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Compile Data Set for Download or QSAR

Found 175 hits with Last Name = 'laugeois' and Initial = 'm'   
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
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM634316
PNG
(8,14-dioxa-4,10,19,20- | US20230357269, Example 1)
Show SMILES O=C1NCCCOc2ccc3[nH]nc(-c4cncc(CO1)c4)c3c2
PDB

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Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM634318
PNG
(4-fluoro-8,14-dioxa-10,19,20- | US20230357269, Exa...)
Show SMILES Fc1cc2COC(=O)NCCCOc3ccc4[nH]nc(-c(c1)c2)c4c3
PDB

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Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM634319
PNG
(8,14-dioxa-10,19,20,23- | US20230357269, Example 4)
Show SMILES O=C1NCCCOc2ccc3[nH]nc(-c4cccc(CO1)n4)c3c2
PDB

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Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM634320
PNG
(8,14-dioxa-10,19,20- | US20230357269, Example 5)
Show SMILES O=C1NCCCOc2ccc3[nH]nc(-c4cccc(CO1)c4)c3c2
PDB

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Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM634322
PNG
(8,14-dioxa-5,10,19,20- | US20230357269, Example 7)
Show SMILES O=C1NCCCOc2ccc3[nH]nc(-c4ccnc(CO1)c4)c3c2
PDB

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Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM634323
PNG
(4-methoxy-8,14-dioxa-10,19,20- | US20230357269, Ex...)
Show SMILES COc1cc2COC(=O)NCCCOc3ccc4[nH]nc(-c(c2)c1)c4c3
PDB

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Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM634324
PNG
(4-bromo-8,14-dioxa-10,19,20- | US20230357269, Exam...)
Show SMILES Brc1cc2COC(=O)NCCCOc3ccc4[nH]nc(-c(c1)c2)c4c3
PDB

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Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM634325
PNG
(5-fluoro-8,14-dioxa-10,19,20- | US20230357269, Exa...)
Show SMILES Fc1ccc-2cc1COC(=O)NCCCOc1ccc3[nH]nc-2c3c1
PDB

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Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM634326
PNG
(5-methyl-8,14-dioxa-10,19,20- | US20230357269, Exa...)
Show SMILES Cc1ccc-2cc1COC(=O)NCCCOc1ccc3[nH]nc-2c3c1
PDB

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Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM634327
PNG
(4-(pyrrolidin-1-yl)-8,14-dioxa-10,19,20- | US20230...)
Show SMILES O=C1NCCCOc2ccc3[nH]nc(-c4cc(CO1)cc(c4)N1CCCC1)c3c2
PDB

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Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM634328
PNG
(4-[4-(propan-2-yl)piperazin-1-yl]-8,14-dioxa- | US...)
Show SMILES CC(C)N1CCN(CC1)c1cc2COC(=O)NCCCOc3ccc4[nH]nc(-c(c2)c1)c4c3
PDB

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Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM50580006
PNG
(CHEMBL5090730 | US20230357269, Example 14)
Show SMILES O=C1NCCCOc2ccc3[nH]nc(-c4cc(CO1)cc(c4)N1CCC4(COC4)C1)c3c2
PDB

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Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM50580007
PNG
(CHEMBL5072941 | US20230357269, Example 15)
Show SMILES O=C1NCCCOc2ccc3[nH]nc(-c4cc(CO1)cc(c4)N1CCN(CC1)C1COC1)c3c2
PDB

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Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM634331
PNG
(4-(morpholin-4-yl)-8,14-dioxa-10,19,20- | US202303...)
Show SMILES O=C1NCCCOc2ccc3[nH]nc(-c4cc(CO1)cc(c4)N1CCOCC1)c3c2
PDB

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Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM634332
PNG
(4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-8,14- | US2...)
Show SMILES C[C@H]1CN(C[C@@H](C)O1)c1cc2COC(=O)NCCCOc3ccc4[nH]nc(-c(c2)c1)c4c3 |r|
PDB

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Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM634333
PNG
(4-methyl-8,14-dioxa-10,19,20- | US20230357269, Exa...)
Show SMILES Cc1cc2COC(=O)NCCCOc3ccc4[nH]nc(-c(c1)c2)c4c3
PDB

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Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM634334
PNG
(5-methoxy-8,14-dioxa-10,19,20- | US20230357269, Ex...)
Show SMILES COc1ccc-2cc1COC(=O)NCCCOc1ccc3[nH]nc-2c3c1
PDB

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Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM634335
PNG
(4-(4,4-difluoropiperidin-1-yl)-8,14-dioxa- | US202...)
Show SMILES FC1(F)CCN(CC1)c1cc2COC(=O)NCCCOc3ccc4[nH]nc(-c(c2)c1)c4c3
PDB

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Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM634336
PNG
(4-(3,3-difluoropyrrolidin-1-yl)-8,14-dioxa- | US20...)
Show SMILES FC1(F)CCN(C1)c1cc2COC(=O)NCCCOc3ccc4[nH]nc(-c(c2)c1)c4c3
PDB

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Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM634337
PNG
(7-methyl-8,14-dioxa-10,19,20- | US20230357269, Exa...)
Show SMILES CC1OC(=O)NCCCOc2ccc3[nH]nc(-c4cccc1c4)c3c2
PDB

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Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM634338
PNG
(4-[4-(2-methoxyethyl)piperidin-1-yl]-8,14-dioxa- |...)
Show SMILES COCCC1CCN(CC1)c1cc2COC(=O)NCCCOc3ccc4[nH]nc(-c(c2)c1)c4c3
PDB

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Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM634340
PNG
(4-[(3R)-3-hydroxypyrrolidin-1-yl]-8,14-dioxa- | US...)
Show SMILES O[C@@H]1CCN(C1)c1cc2COC(=O)NCCCOc3ccc4[nH]nc(-c(c2)c1)c4c3 |r|
PDB

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Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM634341
PNG
(4-[(2-methoxyethyl)(methyl)amino]-8,14-dioxa- | US...)
Show SMILES COCCN(C)c1cc2COC(=O)NCCCOc3ccc4[nH]nc(-c(c2)c1)c4c3
PDB

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Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM634342
PNG
(4-chloro-8,14-dioxa-10,19,20- | US20230357269, Exa...)
Show SMILES Clc1cc2COC(=O)NCCCOc3ccc4[nH]nc(-c(c1)c2)c4c3
PDB

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Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM634343
PNG
(4-fluoro-5-methyl-8,14-dioxa-10,19,20- | US2023035...)
Show SMILES Cc1c(F)cc-2cc1COC(=O)NCCCOc1ccc3[nH]nc-2c3c1
PDB

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Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM634344
PNG
(4,5-difluoro-8,14-dioxa-10,19,20- | US20230357269,...)
Show SMILES Fc1cc-2cc(COC(=O)NCCCOc3ccc4[nH]nc-2c4c3)c1F
PDB

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Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM634345
PNG
(5-bromo-8,14-dioxa-10,19,20- | US20230357269, Exam...)
Show SMILES Brc1ccc-2cc1COC(=O)NCCCOc1ccc3[nH]nc-2c3c1
PDB

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Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM634346
PNG
(4-(4-methylpiperazin-1-yl)-8,14-dioxa-10,19,20- | ...)
Show SMILES CN1CCN(CC1)c1cc2COC(=O)NCCCOc3ccc4[nH]nc(-c(c2)c1)c4c3
PDB

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Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM634347
PNG
(4-(3-methoxyazetidin-1-yl)-8,14-dioxa-10,19,20- | ...)
Show SMILES COC1CN(C1)c1cc2COC(=O)NCCCOc3ccc4[nH]nc(-c(c2)c1)c4c3
PDB

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Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM634348
PNG
(1-{9-oxo-8,14-dioxa-10,19,20-triazatetra | US20230...)
Show SMILES O=C1NCCCOc2ccc3[nH]nc(-c4cc(CO1)cc(c4)N1CCC(CC1)C#N)c3c2
PDB

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Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM50580008
PNG
(CHEMBL5093627 | US20230357269, Example 34)
Show SMILES O=C1NCCCOc2ccc3[nH]nc(-c4cc(CO1)cc(c4)N1CCC(CC1)N1CCCC1)c3c2
PDB

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Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM634350
PNG
(4-(azetidin-1-yl)-8,14-dioxa-10,19,20- | US2023035...)
Show SMILES O=C1NCCCOc2ccc3[nH]nc(-c4cc(CO1)cc(c4)N1CCC1)c3c2
PDB

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Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM634351
PNG
(4-(piperidin-1-yl)-8,14-dioxa-10,19,20- | US202303...)
Show SMILES O=C1NCCCOc2ccc3[nH]nc(-c4cc(CO1)cc(c4)N1CCCCC1)c3c2
PDB

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Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM634352
PNG
(4-(2,5-dihydrofuran-3-yl)-8,14-dioxa-10,19,20- | U...)
Show SMILES O=C1NCCCOc2ccc3[nH]nc(-c4cc(CO1)cc(c4)C1=CCOC1)c3c2 |t:24|
PDB

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Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM50580009
PNG
(CHEMBL5082872 | US20230357269, Example 38)
Show SMILES O=C1NCCCOc2ccc3[nH]nc(-c4cc(CO1)cc(c4)N1CCC(CC1)N1CCOCC1)c3c2
PDB

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Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM634354
PNG
(4-(1-methyl-1,2,3,6-tetrahydropyridin-4-yl)-8,14- ...)
Show SMILES CN1CCC(=CC1)c1cc2COC(=O)NCCCOc3ccc4[nH]nc(-c(c2)c1)c4c3 |c:4|
PDB

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Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM634355
PNG
(4-[(2S,5S)-2,5-dimethylmorpholin-4-yl]-8,14- | US2...)
Show SMILES O=C1NCCCOc2ccc3[nH]nc(-c4cc(CO1)cc(c4)N1C[C@@H]4C[C@H]1CO4)c3c2 |r|
PDB

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Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM634356
PNG
(4-[(morpholin-4-yl)methyl]-8,14-dioxa-10,19,20- | ...)
Show SMILES O=C1NCCCOc2ccc3[nH]nc(-c4cc(CN5CCOCC5)cc(CO1)c4)c3c2
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Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM634357
PNG
(4-[(pyrrolidin-1-yl)methyl]-8,14-dioxa-10,19,20- |...)
Show SMILES O=C1NCCCOc2ccc3[nH]nc(-c4cc(CN5CCCC5)cc(CO1)c4)c3c2
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More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM634359
PNG
(4-[(4-methylpiperazin-1-yl)methyl]-8,14-dioxa- | U...)
Show SMILES CN1CCN(Cc2cc3COC(=O)NCCCOc4ccc5[nH]nc(-c(c2)c3)c5c4)CC1
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Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM634360
PNG
(5-(morpholin-4-yl)-8,14-dioxa-10,19,20- | US202303...)
Show SMILES O=C1NCCCOc2ccc3[nH]nc(-c4ccc(N5CCOCC5)c(CO1)c4)c3c2
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Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM634361
PNG
(4-[4-(2-methoxyethyl)piperazin-1-yl]-8,14-dioxa- |...)
Show SMILES COCCN1CCN(CC1)c1cc2COC(=O)NCCCOc3ccc4[nH]nc(-c(c2)c1)c4c3
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Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM634362
PNG
(4-(diethylamino)-8,14-dioxa-10,19,20-triazatetracy...)
Show SMILES CCN(CC)c1cc2COC(=O)NCCCOc3ccc4[nH]nc(-c(c2)c1)c4c3
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Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM634363
PNG
(4-cyclopropyl-8,14-dioxa-10,19,20- | US20230357269...)
Show SMILES O=C1NCCCOc2ccc3[nH]nc(-c4cc(CO1)cc(c4)C1CC1)c3c2
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Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM634365
PNG
(13-methyl-8,14-dioxa-10,19,20- | US20230357269, Ex...)
Show SMILES CC1CCNC(=O)OCc2cccc(c2)-c2n[nH]c3ccc(O1)cc23
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Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM634366
PNG
(8,14-dioxa-4,5,10,19,20- | US20230357269, Example ...)
Show SMILES O=C1NCCCOc2ccc3[nH]nc(-c4cnn(CCO1)c4)c3c2
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More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM634367
PNG
(4-[methyl(oxetan-3-yl)amino]-8,14-dioxa- | US20230...)
Show SMILES CN(C1COC1)c1cc2COC(=O)NCCCOc3ccc4[nH]nc(-c(c2)c1)c4c3
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Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM634369
PNG
(4,10-dimethyl-8,14-dioxa-10,19,20- | US20230357269...)
Show SMILES CN1CCCOc2ccc3[nH]nc(-c4cc(C)cc(COC1=O)c4)c3c2
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More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM634370
PNG
(4-(propan-2-yloxy)-8,14-dioxa-10,19,20- | US202303...)
Show SMILES CC(C)Oc1cc2COC(=O)NCCCOc3ccc4[nH]nc(-c(c2)c1)c4c3
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More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM634371
PNG
(4-fluoro-7-methyl-8,14-dioxa-10,19,20- | US2023035...)
Show SMILES CC1OC(=O)NCCCOc2ccc3[nH]nc(-c4cc(F)cc1c4)c3c2
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Ligand-Target Pair
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