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Found 1429 hits Enz. Inhib. hit(s) with Target = 'Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)'   
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 (LRRK2)(G2019S)


(Homo sapiens (Human))
BDBM257380
PNG
(US9493440, 230)
Show SMILES CC1(CC1)Oc1ccc2[nH]nc(-c3cc(ncn3)N3CCN(CCF)CC3)c2c1
Show InChI InChI=1S/C21H25FN6O/c1-21(4-5-21)29-15-2-3-17-16(12-15)20(26-25-17)18-13-19(24-14-23-18)28-10-8-27(7-6-22)9-11-28/h2-3,12-14H,4-11H2,1H3,(H,25,26)
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n/an/a 0.450n/an/an/an/a8.525



Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound (98 uM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well bla...


US Patent US9493440 (2016)


BindingDB Entry DOI: 10.7270/Q2668C4X
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)(G2019S)


(Homo sapiens (Human))
BDBM257387
PNG
(US9493440, T2)
Show SMILES C[C@H]1CN(C[C@@H](C)N1C)c1cc(ncn1)-c1n[nH]c2ccc(OC3(C)CC3)cc12 |r|
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n/an/a 0.490n/an/an/an/a8.525



Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound (98 uM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well bla...


US Patent US9493440 (2016)


BindingDB Entry DOI: 10.7270/Q2668C4X
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)(G2019S)


(Homo sapiens (Human))
BDBM257316
PNG
(US9493440, 160)
Show SMILES COCCN1CCN(CC1)c1cc(ncn1)-c1n[nH]c2cc(F)c(OC3(C)CC3)cc12
Show InChI InChI=1S/C22H27FN6O2/c1-22(3-4-22)31-19-11-15-17(12-16(19)23)26-27-21(15)18-13-20(25-14-24-18)29-7-5-28(6-8-29)9-10-30-2/h11-14H,3-10H2,1-2H3,(H,26,27)
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound (98 uM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well bla...


US Patent US9493440 (2016)


BindingDB Entry DOI: 10.7270/Q2668C4X
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)(G2019S)


(Homo sapiens (Human))
BDBM257342
PNG
(US9493440, 186)
Show SMILES CC1(CC1)Oc1cc2c(n[nH]c2cc1F)-c1cc(ncn1)N1CCS(=O)(=O)CC1
Show InChI InChI=1S/C19H20FN5O3S/c1-19(2-3-19)28-16-8-12-14(9-13(16)20)23-24-18(12)15-10-17(22-11-21-15)25-4-6-29(26,27)7-5-25/h8-11H,2-7H2,1H3,(H,23,24)
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound (98 uM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well bla...


US Patent US9493440 (2016)


BindingDB Entry DOI: 10.7270/Q2668C4X
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)(G2019S)


(Homo sapiens (Human))
BDBM257175
PNG
(US9493440, 16)
Show SMILES C[C@@H]1CN(CCN1C)c1cc(ncn1)-c1n[nH]c2ccc(OC3(C)CC3)cc12 |r|
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound (98 uM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well bla...


US Patent US9493440 (2016)


BindingDB Entry DOI: 10.7270/Q2668C4X
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)(G2019S)


(Homo sapiens (Human))
BDBM257161
PNG
(BDBM257389 | US9493440, 1)
Show SMILES CC1(CC1)Oc1ccc2[nH]nc(-c3cc(ncn3)N3CCOCC3)c2c1
Show InChI InChI=1S/C19H21N5O2/c1-19(4-5-19)26-13-2-3-15-14(10-13)18(23-22-15)16-11-17(21-12-20-16)24-6-8-25-9-7-24/h2-3,10-12H,4-9H2,1H3,(H,22,23)
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound (98 uM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well bla...


US Patent US9493440 (2016)


BindingDB Entry DOI: 10.7270/Q2668C4X
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)(G2019S)


(Homo sapiens (Human))
BDBM257184
PNG
(BDBM257386 | US9493440, 26)
Show SMILES C[C@H]1CN(CCN1C)c1cc(ncn1)-c1n[nH]c2ccc(OC3(C)CC3)cc12 |r|
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound (98 uM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well bla...


US Patent US9493440 (2016)


BindingDB Entry DOI: 10.7270/Q2668C4X
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)(G2019S)


(Homo sapiens (Human))
BDBM257194
PNG
(US9493440, 38)
Show SMILES CC1(CC1)Oc1ccc2[nH]nc(-c3cc(ncn3)N3CCC4(CNC(=O)C4)CC3)c2c1
Show InChI InChI=1S/C23H26N6O2/c1-22(4-5-22)31-15-2-3-17-16(10-15)21(28-27-17)18-11-19(26-14-25-18)29-8-6-23(7-9-29)12-20(30)24-13-23/h2-3,10-11,14H,4-9,12-13H2,1H3,(H,24,30)(H,27,28)
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound (98 uM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well bla...


US Patent US9493440 (2016)


BindingDB Entry DOI: 10.7270/Q2668C4X
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)(G2019S)


(Homo sapiens (Human))
BDBM257295
PNG
(US9493440, 139)
Show SMILES COCC(C)N1CCN(C[C@H]1C)c1cc(ncn1)-c1n[nH]c2ccc(OC3(C)CC3)cc12 |r|
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound (98 uM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well bla...


US Patent US9493440 (2016)


BindingDB Entry DOI: 10.7270/Q2668C4X
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)(G2019S)


(Homo sapiens (Human))
BDBM257307
PNG
(US9493440, 151)
Show SMILES C[C@@H]1CN(CCO1)c1cc(ncn1)-c1n[nH]c2cc(F)c(OC3(C)CC3)cc12 |r|
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound (98 uM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well bla...


US Patent US9493440 (2016)


BindingDB Entry DOI: 10.7270/Q2668C4X
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)(G2019S)


(Homo sapiens (Human))
BDBM257289
PNG
(US9493440, 133)
Show SMILES CCN1CCN(C[C@@H]1C)c1cc(ncn1)-c1n[nH]c2ccc(OC3(C)CC3)cc12 |r|
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound (98 uM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well bla...


US Patent US9493440 (2016)


BindingDB Entry DOI: 10.7270/Q2668C4X
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)(G2019S)


(Homo sapiens (Human))
BDBM257287
PNG
(US9493440, 131)
Show SMILES COCC(C)N1CCN(C[C@@H]1C)c1cc(ncn1)-c1n[nH]c2ccc(OC3(C)CC3)cc12 |r|
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound (98 uM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well bla...


US Patent US9493440 (2016)


BindingDB Entry DOI: 10.7270/Q2668C4X
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)(G2019S)


(Homo sapiens (Human))
BDBM257285
PNG
(US9493440, 129)
Show SMILES C[C@H]1CN(CCN1Cc1ncco1)c1cc(ncn1)-c1n[nH]c2ccc(OC3(C)CC3)cc12 |r|
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound (98 uM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well bla...


US Patent US9493440 (2016)


BindingDB Entry DOI: 10.7270/Q2668C4X
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)(G2019S)


(Homo sapiens (Human))
BDBM257309
PNG
(US9493440, 153)
Show SMILES CN1CCN(CC1)c1cc(ncn1)-c1n[nH]c2cc(F)c(OC3(C)CC3)cc12
Show InChI InChI=1S/C20H23FN6O/c1-20(3-4-20)28-17-9-13-15(10-14(17)21)24-25-19(13)16-11-18(23-12-22-16)27-7-5-26(2)6-8-27/h9-12H,3-8H2,1-2H3,(H,24,25)
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound (98 uM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well bla...


US Patent US9493440 (2016)


BindingDB Entry DOI: 10.7270/Q2668C4X
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)(G2019S)


(Homo sapiens (Human))
BDBM257311
PNG
(US9493440, 155)
Show SMILES CC1(CC1)Oc1cc2c(n[nH]c2cc1F)-c1cc(ncn1)N1CCN(CC1)S(C)(=O)=O
Show InChI InChI=1S/C20H23FN6O3S/c1-20(3-4-20)30-17-9-13-15(10-14(17)21)24-25-19(13)16-11-18(23-12-22-16)26-5-7-27(8-6-26)31(2,28)29/h9-12H,3-8H2,1-2H3,(H,24,25)
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound (98 uM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well bla...


US Patent US9493440 (2016)


BindingDB Entry DOI: 10.7270/Q2668C4X
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)(G2019S)


(Homo sapiens (Human))
BDBM257312
PNG
(US9493440, 156)
Show SMILES CN1CCN(CC1=O)c1cc(ncn1)-c1n[nH]c2cc(F)c(OC3(C)CC3)cc12
Show InChI InChI=1S/C20H21FN6O2/c1-20(3-4-20)29-16-7-12-14(8-13(16)21)24-25-19(12)15-9-17(23-11-22-15)27-6-5-26(2)18(28)10-27/h7-9,11H,3-6,10H2,1-2H3,(H,24,25)
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound (98 uM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well bla...


US Patent US9493440 (2016)


BindingDB Entry DOI: 10.7270/Q2668C4X
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)(G2019S)


(Homo sapiens (Human))
BDBM257326
PNG
(US9493440, 170)
Show SMILES CC1(CC1)Oc1cc2c(n[nH]c2cc1F)-c1cc(ncn1)N1CCS(=O)CC1
Show InChI InChI=1S/C19H20FN5O2S/c1-19(2-3-19)27-16-8-12-14(9-13(16)20)23-24-18(12)15-10-17(22-11-21-15)25-4-6-28(26)7-5-25/h8-11H,2-7H2,1H3,(H,23,24)
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound (98 uM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well bla...


US Patent US9493440 (2016)


BindingDB Entry DOI: 10.7270/Q2668C4X
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)(G2019S)


(Homo sapiens (Human))
BDBM257330
PNG
(US9493440, 174)
Show SMILES Cc1nonc1N1CCN(CC1)c1cc(ncn1)-c1n[nH]c2cc(F)c(OC3(C)CC3)cc12
Show InChI InChI=1S/C22H23FN8O2/c1-13-21(29-33-28-13)31-7-5-30(6-8-31)19-11-17(24-12-25-19)20-14-9-18(32-22(2)3-4-22)15(23)10-16(14)26-27-20/h9-12H,3-8H2,1-2H3,(H,26,27)
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound (98 uM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well bla...


US Patent US9493440 (2016)


BindingDB Entry DOI: 10.7270/Q2668C4X
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)(G2019S)


(Homo sapiens (Human))
BDBM257184
PNG
(BDBM257386 | US9493440, 26)
Show SMILES C[C@H]1CN(CCN1C)c1cc(ncn1)-c1n[nH]c2ccc(OC3(C)CC3)cc12 |r|
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound (98 uM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well bla...


US Patent US9493440 (2016)


BindingDB Entry DOI: 10.7270/Q2668C4X
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)(G2019S)


(Homo sapiens (Human))
BDBM257189
PNG
(BDBM257192 | US9493440, 33)
Show SMILES CCS(=O)(=O)N1CCN(CC1)c1cc(ncn1)-c1n[nH]c2ccc(OC3(C)CC3)cc12
Show InChI InChI=1S/C21H26N6O3S/c1-3-31(28,29)27-10-8-26(9-11-27)19-13-18(22-14-23-19)20-16-12-15(30-21(2)6-7-21)4-5-17(16)24-25-20/h4-5,12-14H,3,6-11H2,1-2H3,(H,24,25)
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound (98 uM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well bla...


US Patent US9493440 (2016)


BindingDB Entry DOI: 10.7270/Q2668C4X
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)(G2019S)


(Homo sapiens (Human))
BDBM257189
PNG
(BDBM257192 | US9493440, 33)
Show SMILES CCS(=O)(=O)N1CCN(CC1)c1cc(ncn1)-c1n[nH]c2ccc(OC3(C)CC3)cc12
Show InChI InChI=1S/C21H26N6O3S/c1-3-31(28,29)27-10-8-26(9-11-27)19-13-18(22-14-23-19)20-16-12-15(30-21(2)6-7-21)4-5-17(16)24-25-20/h4-5,12-14H,3,6-11H2,1-2H3,(H,24,25)
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound (98 uM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well bla...


US Patent US9493440 (2016)


BindingDB Entry DOI: 10.7270/Q2668C4X
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)(G2019S)


(Homo sapiens (Human))
BDBM257371
PNG
(US9493440, 219)
Show SMILES CCC1(CC1)Oc1ccc2[nH]nc(-c3cc(ncn3)N3CCN(CC3)S(C)(=O)=O)c2c1
Show InChI InChI=1S/C21H26N6O3S/c1-3-21(6-7-21)30-15-4-5-17-16(12-15)20(25-24-17)18-13-19(23-14-22-18)26-8-10-27(11-9-26)31(2,28)29/h4-5,12-14H,3,6-11H2,1-2H3,(H,24,25)
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound (98 uM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well bla...


US Patent US9493440 (2016)


BindingDB Entry DOI: 10.7270/Q2668C4X
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)(G2019S)


(Homo sapiens (Human))
BDBM257315
PNG
(US9493440, 159)
Show SMILES CC1(CC1)Oc1cc2c(n[nH]c2cc1F)-c1cc(ncn1)N1CCN(CCF)CC1
Show InChI InChI=1S/C21H24F2N6O/c1-21(2-3-21)30-18-10-14-16(11-15(18)23)26-27-20(14)17-12-19(25-13-24-17)29-8-6-28(5-4-22)7-9-29/h10-13H,2-9H2,1H3,(H,26,27)
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound (98 uM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well bla...


US Patent US9493440 (2016)


BindingDB Entry DOI: 10.7270/Q2668C4X
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)(G2019S)


(Homo sapiens (Human))
BDBM257286
PNG
(US9493440, 130)
Show SMILES C[C@H]1CN(CCN1Cc1cocn1)c1cc(ncn1)-c1n[nH]c2ccc(OC3(C)CC3)cc12 |r|
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n/an/a 0.700n/an/an/an/a8.525



Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound (98 uM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well bla...


US Patent US9493440 (2016)


BindingDB Entry DOI: 10.7270/Q2668C4X
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)(G2019S)


(Homo sapiens (Human))
BDBM257332
PNG
(US9493440, 176)
Show SMILES CC1(CC1)Oc1cc2c(n[nH]c2cc1F)-c1cc(ncn1)N1CCN(CC2CCCO2)CC1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound (98 uM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well bla...


US Patent US9493440 (2016)


BindingDB Entry DOI: 10.7270/Q2668C4X
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)(G2019S)


(Homo sapiens (Human))
BDBM257193
PNG
(US9493440, 37)
Show SMILES CN1CC2(CC1=O)CCN(CC2)c1cc(ncn1)-c1n[nH]c2ccc(OC3(C)CC3)cc12
Show InChI InChI=1S/C24H28N6O2/c1-23(5-6-23)32-16-3-4-18-17(11-16)22(28-27-18)19-12-20(26-15-25-19)30-9-7-24(8-10-30)13-21(31)29(2)14-24/h3-4,11-12,15H,5-10,13-14H2,1-2H3,(H,27,28)
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound (98 uM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well bla...


US Patent US9493440 (2016)


BindingDB Entry DOI: 10.7270/Q2668C4X
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)(G2019S)


(Homo sapiens (Human))
BDBM257336
PNG
(US9493440, 180)
Show SMILES CC1(CC1)Oc1cc2c(n[nH]c2cc1F)-c1cc(ncn1)N1CCN(CC1)c1nncs1
Show InChI InChI=1S/C21H21FN8OS/c1-21(2-3-21)31-17-8-13-15(9-14(17)22)26-27-19(13)16-10-18(24-11-23-16)29-4-6-30(7-5-29)20-28-25-12-32-20/h8-12H,2-7H2,1H3,(H,26,27)
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n/an/a 0.700n/an/an/an/a8.525



Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound (98 uM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well bla...


US Patent US9493440 (2016)


BindingDB Entry DOI: 10.7270/Q2668C4X
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)(G2019S)


(Homo sapiens (Human))
BDBM257284
PNG
(US9493440, 128)
Show SMILES C[C@H]1CN(CCN1Cc1ccco1)c1cc(ncn1)-c1n[nH]c2ccc(OC3(C)CC3)cc12 |r|
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound (98 uM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well bla...


US Patent US9493440 (2016)


BindingDB Entry DOI: 10.7270/Q2668C4X
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)(G2019S)


(Homo sapiens (Human))
BDBM257292
PNG
(US9493440, 136)
Show SMILES C[C@@H]1CN(CCN1Cc1cocn1)c1cc(ncn1)-c1n[nH]c2ccc(OC3(C)CC3)cc12 |r|
PDB

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Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound (98 uM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well bla...


US Patent US9493440 (2016)


BindingDB Entry DOI: 10.7270/Q2668C4X
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)(G2019S)


(Homo sapiens (Human))
BDBM257271
PNG
(US9493440, 115)
Show SMILES CC1(CC1)Oc1ccc2[nH]nc(-c3cc(ncn3)N3CCN(CC4CCCO4)CC3)c2c1
PDB

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Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound (98 uM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well bla...


US Patent US9493440 (2016)


BindingDB Entry DOI: 10.7270/Q2668C4X
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)(G2019S)


(Homo sapiens (Human))
BDBM257195
PNG
(US9493440, 39)
Show SMILES CN1CCC2(CCN(CC2)c2cc(ncn2)-c2n[nH]c3ccc(OC4(C)CC4)cc23)C1=O
Show InChI InChI=1S/C24H28N6O2/c1-23(5-6-23)32-16-3-4-18-17(13-16)21(28-27-18)19-14-20(26-15-25-19)30-11-8-24(9-12-30)7-10-29(2)22(24)31/h3-4,13-15H,5-12H2,1-2H3,(H,27,28)
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound (98 uM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well bla...


US Patent US9493440 (2016)


BindingDB Entry DOI: 10.7270/Q2668C4X
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)(G2019S)


(Homo sapiens (Human))
BDBM257305
PNG
(US9493440, 149)
Show SMILES CC1(CC1)Oc1cc2c(n[nH]c2cc1F)-c1cc(ncn1)N1CCOCC1
Show InChI InChI=1S/C19H20FN5O2/c1-19(2-3-19)27-16-8-12-14(9-13(16)20)23-24-18(12)15-10-17(22-11-21-15)25-4-6-26-7-5-25/h8-11H,2-7H2,1H3,(H,23,24)
PDB

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Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound (98 uM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well bla...


US Patent US9493440 (2016)


BindingDB Entry DOI: 10.7270/Q2668C4X
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)


(Homo sapiens (Human))
BDBM239190
PNG
(US9416126, A15)
Show SMILES CC(C)N1CCN(CC1)c1cc(ncn1)-c1n[nH]c2ccc(cc12)-c1cnn(C)c1
Show InChI InChI=1S/C22H26N8/c1-15(2)29-6-8-30(9-7-29)21-11-20(23-14-24-21)22-18-10-16(4-5-19(18)26-27-22)17-12-25-28(3)13-17/h4-5,10-15H,6-9H2,1-3H3,(H,26,27)
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n/an/a 0.730n/an/an/an/a8.525



Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound(98 μM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well...


US Patent US9416126 (2016)


BindingDB Entry DOI: 10.7270/Q2D50KV9
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)(G2019S)


(Homo sapiens (Human))
BDBM257381
PNG
(US9493440, 231)
Show SMILES CC1(CC1)Oc1ccc2[nH]nc(-c3cc(ncn3)N3CCN(CCO)C(=O)C3)c2c1
Show InChI InChI=1S/C21H24N6O3/c1-21(4-5-21)30-14-2-3-16-15(10-14)20(25-24-16)17-11-18(23-13-22-17)27-7-6-26(8-9-28)19(29)12-27/h2-3,10-11,13,28H,4-9,12H2,1H3,(H,24,25)
PDB

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Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound (98 uM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well bla...


US Patent US9493440 (2016)


BindingDB Entry DOI: 10.7270/Q2668C4X
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)(G2019S)


(Homo sapiens (Human))
BDBM257181
PNG
(BDBM257382 | US9493440, 23)
Show SMILES CC1(CC1)Oc1ccc2[nH]nc(-c3cc(ncn3)N3CCO[C@@H](CO)C3)c2c1 |r|
PDB

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Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound (98 uM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well bla...


US Patent US9493440 (2016)


BindingDB Entry DOI: 10.7270/Q2668C4X
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)


(Homo sapiens (Human))
BDBM239542
PNG
(US9416126, U26)
Show SMILES COc1ccncc1-c1ccc2[nH]nc(-c3cc(ncn3)N3C[C@H](C)O[C@H](C)C3)c2c1 |r|
PDB

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Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound(98 μM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well...


US Patent US9416126 (2016)


BindingDB Entry DOI: 10.7270/Q2D50KV9
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)(G2019S)


(Homo sapiens (Human))
BDBM257181
PNG
(BDBM257382 | US9493440, 23)
Show SMILES CC1(CC1)Oc1ccc2[nH]nc(-c3cc(ncn3)N3CCO[C@@H](CO)C3)c2c1 |r|
PDB

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Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound (98 uM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well bla...


US Patent US9493440 (2016)


BindingDB Entry DOI: 10.7270/Q2668C4X
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)


(Homo sapiens (Human))
BDBM239082
PNG
(US9416126, A8)
Show SMILES CCN1CCN(CC1)c1cc(ncn1)-c1n[nH]c2ccc(cc12)-c1cnn(C)c1
Show InChI InChI=1S/C21H24N8/c1-3-28-6-8-29(9-7-28)20-11-19(22-14-23-20)21-17-10-15(4-5-18(17)25-26-21)16-12-24-27(2)13-16/h4-5,10-14H,3,6-9H2,1-2H3,(H,25,26)
PDB

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n/an/a 0.760n/an/an/an/a8.525



Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound(98 μM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well b...


US Patent US9416126 (2016)


BindingDB Entry DOI: 10.7270/Q2D50KV9
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)(G2019S)


(Homo sapiens (Human))
BDBM257182
PNG
(BDBM257383 | US9493440, 24)
Show SMILES CC1(CC1)Oc1ccc2[nH]nc(-c3cc(ncn3)N3CCO[C@H](CO)C3)c2c1 |r|
PDB

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Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound (98 uM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well bla...


US Patent US9493440 (2016)


BindingDB Entry DOI: 10.7270/Q2668C4X
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)(G2019S)


(Homo sapiens (Human))
BDBM257182
PNG
(BDBM257383 | US9493440, 24)
Show SMILES CC1(CC1)Oc1ccc2[nH]nc(-c3cc(ncn3)N3CCO[C@H](CO)C3)c2c1 |r|
PDB

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n/an/a 0.780n/an/an/an/a8.525



Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound (98 uM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well bla...


US Patent US9493440 (2016)


BindingDB Entry DOI: 10.7270/Q2668C4X
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)(G2019S)


(Homo sapiens (Human))
BDBM257306
PNG
(US9493440, 150)
Show SMILES C[C@H]1CN(C[C@@H](C)O1)c1cc(ncn1)-c1n[nH]c2cc(F)c(OC3(C)CC3)cc12 |r|
PDB

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Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound (98 uM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well bla...


US Patent US9493440 (2016)


BindingDB Entry DOI: 10.7270/Q2668C4X
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)(G2019S)


(Homo sapiens (Human))
BDBM257378
PNG
(US9493440, 228)
Show SMILES CC1(CC1)Oc1ccc2[nH]nc(-c3cc(ncn3)N3CCC(O)CC3)c2c1
Show InChI InChI=1S/C20H23N5O2/c1-20(6-7-20)27-14-2-3-16-15(10-14)19(24-23-16)17-11-18(22-12-21-17)25-8-4-13(26)5-9-25/h2-3,10-13,26H,4-9H2,1H3,(H,23,24)
PDB

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Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound (98 uM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well bla...


US Patent US9493440 (2016)


BindingDB Entry DOI: 10.7270/Q2668C4X
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)(G2019S)


(Homo sapiens (Human))
BDBM257290
PNG
(US9493440, 134)
Show SMILES C[C@H]1CN(CCN1CCC(F)(F)F)c1cc(ncn1)-c1n[nH]c2ccc(OC3(C)CC3)cc12 |r|
PDB

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Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound (98 uM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well bla...


US Patent US9493440 (2016)


BindingDB Entry DOI: 10.7270/Q2668C4X
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)(G2019S)


(Homo sapiens (Human))
BDBM257351
PNG
(US9493440, 195)
Show SMILES COCC(=O)N1CCN(CC1)c1cc(ncn1)-c1n[nH]c2cc(F)c(OC3(C)CC3)cc12
Show InChI InChI=1S/C22H25FN6O3/c1-22(3-4-22)32-18-9-14-16(10-15(18)23)26-27-21(14)17-11-19(25-13-24-17)28-5-7-29(8-6-28)20(30)12-31-2/h9-11,13H,3-8,12H2,1-2H3,(H,26,27)
PDB

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Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound (98 uM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well bla...


US Patent US9493440 (2016)


BindingDB Entry DOI: 10.7270/Q2668C4X
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)(G2019S)


(Homo sapiens (Human))
BDBM257300
PNG
(US9493440, 144)
Show SMILES CC(C)N1CCN(C[C@H]1C)c1cc(ncn1)-c1n[nH]c2ccc(OC3(C)CC3)cc12 |r|
PDB

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Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound (98 uM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well bla...


US Patent US9493440 (2016)


BindingDB Entry DOI: 10.7270/Q2668C4X
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)(G2019S)


(Homo sapiens (Human))
BDBM257256
PNG
(US9493440, 100)
Show SMILES CC1(CC1)Oc1ccc2[nH]nc(-c3cc(ncn3)N3CCN(CC3)C3CCS(=O)(=O)C3)c2c1
PDB

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Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound (98 uM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well bla...


US Patent US9493440 (2016)


BindingDB Entry DOI: 10.7270/Q2668C4X
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)(G2019S)


(Homo sapiens (Human))
BDBM257298
PNG
(US9493440, 142)
Show SMILES CCN1CCN(C[C@H]1C)c1cc(ncn1)-c1n[nH]c2ccc(OC3(C)CC3)cc12 |r|
PDB

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Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound (98 uM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well bla...


US Patent US9493440 (2016)


BindingDB Entry DOI: 10.7270/Q2668C4X
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)(G2019S)


(Homo sapiens (Human))
BDBM257261
PNG
(US9493440, 105)
Show SMILES COCC1CN(CCO1)c1cc(ncn1)-c1n[nH]c2ccc(OC3(C)CC3)cc12
PDB

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Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound (98 uM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well bla...


US Patent US9493440 (2016)


BindingDB Entry DOI: 10.7270/Q2668C4X
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)(G2019S)


(Homo sapiens (Human))
BDBM257322
PNG
(US9493440, 166)
Show SMILES CC1(CC1)Oc1cc2c(n[nH]c2cc1F)-c1cc(ncn1)N1CCN(CC1)C1CCS(=O)(=O)C1
PDB

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Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound (98 uM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well bla...


US Patent US9493440 (2016)


BindingDB Entry DOI: 10.7270/Q2668C4X
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2)(G2019S)


(Homo sapiens (Human))
BDBM257188
PNG
(US9493440, 32)
Show SMILES CC1(CC1)Oc1ccc2[nH]nc(-c3cc(ncn3)N3CCC4(CCC(=O)N4)CC3)c2c1
Show InChI InChI=1S/C23H26N6O2/c1-22(6-7-22)31-15-2-3-17-16(12-15)21(28-27-17)18-13-19(25-14-24-18)29-10-8-23(9-11-29)5-4-20(30)26-23/h2-3,12-14H,4-11H2,1H3,(H,26,30)(H,27,28)
PDB

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 0.860n/an/an/an/a8.525



Merck Sharp & Dohme Corp.

US Patent


Assay Description
a) 400 nl of a 1:2.15 serial dilution of test compound (98 uM top assay concentration) is spotted via Labcyte Echo to certain wells in a 384 well bla...


US Patent US9493440 (2016)


BindingDB Entry DOI: 10.7270/Q2668C4X
More data for this
Ligand-Target Pair
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