6-14(7-9-21)20-19(24)12-25-15-4-2-13-3-5-18(23)17(11-22)16(13)10-15/h2-5,10-11,14,23H,6-9,12H2,1H3,(H,20,24)
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n/an/a>1.00E+3n/an/an/an/an/an/a



MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257148
PNG
(US9493435, 166)
Show SMILES CN1CCN(CC1)C(=O)c1ccc(Oc2ccc3c(C=O)c(O)ccc3c2)cc1
Show InChI InChI=1S/C23H22N2O4/c1-24-10-12-25(13-11-24)23(28)16-2-5-18(6-3-16)29-19-7-8-20-17(14-19)4-9-22(27)21(20)15-26/h2-9,14-15,27H,10-13H2,1H3
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM256985
PNG
(US9493435, 2)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C22H21NO3/c1-3-23(4-2)22(26)16-7-5-15(6-8-16)17-9-11-19-18(13-17)10-12-21(25)20(19)14-24/h5-14,25H,3-4H2,1-2H3
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM256986
PNG
(US9493435, 3)
Show SMILES Oc1ccc2cc(ccc2c1C=O)-c1ccc(cc1)C(=O)N1CCCC1
Show InChI InChI=1S/C22H19NO3/c24-14-20-19-9-7-17(13-18(19)8-10-21(20)25)15-3-5-16(6-4-15)22(26)23-11-1-2-12-23/h3-10,13-14,25H,1-2,11-12H2
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257036
PNG
(US9493435, 53)
Show SMILES Oc1ccc2cc(ccc2c1C=O)-c1ccc(s1)C(=O)N1CCNCC1
Show InChI InChI=1S/C20H18N2O3S/c23-12-16-15-3-1-14(11-13(15)2-4-17(16)24)18-5-6-19(26-18)20(25)22-9-7-21-8-10-22/h1-6,11-12,21,24H,7-10H2
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257038
PNG
(US9493435, 55)
Show SMILES NCCN1CCN(CC1)C(=O)c1ccc(s1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C22H23N3O3S/c23-7-8-24-9-11-25(12-10-24)22(28)21-6-5-20(29-21)16-1-3-17-15(13-16)2-4-19(27)18(17)14-26/h1-6,13-14,27H,7-12,23H2
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257041
PNG
(US9493435, 59)
Show SMILES Oc1ccc2cc(ccc2c1C=O)N1CCCC1
Show InChI InChI=1S/C15H15NO2/c17-10-14-13-5-4-12(16-7-1-2-8-16)9-11(13)3-6-15(14)18/h3-6,9-10,18H,1-2,7-8H2
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257046
PNG
(US9493435, 64)
Show SMILES CSc1ncc(cn1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C16H12N2O2S/c1-21-16-17-7-12(8-18-16)10-2-4-13-11(6-10)3-5-15(20)14(13)9-19/h2-9,20H,1H3
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257069
PNG
(US9493435, 87)
Show SMILES CN1CCN(CC1)c1ccc2ccc(O)c(CO)c2c1
Show InChI InChI=1S/C16H20N2O2/c1-17-6-8-18(9-7-17)13-4-2-12-3-5-16(20)15(11-19)14(12)10-13/h2-5,10,19-20H,6-9,11H2,1H3
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257082
PNG
(US9493435, 100)
Show SMILES Oc1ccc2cc(ccc2c1C=O)N1CCN(Cc2cccnc2)CC1
Show InChI InChI=1S/C21H21N3O2/c25-15-20-19-5-4-18(12-17(19)3-6-21(20)26)24-10-8-23(9-11-24)14-16-2-1-7-22-13-16/h1-7,12-13,15,26H,8-11,14H2
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257087
PNG
(US9493435, 105)
Show SMILES COCc1cn(nn1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C15H13N3O3/c1-21-9-11-7-18(17-16-11)12-3-4-13-10(6-12)2-5-15(20)14(13)8-19/h2-8,20H,9H2,1H3
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257088
PNG
(US9493435, 106)
Show SMILES CN(C)C1CCN(C1)c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C17H20N2O2/c1-18(2)14-7-8-19(10-14)13-4-5-15-12(9-13)3-6-17(21)16(15)11-20/h3-6,9,11,14,21H,7-8,10H2,1-2H3
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257089
PNG
(US9493435, 107)
Show SMILES Oc1ccc2cc(ccc2c1C=O)N1CCC(C1)N1CCOCC1
Show InChI InChI=1S/C19H22N2O3/c22-13-18-17-3-2-15(11-14(17)1-4-19(18)23)21-6-5-16(12-21)20-7-9-24-10-8-20/h1-4,11,13,16,23H,5-10,12H2
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257090
PNG
(BDBM257097 | US9493435, 108)
Show SMILES Oc1ccc2cc(ccc2c1C=O)N1CCCC(C1)NCc1ccccn1
Show InChI InChI=1S/C22H23N3O2/c26-15-21-20-8-7-19(12-16(20)6-9-22(21)27)25-11-3-5-18(14-25)24-13-17-4-1-2-10-23-17/h1-2,4,6-10,12,15,18,24,27H,3,5,11,13-14H2
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257106
PNG
(US9493435, 124)
Show SMILES Oc1ccc2cc(ccc2c1C=O)-c1ccc(nc1)C(=O)N1CCCC1
Show InChI InChI=1S/C21H18N2O3/c24-13-18-17-6-3-14(11-15(17)5-8-20(18)25)16-4-7-19(22-12-16)21(26)23-9-1-2-10-23/h3-8,11-13,25H,1-2,9-10H2
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257112
PNG
(BDBM257128 | US9493435, 130)
Show SMILES CN(Cc1ccccc1)C1CCN(C1)c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C23H24N2O2/c1-24(14-17-5-3-2-4-6-17)20-11-12-25(15-20)19-8-9-21-18(13-19)7-10-23(27)22(21)16-26/h2-10,13,16,20,27H,11-12,14-15H2,1H3
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257114
PNG
(US9493435, 132)
Show SMILES CN(C)C(=O)C1CCN(C1)c1ccc2ccc(O)c(C=O)c2c1
Show InChI InChI=1S/C18H20N2O3/c1-19(2)18(23)13-7-8-20(10-13)14-5-3-12-4-6-17(22)16(11-21)15(12)9-14/h3-6,9,11,13,22H,7-8,10H2,1-2H3
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MannKing 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...


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More data for this
Ligand-Target Pair
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257115
PNG
(US9493435, 133)
Show SMILES OCc1c(O)ccc2ccc(cc12)N1CCC(C1)C(=O)N1CCCCC1
Show InChI InChI=1S/C21H26N2O3/c24-14-19-18-12-17(6-4-15(18)5-7-20(19)25)23-11-8-16(13-23)21(26)22-9-2-1-3-10-22/h4-7,12,16,24-25H,1-3,8-11,13-14H2
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MannKing Corporation

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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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257116
PNG
(US9493435, 134)
Show SMILES CN(Cc1ccccc1)C(=O)C1CCN(C1)c1ccc2ccc(O)c(CO)c2c1
Show InChI InChI=1S/C24H26N2O3/c1-25(14-17-5-3-2-4-6-17)24(29)19-11-12-26(15-19)20-9-7-18-8-10-23(28)22(16-27)21(18)13-20/h2-10,13,19,27-28H,11-12,14-16H2,1H3
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MannKing Corporation

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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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257132
PNG
(US9493435, 150)
Show SMILES CN1CCN(CC1)C(=O)C1CCN(C1)c1ccc2ccc(O)c(C=O)c2c1
Show InChI InChI=1S/C21H25N3O3/c1-22-8-10-23(11-9-22)21(27)16-6-7-24(13-16)17-4-2-15-3-5-20(26)19(14-25)18(15)12-17/h2-5,12,14,16,26H,6-11,13H2,1H3
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257143
PNG
(US9493435, 161)
Show SMILES Oc1ccc2ccc(OCC(=O)N3CCOCC3)cc2c1C=O
Show InChI InChI=1S/C17H17NO5/c19-10-15-14-9-13(3-1-12(14)2-4-16(15)20)23-11-17(21)18-5-7-22-8-6-18/h1-4,9-10,20H,5-8,11H2
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MannKing Corporation

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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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257075
PNG
(BDBM257154 | US9493435, 93)
Show SMILES CS(=O)(=O)NC1CCN(CC1)c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C17H20N2O4S/c1-24(22,23)18-13-6-8-19(9-7-13)14-3-4-15-12(10-14)2-5-17(21)16(15)11-20/h2-5,10-11,13,18,21H,6-9H2,1H3
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257158
PNG
(US9493435, 179)
Show SMILES Oc1ccc2cc(OCC(=O)N3CCOCC3)ccc2c1C=O
Show InChI InChI=1S/C17H17NO5/c19-10-15-14-3-2-13(9-12(14)1-4-16(15)20)23-11-17(21)18-5-7-22-8-6-18/h1-4,9-10,20H,5-8,11H2
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM256993
PNG
(BDBM257149 | US9493435, 10)
Show SMILES COCCNC(=O)c1ccc(cc1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C21H19NO4/c1-26-11-10-22-21(25)15-4-2-14(3-5-15)16-6-8-18-17(12-16)7-9-20(24)19(18)13-23/h2-9,12-13,24H,10-11H2,1H3,(H,22,25)
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM256998
PNG
(US9493435, 15)
Show SMILES COCCNC(=O)c1ccc(s1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C19H17NO4S/c1-24-9-8-20-19(23)18-7-6-17(25-18)13-2-4-14-12(10-13)3-5-16(22)15(14)11-21/h2-7,10-11,22H,8-9H2,1H3,(H,20,23)
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MannKing Corporation

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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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257059
PNG
(US9493435, 77)
Show SMILES Oc1ccc2cc(ccc2c1C=O)-c1ccc(o1)C(=O)NCC1CCCCN1
Show InChI InChI=1S/C22H22N2O4/c25-13-18-17-6-4-15(11-14(17)5-7-19(18)26)20-8-9-21(28-20)22(27)24-12-16-3-1-2-10-23-16/h4-9,11,13,16,23,26H,1-3,10,12H2,(H,24,27)
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257066
PNG
(US9493435, 84)
Show SMILES CC(=O)NC1CCN(CC1)c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C18H20N2O3/c1-12(22)19-14-6-8-20(9-7-14)15-3-4-16-13(10-15)2-5-18(23)17(16)11-21/h2-5,10-11,14,23H,6-9H2,1H3,(H,19,22)
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257077
PNG
(US9493435, 95)
Show SMILES Oc1ccc2cc(ccc2c1C=O)N1CCN(Cc2ccccc2)CC1
Show InChI InChI=1S/C22H22N2O2/c25-16-21-20-8-7-19(14-18(20)6-9-22(21)26)24-12-10-23(11-13-24)15-17-4-2-1-3-5-17/h1-9,14,16,26H,10-13,15H2
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MannKing Corporation

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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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257086
PNG
(US9493435, 104)
Show SMILES OCc1c(O)ccc2ccc(cc12)N1CCCC1
Show InChI InChI=1S/C15H17NO2/c17-10-14-13-9-12(16-7-1-2-8-16)5-3-11(13)4-6-15(14)18/h3-6,9,17-18H,1-2,7-8,10H2
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257099
PNG
(US9493435, 117)
Show SMILES Oc1ccc2cc(ccc2c1C=O)N1CCC(C1)N1CCCCC1
Show InChI InChI=1S/C20H24N2O2/c23-14-19-18-6-5-16(12-15(18)4-7-20(19)24)22-11-8-17(13-22)21-9-2-1-3-10-21/h4-7,12,14,17,24H,1-3,8-11,13H2
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257100
PNG
(US9493435, 118)
Show SMILES CN1CCN(CC1)C1CCN(C1)c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C20H25N3O2/c1-21-8-10-22(11-9-21)17-6-7-23(13-17)16-3-4-18-15(12-16)2-5-20(25)19(18)14-24/h2-5,12,14,17,25H,6-11,13H2,1H3
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257113
PNG
(US9493435, 131)
Show SMILES CNC(=O)C1CCN(C1)c1ccc2ccc(O)c(C=O)c2c1
Show InChI InChI=1S/C17H18N2O3/c1-18-17(22)12-6-7-19(9-12)13-4-2-11-3-5-16(21)15(10-20)14(11)8-13/h2-5,8,10,12,21H,6-7,9H2,1H3,(H,18,22)
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257129
PNG
(US9493435, 147)
Show SMILES CN(Cc1ccncc1)C1CCN(C1)c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C22H23N3O2/c1-24(13-16-6-9-23-10-7-16)19-8-11-25(14-19)18-3-4-20-17(12-18)2-5-22(27)21(20)15-26/h2-7,9-10,12,15,19,27H,8,11,13-14H2,1H3
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM256995
PNG
(US9493435, 12)
Show SMILES CN(C)C(=O)c1ccc(s1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C18H15NO3S/c1-19(2)18(22)17-8-7-16(23-17)12-3-5-13-11(9-12)4-6-15(21)14(13)10-20/h3-10,21H,1-2H3
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257009
PNG
(US9493435, 26)
Show SMILES CN(C)C(=O)c1ccc(Cl)c(c1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C20H16ClNO3/c1-22(2)20(25)14-4-7-18(21)16(10-14)13-3-6-15-12(9-13)5-8-19(24)17(15)11-23/h3-11,24H,1-2H3
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257011
PNG
(US9493435, 28)
Show SMILES CN(C)C(=O)c1ccc(c(Cl)c1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C20H16ClNO3/c1-22(2)20(25)14-4-7-16(18(21)10-14)13-3-6-15-12(9-13)5-8-19(24)17(15)11-23/h3-11,24H,1-2H3
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257023
PNG
(US9493435, 40)
Show SMILES CCOC(=O)CCc1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C16H16O4/c1-2-20-16(19)8-4-11-3-6-13-12(9-11)5-7-15(18)14(13)10-17/h3,5-7,9-10,18H,2,4,8H2,1H3
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257033
PNG
(US9493435, 50)
Show SMILES CN1CCN(CC1)C(=O)c1ccc(cn1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C22H21N3O3/c1-24-8-10-25(11-9-24)22(28)20-6-3-17(13-23-20)15-2-5-18-16(12-15)4-7-21(27)19(18)14-26/h2-7,12-14,27H,8-11H2,1H3
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257048
PNG
(US9493435, 66)
Show SMILES CN1CCN(CC1)C(=O)c1cc(ccn1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C22H21N3O3/c1-24-8-10-25(11-9-24)22(28)20-13-16(6-7-23-20)15-2-4-18-17(12-15)3-5-21(27)19(18)14-26/h2-7,12-14,27H,8-11H2,1H3
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257058
PNG
(US9493435, 76)
Show SMILES CN1CCN(CC1)C(=O)c1coc(n1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C20H19N3O4/c1-22-6-8-23(9-7-22)20(26)17-12-27-19(21-17)14-2-4-15-13(10-14)3-5-18(25)16(15)11-24/h2-5,10-12,25H,6-9H2,1H3
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257072
PNG
(US9493435, 90)
Show SMILES Oc1ccc2ccc(cc2c1C=O)N1CCC(CC1)N1CCOCC1
Show InChI InChI=1S/C20H24N2O3/c23-14-19-18-13-17(3-1-15(18)2-4-20(19)24)21-7-5-16(6-8-21)22-9-11-25-12-10-22/h1-4,13-14,16,24H,5-12H2
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257078
PNG
(US9493435, 96)
Show SMILES Oc1ccc2cc(ccc2c1C=O)N1CCN(Cc2ccccn2)CC1
Show InChI InChI=1S/C21H21N3O2/c25-15-20-19-6-5-18(13-16(19)4-7-21(20)26)24-11-9-23(10-12-24)14-17-3-1-2-8-22-17/h1-8,13,15,26H,9-12,14H2
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257079
PNG
(BDBM257151 | US9493435, 97)
Show SMILES Oc1ccc2cc(ccc2c1C=O)N1CCC(CC1)NCc1ccccc1
Show InChI InChI=1S/C23H24N2O2/c26-16-22-21-8-7-20(14-18(21)6-9-23(22)27)25-12-10-19(11-13-25)24-15-17-4-2-1-3-5-17/h1-9,14,16,19,24,27H,10-13,15H2
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257080
PNG
(US9493435, 98)
Show SMILES Oc1ccc2cc(ccc2c1C=O)N1CCCC(C1)NCc1ccccc1
Show InChI InChI=1S/C23H24N2O2/c26-16-22-21-10-9-20(13-18(21)8-11-23(22)27)25-12-4-7-19(15-25)24-14-17-5-2-1-3-6-17/h1-3,5-6,8-11,13,16,19,24,27H,4,7,12,14-15H2
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257092
PNG
(US9493435, 110)
Show SMILES Oc1ccc2cc(ccc2c1C=O)N1CCC(CC1)C(=O)N1CCOCC1
Show InChI InChI=1S/C21H24N2O4/c24-14-19-18-3-2-17(13-16(18)1-4-20(19)25)22-7-5-15(6-8-22)21(26)23-9-11-27-12-10-23/h1-4,13-15,25H,5-12H2
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257105
PNG
(US9493435, 123)
Show SMILES CN(C1CCCN(C1)c1ccc2c(C=O)c(O)ccc2c1)S(C)(=O)=O
Show InChI InChI=1S/C18H22N2O4S/c1-19(25(2,23)24)15-4-3-9-20(11-15)14-6-7-16-13(10-14)5-8-18(22)17(16)12-21/h5-8,10,12,15,22H,3-4,9,11H2,1-2H3
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257120
PNG
(US9493435, 138)
Show SMILES CN1CCN(CC1)C1CCN(C1)c1ccc2ccc(O)c(CO)c2c1
Show InChI InChI=1S/C20H27N3O2/c1-21-8-10-22(11-9-21)17-6-7-23(13-17)16-4-2-15-3-5-20(25)19(14-24)18(15)12-16/h2-5,12,17,24-25H,6-11,13-14H2,1H3
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257127
PNG
(US9493435, 145)
Show SMILES CN1CCC(CC1)NC(=O)c1sc(nc1C)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C22H23N3O3S/c1-13-20(21(28)24-16-7-9-25(2)10-8-16)29-22(23-13)15-3-5-17-14(11-15)4-6-19(27)18(17)12-26/h3-6,11-12,16,27H,7-10H2,1-2H3,(H,24,28)
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257112
PNG
(BDBM257128 | US9493435, 130)
Show SMILES CN(Cc1ccccc1)C1CCN(C1)c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C23H24N2O2/c1-24(14-17-5-3-2-4-6-17)20-11-12-25(15-20)19-8-9-21-18(13-19)7-10-23(27)22(21)16-26/h2-10,13,16,20,27H,11-12,14-15H2,1H3
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257137
PNG
(US9493435, 155)
Show SMILES CN(Cc1ccncc1)C1CCN(C1)c1ccc2ccc(O)c(C=O)c2c1
Show InChI InChI=1S/C22H23N3O2/c1-24(13-16-6-9-23-10-7-16)19-8-11-25(14-19)18-4-2-17-3-5-22(27)21(15-26)20(17)12-18/h2-7,9-10,12,15,19,27H,8,11,13-14H2,1H3
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257141
PNG
(US9493435, 159)
Show SMILES CC(C)N1CCN(CC1)c1ccc2ccc(O)c(C=O)c2c1
Show InChI InChI=1S/C18H22N2O2/c1-13(2)19-7-9-20(10-8-19)15-5-3-14-4-6-18(22)17(12-21)16(14)11-15/h3-6,11-13,22H,7-10H2,1-2H3
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257145
PNG
(US9493435, 163)
Show SMILES Oc1ccc2ccc(OCC(=O)NN3CCOCC3)cc2c1C=O
Show InChI InChI=1S/C17H18N2O5/c20-10-15-14-9-13(3-1-12(14)2-4-16(15)21)24-11-17(22)18-19-5-7-23-8-6-19/h1-4,9-10,21H,5-8,11H2,(H,18,22)
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257147
PNG
(US9493435, 165)
Show SMILES CN1CCN(CC1)C(=O)COc1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C18H20N2O4/c1-19-6-8-20(9-7-19)18(23)12-24-14-3-4-15-13(10-14)2-5-17(22)16(15)11-21/h2-5,10-11,22H,6-9,12H2,1H3
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(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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n/an/a<1.00E+3n/an/an/an/an/an/a



MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257096
PNG
(BDBM257152 | US9493435, 114)
Show SMILES Oc1ccc2cc(ccc2c1C=O)N1CCC(CC1)NCc1ccccn1
Show InChI InChI=1S/C22H23N3O2/c26-15-21-20-6-5-19(13-16(20)4-7-22(21)27)25-11-8-17(9-12-25)24-14-18-3-1-2-10-23-18/h1-7,10,13,15,17,24,27H,8-9,11-12,14H2
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257028
PNG
(US9493435, 45)
Show SMILES NCCOCCOCCNC(=O)c1ccc(s1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C22H24N2O5S/c23-7-9-28-11-12-29-10-8-24-22(27)21-6-5-20(30-21)16-1-3-17-15(13-16)2-4-19(26)18(17)14-25/h1-6,13-14,26H,7-12,23H2,(H,24,27)
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM202540
PNG
(US9241942, 32-12 | US9493435, 56)
Show SMILES CN1CCN(CC1)C(=O)c1ccc(o1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C21H20N2O4/c1-22-8-10-23(11-9-22)21(26)20-7-6-19(27-20)15-2-4-16-14(12-15)3-5-18(25)17(16)13-24/h2-7,12-13,25H,8-11H2,1H3
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257039
PNG
(US9493435, 57)
Show SMILES CN1CCN(CC1)C(=O)c1ccc(nc1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C22H21N3O3/c1-24-8-10-25(11-9-24)22(28)17-3-6-20(23-13-17)16-2-5-18-15(12-16)4-7-21(27)19(18)14-26/h2-7,12-14,27H,8-11H2,1H3
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257056
PNG
(US9493435, 74)
Show SMILES CN(C)CCCNC(=O)c1ccc(s1)-c1ccc2c(C=O)c(O)ccc2c1
Show InChI InChI=1S/C21H22N2O3S/c1-23(2)11-3-10-22-21(26)20-9-8-19(27-20)15-4-6-16-14(12-15)5-7-18(25)17(16)13-24/h4-9,12-13,25H,3,10-11H2,1-2H3,(H,22,26)
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257063
PNG
(US9493435, 81)
Show SMILES Oc1ccc2cc(ccc2c1C=O)N1CCN(CC1)c1ccccn1
Show InChI InChI=1S/C20H19N3O2/c24-14-18-17-6-5-16(13-15(17)4-7-19(18)25)22-9-11-23(12-10-22)20-3-1-2-8-21-20/h1-8,13-14,25H,9-12H2
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MannKing 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
GST-Inositol requiring enzyme 1 (IRE-1alpha)


(Homo sapiens (Human))
BDBM257085
PNG
(US9493435, 103)
Show SMILES Oc1ccc2cc(ccc2c1C=O)N1CCN(CC1)c1cccnc1
Show InChI InChI=1S/C20H19N3O2/c24-14-19-18-5-4-16(12-15(18)3-6-20(19)25)22-8-10-23(11-9-22)17-2-1-7-21-13-17/h1-7,12-14,25H,8-11H2
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MannKing 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
* indicates data uncertainty>20%