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Patent code US9751881

Compile Data Set for Download or QSAR
Found 118 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
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338554
PNG
(US9751881, Example 83)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CCN(C2)c2cnc(cn2)C#N)CC1
Show InChI InChI=1S/C24H27N5O3/c1-16-18(2-3-19-20(16)14-32-23(19)31)21(30)13-28-7-4-24(5-8-28)6-9-29(15-24)22-12-26-17(10-25)11-27-22/h2-3,11-12,21,30H,4-9,13-15H2,1H3/t21-/m0/s1
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US Patent
n/an/a 4.70n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338561
PNG
(US9751881, Example 90)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CCN(C2)c2ncc(s2)C#N)CC1
Show InChI InChI=1S/C23H26N4O3S/c1-15-17(2-3-18-19(15)13-30-21(18)29)20(28)12-26-7-4-23(5-8-26)6-9-27(14-23)22-25-11-16(10-24)31-22/h2-3,11,20,28H,4-9,12-14H2,1H3/t20-/m0/s1
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n/an/a 6.70n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338582
PNG
(US9751881, Example 111)
Show SMILES Cc1c2COC(=O)c2ccc1C(O)CN1CCC2(CC1)CCN(CC2)c1cnc(cn1)C#N
Show InChI InChI=1S/C25H29N5O3/c1-17-19(2-3-20-21(17)16-33-24(20)32)22(31)15-29-8-4-25(5-9-29)6-10-30(11-7-25)23-14-27-18(12-26)13-28-23/h2-3,13-14,22,31H,4-11,15-16H2,1H3
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n/an/a 9.62n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM50121344
PNG
(CHEMBL3622105 | US9751881, Example 3)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CCN(C2)c2ccc(cn2)C#N)CC1
Show InChI InChI=1S/C25H28N4O3/c1-17-19(3-4-20-21(17)15-32-24(20)31)22(30)14-28-9-6-25(7-10-28)8-11-29(16-25)23-5-2-18(12-26)13-27-23/h2-5,13,22,30H,6-11,14-16H2,1H3/t22-/m0/s1
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n/an/a 10n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM50121355
PNG
(CHEMBL3622112 | US9751881, Example 81)
Show SMILES Cc1cc(cnc1C#N)N1CCC2(C1)CCN(C[C@H](O)c1ccc3C(=O)OCc3c1C)CC2
Show InChI InChI=1S/C26H30N4O3/c1-17-11-19(13-28-23(17)12-27)30-10-7-26(16-30)5-8-29(9-6-26)14-24(31)20-3-4-21-22(18(20)2)15-33-25(21)32/h3-4,11,13,24,31H,5-10,14-16H2,1-2H3/t24-/m0/s1
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n/an/a 10.1n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM50121345
PNG
(CHEMBL3622104 | US9751881, Example 1)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CN(C(=O)C2)c2ccc(cn2)C#N)CC1
Show InChI InChI=1S/C25H26N4O4/c1-16-18(3-4-19-20(16)14-33-24(19)32)21(30)13-28-8-6-25(7-9-28)10-23(31)29(15-25)22-5-2-17(11-26)12-27-22/h2-5,12,21,30H,6-10,13-15H2,1H3/t21-/m0/s1
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n/an/a 10.5n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM50121363
PNG
(CHEMBL3622106 | US9751881, Example 4)
Show SMILES Cc1c2COC(=O)c2ccc1CCN1CCC2(CN(C(=O)C2)c2ccc(cn2)C#N)CC1
Show InChI InChI=1S/C25H26N4O3/c1-17-19(3-4-20-21(17)15-32-24(20)31)6-9-28-10-7-25(8-11-28)12-23(30)29(16-25)22-5-2-18(13-26)14-27-22/h2-5,14H,6-12,15-16H2,1H3
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n/an/a 12n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338576
PNG
(US9751881, Example 105)
Show SMILES Cc1c2COC(=O)c2ccc1C(O)CN1CCC2(CC1)CCN(CC2)c1ccc(nn1)C#N
Show InChI InChI=1S/C25H29N5O3/c1-17-19(3-4-20-21(17)16-33-24(20)32)22(31)15-29-10-6-25(7-11-29)8-12-30(13-9-25)23-5-2-18(14-26)27-28-23/h2-5,22,31H,6-13,15-16H2,1H3
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n/an/a 13.5n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM50121362
PNG
(CHEMBL3622107 | US9751881, Example 9)
Show SMILES Cc1nc(ccc1C#N)N1CCC2(C1)CCN(C[C@H](O)c1ccc3C(=O)OCc3c1C)CC2
Show InChI InChI=1S/C26H30N4O3/c1-17-20(4-5-21-22(17)15-33-25(21)32)23(31)14-29-10-7-26(8-11-29)9-12-30(16-26)24-6-3-19(13-27)18(2)28-24/h3-6,23,31H,7-12,14-16H2,1-2H3/t23-/m0/s1
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n/an/a 14n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338550
PNG
(US9751881, Example 79)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](N)CN1CCC2(CCN(C2)c2ccc(cn2)C#N)CC1
Show InChI InChI=1S/C25H29N5O2/c1-17-19(3-4-20-21(17)15-32-24(20)31)22(27)14-29-9-6-25(7-10-29)8-11-30(16-25)23-5-2-18(12-26)13-28-23/h2-5,13,22H,6-11,14-16,27H2,1H3/t22-/m0/s1
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n/an/a 14.1n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338580
PNG
(US9751881, Example 109)
Show SMILES Cc1c2COC(=O)c2ccc1C(O)CN1CCC2(CC1)CCN(CC2)c1ncc(cn1)C#N
Show InChI InChI=1S/C25H29N5O3/c1-17-19(2-3-20-21(17)16-33-23(20)32)22(31)15-29-8-4-25(5-9-29)6-10-30(11-7-25)24-27-13-18(12-26)14-28-24/h2-3,13-14,22,31H,4-11,15-16H2,1H3
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338482
PNG
(US9751881, Example 14)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CN(C(=O)C2)c2ccc(cc2)C#N)CC1
Show InChI InChI=1S/C26H27N3O4/c1-17-20(6-7-21-22(17)15-33-25(21)32)23(30)14-28-10-8-26(9-11-28)12-24(31)29(16-26)19-4-2-18(13-27)3-5-19/h2-7,23,30H,8-12,14-16H2,1H3/t23-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338573
PNG
(US9751881, Example 102)
Show SMILES COc1cc(ncc1C#N)N1CC2(CCN(C[C@H](O)c3ccc4C(=O)OCc4c3C)CC2)OCC1=O
Show InChI InChI=1S/C26H28N4O6/c1-16-18(3-4-19-20(16)13-35-25(19)33)21(31)12-29-7-5-26(6-8-29)15-30(24(32)14-36-26)23-9-22(34-2)17(10-27)11-28-23/h3-4,9,11,21,31H,5-8,12-15H2,1-2H3/t21-/m0/s1
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n/an/a 16.7n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM50121361
PNG
(CHEMBL3622108 | US9751881, Example 10)
Show SMILES Cc1cc(ncc1C#N)N1CCC2(C1)CCN(C[C@H](O)c1ccc3C(=O)OCc3c1C)CC2
Show InChI InChI=1S/C26H30N4O3/c1-17-11-24(28-13-19(17)12-27)30-10-7-26(16-30)5-8-29(9-6-26)14-23(31)20-3-4-21-22(18(20)2)15-33-25(21)32/h3-4,11,13,23,31H,5-10,14-16H2,1-2H3/t23-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338492
PNG
(US9751881, Example 24A | US9751881, Example 24B)
Show SMILES Cc1cc2C(=O)OCc2cc1C(O)CN1CCC2(CCN(C2)c2ccc(cn2)C#N)CC1
Show InChI InChI=1S/C25H28N4O3/c1-17-10-21-19(15-32-24(21)31)11-20(17)22(30)14-28-7-4-25(5-8-28)6-9-29(16-25)23-3-2-18(12-26)13-27-23/h2-3,10-11,13,22,30H,4-9,14-16H2,1H3
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n/an/a 17.6n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338524
PNG
(US9751881, Example 53)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(C1)CCN(CC2)c1ccc(cn1)C#N
Show InChI InChI=1S/C25H28N4O3/c1-17-19(3-4-20-21(17)15-32-24(20)31)22(30)14-28-9-6-25(16-28)7-10-29(11-8-25)23-5-2-18(12-26)13-27-23/h2-5,13,22,30H,6-11,14-16H2,1H3/t22-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM50121360
PNG
(CHEMBL3622109 | US9751881, Example 11)
Show SMILES Cc1cc(cnc1N1CCC2(C1)CCN(C[C@H](O)c1ccc3C(=O)OCc3c1C)CC2)C#N
Show InChI InChI=1S/C26H30N4O3/c1-17-11-19(12-27)13-28-24(17)30-10-7-26(16-30)5-8-29(9-6-26)14-23(31)20-3-4-21-22(18(20)2)15-33-25(21)32/h3-4,11,13,23,31H,5-10,14-16H2,1-2H3/t23-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338470
PNG
(US9751881, Example 7 | US9751881, Example 82)
Show SMILES COc1cc(ncc1C#N)N1CCC2(C1)CCN(C[C@H](O)c1ccc3C(=O)OCc3c1C)CC2
Show InChI InChI=1S/C26H30N4O4/c1-17-19(3-4-20-21(17)15-34-25(20)32)22(31)14-29-8-5-26(6-9-29)7-10-30(16-26)24-11-23(33-2)18(12-27)13-28-24/h3-4,11,13,22,31H,5-10,14-16H2,1-2H3/t22-/m0/s1
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n/an/a 21.5n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338345
PNG
(US9751881, Example 2)
Show SMILES Cc1cc2C(=O)OCc2cc1C(O)CN1CCC2(CN(C(=O)C2)c2ccc(cn2)C#N)CC1
Show InChI InChI=1S/C25H26N4O4/c1-16-8-20-18(14-33-24(20)32)9-19(16)21(30)13-28-6-4-25(5-7-28)10-23(31)29(15-25)22-3-2-17(11-26)12-27-22/h2-3,8-9,12,21,30H,4-7,10,13-15H2,1H3
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n/an/a 23n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338481
PNG
(US9751881, Example 13)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CCN(C2)c2cc(ccn2)C#N)CC1
Show InChI InChI=1S/C25H28N4O3/c1-17-19(2-3-20-21(17)15-32-24(20)31)22(30)14-28-9-5-25(6-10-28)7-11-29(16-25)23-12-18(13-26)4-8-27-23/h2-4,8,12,22,30H,5-7,9-11,14-16H2,1H3/t22-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338575
PNG
(US9751881, Example 104)
Show SMILES Cc1c2COC(=O)c2ccc1C(O)CN1CCC2(CC1)CCN(CC2)c1ccc(cn1)C#N
Show InChI InChI=1S/C26H30N4O3/c1-18-20(3-4-21-22(18)17-33-25(21)32)23(31)16-29-10-6-26(7-11-29)8-12-30(13-9-26)24-5-2-19(14-27)15-28-24/h2-5,15,23,31H,6-13,16-17H2,1H3
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n/an/a 26n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338577
PNG
(US9751881, Example 106)
Show SMILES Cc1c2COC(=O)c2ccc1C(O)CN1CCC2(CC1)CCN(CC2)c1cc(ncn1)C#N
Show InChI InChI=1S/C25H29N5O3/c1-17-19(2-3-20-21(17)15-33-24(20)32)22(31)14-29-8-4-25(5-9-29)6-10-30(11-7-25)23-12-18(13-26)27-16-28-23/h2-3,12,16,22,31H,4-11,14-15H2,1H3
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n/an/a 26.3n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338492
PNG
(US9751881, Example 24A | US9751881, Example 24B)
Show SMILES Cc1cc2C(=O)OCc2cc1C(O)CN1CCC2(CCN(C2)c2ccc(cn2)C#N)CC1
Show InChI InChI=1S/C25H28N4O3/c1-17-10-21-19(15-32-24(21)31)11-20(17)22(30)14-28-7-4-25(5-8-28)6-9-29(16-25)23-3-2-18(12-26)13-27-23/h2-3,10-11,13,22,30H,4-9,14-16H2,1H3
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n/an/a 31.4n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338470
PNG
(US9751881, Example 7 | US9751881, Example 82)
Show SMILES COc1cc(ncc1C#N)N1CCC2(C1)CCN(C[C@H](O)c1ccc3C(=O)OCc3c1C)CC2
Show InChI InChI=1S/C26H30N4O4/c1-17-19(3-4-20-21(17)15-34-25(20)32)22(31)14-29-8-5-26(6-9-29)7-10-30(16-26)24-11-23(33-2)18(12-27)13-28-24/h3-4,11,13,22,31H,5-10,14-16H2,1-2H3/t22-/m0/s1
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n/an/a 32.8n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338530
PNG
(US9751881, Example 59)
Show SMILES COc1cc(ncc1C#N)N1CC2(CC1=O)CCN(C[C@H](O)c1ccc3C(=O)OCc3c1C)CC2
Show InChI InChI=1S/C26H28N4O5/c1-16-18(3-4-19-20(16)14-35-25(19)33)21(31)13-29-7-5-26(6-8-29)10-24(32)30(15-26)23-9-22(34-2)17(11-27)12-28-23/h3-4,9,12,21,31H,5-8,10,13-15H2,1-2H3/t21-/m0/s1
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n/an/a 32.9n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM50235201
PNG
(CHEMBL4066423)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CCN(C2)c2cncc(c2)C#N)CC1
Show InChI InChI=1S/C25H28N4O3/c1-17-20(2-3-21-22(17)15-32-24(21)31)23(30)14-28-7-4-25(5-8-28)6-9-29(16-25)19-10-18(11-26)12-27-13-19/h2-3,10,12-13,23,30H,4-9,14-16H2,1H3/t23-/m0/s1
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n/an/a 33n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338440
PNG
(US9751881, Example 5)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CCN(C2=O)c2ccc(cn2)C#N)CC1
Show InChI InChI=1S/C25H26N4O4/c1-16-18(3-4-19-20(16)15-33-23(19)31)21(30)14-28-9-6-25(7-10-28)8-11-29(24(25)32)22-5-2-17(12-26)13-27-22/h2-5,13,21,30H,6-11,14-15H2,1H3/t21-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338512
PNG
(US9751881, Example 43)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CCCN(C2)c2ncc(cn2)-n2cnnn2)CC1
Show InChI InChI=1S/C25H30N8O3/c1-17-19(3-4-20-21(17)14-36-23(20)35)22(34)13-31-9-6-25(7-10-31)5-2-8-32(15-25)24-26-11-18(12-27-24)33-16-28-29-30-33/h3-4,11-12,16,22,34H,2,5-10,13-15H2,1H3/t22-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338476
PNG
(US9751881, Example 8)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CCN(C2)c2ccc(cn2)-n2cnnn2)CC1
Show InChI InChI=1S/C25H29N7O3/c1-17-19(3-4-20-21(17)14-35-24(20)34)22(33)13-30-9-6-25(7-10-30)8-11-31(15-25)23-5-2-18(12-26-23)32-16-27-28-29-32/h2-5,12,16,22,33H,6-11,13-15H2,1H3/t22-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338572
PNG
(US9751881, Example 101)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CC1)CN(CCO2)c1ccc(cn1)C#N
Show InChI InChI=1S/C25H28N4O4/c1-17-19(3-4-20-21(17)15-32-24(20)31)22(30)14-28-8-6-25(7-9-28)16-29(10-11-33-25)23-5-2-18(12-26)13-27-23/h2-5,13,22,30H,6-11,14-16H2,1H3/t22-/m0/s1
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n/an/a 39.6n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM50235200
PNG
(CHEMBL4098260)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CCN(C2)c2ccc(cn2)S(C)(=O)=O)CC1
Show InChI InChI=1S/C25H31N3O5S/c1-17-19(4-5-20-21(17)15-33-24(20)30)22(29)14-27-10-7-25(8-11-27)9-12-28(16-25)23-6-3-18(13-26-23)34(2,31)32/h3-6,13,22,29H,7-12,14-16H2,1-2H3/t22-/m0/s1
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n/an/a 41.1n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338500
PNG
(US9751881, Example 31)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CCN(C2)c2ccc(cc2)S(C)(=O)=O)CC1
Show InChI InChI=1S/C26H32N2O5S/c1-18-21(7-8-22-23(18)16-33-25(22)30)24(29)15-27-12-9-26(10-13-27)11-14-28(17-26)19-3-5-20(6-4-19)34(2,31)32/h3-8,24,29H,9-17H2,1-2H3/t24-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338519
PNG
(US9751881, Example 50)
Show SMILES COc1cc(ncc1C#N)N1CC2(C1)CCN(C[C@H](O)c1ccc3C(=O)OCc3c1C)CC2
Show InChI InChI=1S/C25H28N4O4/c1-16-18(3-4-19-20(16)13-33-24(19)31)21(30)12-28-7-5-25(6-8-28)14-29(15-25)23-9-22(32-2)17(10-26)11-27-23/h3-4,9,11,21,30H,5-8,12-15H2,1-2H3/t21-/m0/s1
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n/an/a 42.4n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM50235196
PNG
(CHEMBL4064760)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CCN(C2)c2cnc(cn2)S(C)(=O)=O)CC1
Show InChI InChI=1S/C24H30N4O5S/c1-16-17(3-4-18-19(16)14-33-23(18)30)20(29)13-27-8-5-24(6-9-27)7-10-28(15-24)21-11-26-22(12-25-21)34(2,31)32/h3-4,11-12,20,29H,5-10,13-15H2,1-2H3/t20-/m0/s1
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n/an/a 44.1n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338522
PNG
(US9751881, Example 52A)
Show SMILES C[C@H]1Cc2cc(ccc2C(=O)O1)C(O)CN1CCC2(CN(C2)c2ccc(cn2)C#N)CC1
Show InChI InChI=1S/C25H28N4O3/c1-17-10-20-11-19(3-4-21(20)24(31)32-17)22(30)14-28-8-6-25(7-9-28)15-29(16-25)23-5-2-18(12-26)13-27-23/h2-5,11,13,17,22,30H,6-10,14-16H2,1H3/t17-,22?/m0/s1
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n/an/a 48.7n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338529
PNG
(US9751881, Example 58)
Show SMILES COc1cc(ncc1C#N)N1CCC2(CCN(C[C@H](O)c3ccc4C(=O)OCc4c3C)CC2)C1=O
Show InChI InChI=1S/C26H28N4O5/c1-16-18(3-4-19-20(16)15-35-24(19)32)21(31)14-29-8-5-26(6-9-29)7-10-30(25(26)33)23-11-22(34-2)17(12-27)13-28-23/h3-4,11,13,21,31H,5-10,14-15H2,1-2H3/t21-/m0/s1
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n/an/a 49.4n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338489
PNG
(US9751881, Example 21)
Show SMILES CC1Cc2cc(ccc2C(=O)O1)C(O)CN1CCC2(CCN(C2)c2ccc(cn2)C#N)CC1
Show InChI InChI=1S/C26H30N4O3/c1-18-12-21-13-20(3-4-22(21)25(32)33-18)23(31)16-29-9-6-26(7-10-29)8-11-30(17-26)24-5-2-19(14-27)15-28-24/h2-5,13,15,18,23,31H,6-12,16-17H2,1H3
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338557
PNG
(US9751881, Example 86)
Show SMILES COc1cc(ccc1N1CCC2(C1)CCN(C[C@H](O)c1ccc3C(=O)OCc3c1C)CC2)C#N
Show InChI InChI=1S/C27H31N3O4/c1-18-20(4-5-21-22(18)16-34-26(21)32)24(31)15-29-10-7-27(8-11-29)9-12-30(17-27)23-6-3-19(14-28)13-25(23)33-2/h3-6,13,24,31H,7-12,15-17H2,1-2H3/t24-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338497
PNG
(US9751881, Example 28)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1C2CCC1CC1(CCN(C1)c1ccc(cn1)C#N)C2
Show InChI InChI=1S/C27H30N4O3/c1-17-21(5-6-22-23(17)15-34-26(22)33)24(32)14-31-19-3-4-20(31)11-27(10-19)8-9-30(16-27)25-7-2-18(12-28)13-29-25/h2,5-7,13,19-20,24,32H,3-4,8-11,14-16H2,1H3/t19?,20?,24-,27?/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338484
PNG
(US9751881, Example 16)
Show SMILES COc1cc(ccc1C#N)N1CC2(CC1=O)CCN(C[C@H](O)c1ccc3C(=O)OCc3c1C)CC2
Show InChI InChI=1S/C27H29N3O5/c1-17-20(5-6-21-22(17)15-35-26(21)33)23(31)14-29-9-7-27(8-10-29)12-25(32)30(16-27)19-4-3-18(13-28)24(11-19)34-2/h3-6,11,23,31H,7-10,12,14-16H2,1-2H3/t23-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM50235198
PNG
(CHEMBL4066256)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CN(C(=O)C2)c2ccc(cn2)S(C)(=O)=O)CC1
Show InChI InChI=1S/C25H29N3O6S/c1-16-18(4-5-19-20(16)14-34-24(19)31)21(29)13-27-9-7-25(8-10-27)11-23(30)28(15-25)22-6-3-17(12-26-22)35(2,32)33/h3-6,12,21,29H,7-11,13-15H2,1-2H3/t21-/m0/s1
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n/an/a 53.4n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338531
PNG
(US9751881, Example 60)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CCN(C2)c2ccnc(c2)C#N)CC1
Show InChI InChI=1S/C25H28N4O3/c1-17-20(2-3-21-22(17)15-32-24(21)31)23(30)14-28-9-5-25(6-10-28)7-11-29(16-25)19-4-8-27-18(12-19)13-26/h2-4,8,12,23,30H,5-7,9-11,14-16H2,1H3/t23-/m0/s1
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n/an/a 54.4n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338532
PNG
(US9751881, Example 61)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CCCN(C2)c2ccc(cn2)S(C)(=O)=O)CC1
Show InChI InChI=1S/C26H33N3O5S/c1-18-20(5-6-21-22(18)16-34-25(21)31)23(30)15-28-12-9-26(10-13-28)8-3-11-29(17-26)24-7-4-19(14-27-24)35(2,32)33/h4-7,14,23,30H,3,8-13,15-17H2,1-2H3/t23-/m0/s1
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n/an/a 56n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338483
PNG
(US9751881, Example 15)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CCN(C2)c2ncc(cn2)-n2cnnn2)CC1
Show InChI InChI=1S/C24H28N8O3/c1-16-18(2-3-19-20(16)13-35-22(19)34)21(33)12-30-7-4-24(5-8-30)6-9-31(14-24)23-25-10-17(11-26-23)32-15-27-28-29-32/h2-3,10-11,15,21,33H,4-9,12-14H2,1H3/t21-/m0/s1
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n/an/a 57n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338528
PNG
(US9751881, Example 57)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CCN(C2=O)c2ccc(nn2)S(C)(=O)=O)CC1
Show InChI InChI=1S/C24H28N4O6S/c1-15-16(3-4-17-18(15)14-34-22(17)30)19(29)13-27-10-7-24(8-11-27)9-12-28(23(24)31)20-5-6-21(26-25-20)35(2,32)33/h3-6,19,29H,7-14H2,1-2H3/t19-/m0/s1
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n/an/a 59.2n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338507
PNG
(US9751881, Example 38)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CCN(C2)c2ncc(s2)S(C)(=O)=O)CC1
Show InChI InChI=1S/C23H29N3O5S2/c1-15-16(3-4-17-18(15)13-31-21(17)28)19(27)12-25-8-5-23(6-9-25)7-10-26(14-23)22-24-11-20(32-22)33(2,29)30/h3-4,11,19,27H,5-10,12-14H2,1-2H3/t19-/m0/s1
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n/an/a 60n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338548
PNG
(US9751881, Example 77)
Show SMILES CN[C@@H](CN1CCC2(CCN(C2)c2ccc(cn2)C#N)CC1)c1ccc2C(=O)OCc2c1C
Show InChI InChI=1S/C26H31N5O2/c1-18-20(4-5-21-22(18)16-33-25(21)32)23(28-2)15-30-10-7-26(8-11-30)9-12-31(17-26)24-6-3-19(13-27)14-29-24/h3-6,14,23,28H,7-12,15-17H2,1-2H3/t23-/m0/s1
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n/an/a 61.3n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338551
PNG
(US9751881, Example 80)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CCN(C2)c2ccc(cc2)-n2ccnn2)CC1
Show InChI InChI=1S/C27H31N5O3/c1-19-22(6-7-23-24(19)17-35-26(23)34)25(33)16-30-12-8-27(9-13-30)10-14-31(18-27)20-2-4-21(5-3-20)32-15-11-28-29-32/h2-7,11,15,25,33H,8-10,12-14,16-18H2,1H3/t25-/m0/s1
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n/an/a 63.5n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338538
PNG
(US9751881, Example 67)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CN(C(=O)C2)c2ccc(c(F)c2)S(C)(=O)=O)CC1
Show InChI InChI=1S/C26H29FN2O6S/c1-16-18(4-5-19-20(16)14-35-25(19)32)22(30)13-28-9-7-26(8-10-28)12-24(31)29(15-26)17-3-6-23(21(27)11-17)36(2,33)34/h3-6,11,22,30H,7-10,12-15H2,1-2H3/t22-/m0/s1
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n/an/a 68n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338523
PNG
(US9751881, Example 52B)
Show SMILES C[C@@H]1Cc2cc(ccc2C(=O)O1)C(O)CN1CCC2(CN(C2)c2ccc(cn2)C#N)CC1
Show InChI InChI=1S/C25H28N4O3/c1-17-10-20-11-19(3-4-21(20)24(31)32-17)22(30)14-28-8-6-25(7-9-28)15-29(16-25)23-5-2-18(12-26)13-27-23/h2-5,11,13,17,22,30H,6-10,14-16H2,1H3/t17-,22?/m1/s1
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n/an/a 69.9n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338549
PNG
(US9751881, Example 78)
Show SMILES Cc1c2COC(=O)c2ccc1[C@H](CN1CCC2(CCN(C2)c2ccc(cn2)C#N)CC1)NCC=C
Show InChI InChI=1S/C28H33N5O2/c1-3-11-30-25(22-5-6-23-24(20(22)2)18-35-27(23)34)17-32-12-8-28(9-13-32)10-14-33(19-28)26-7-4-21(15-29)16-31-26/h3-7,16,25,30H,1,8-14,17-19H2,2H3/t25-/m0/s1
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n/an/a 70.6n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338517
PNG
(US9751881, Example 48)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CN(C2)c2ccc(nn2)S(C)(=O)=O)CC1
Show InChI InChI=1S/C23H28N4O5S/c1-15-16(3-4-17-18(15)12-32-22(17)29)19(28)11-26-9-7-23(8-10-26)13-27(14-23)20-5-6-21(25-24-20)33(2,30)31/h3-6,19,28H,7-14H2,1-2H3/t19-/m0/s1
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n/an/a 71n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM50235197
PNG
(CHEMBL4086237)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CN(C(=O)C2)c2cnc(cn2)S(C)(=O)=O)CC1
Show InChI InChI=1S/C24H28N4O6S/c1-15-16(3-4-17-18(15)13-34-23(17)31)19(29)12-27-7-5-24(6-8-27)9-22(30)28(14-24)20-10-26-21(11-25-20)35(2,32)33/h3-4,10-11,19,29H,5-9,12-14H2,1-2H3/t19-/m0/s1
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n/an/a 74.2n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338494
PNG
(US9751881, Example 25)
Show SMILES OC(CN1CCC2(CCN(C2)c2ccc(cn2)C#N)CC1)c1cc2COC(=O)c2cc1C1CC1
Show InChI InChI=1S/C27H30N4O3/c28-13-18-1-4-25(29-14-18)31-10-7-27(17-31)5-8-30(9-6-27)15-24(32)23-11-20-16-34-26(33)22(20)12-21(23)19-2-3-19/h1,4,11-12,14,19,24,32H,2-3,5-10,15-17H2
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n/an/a 74.4n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM50235211
PNG
(CHEMBL4093830)
Show SMILES Cc1nc(ccc1S(C)(=O)=O)N1CCC2(C1)CCN(C[C@H](O)c1ccc3C(=O)OCc3c1C)CC2
Show InChI InChI=1S/C26H33N3O5S/c1-17-19(4-5-20-21(17)15-34-25(20)31)22(30)14-28-11-8-26(9-12-28)10-13-29(16-26)24-7-6-23(18(2)27-24)35(3,32)33/h4-7,22,30H,8-16H2,1-3H3/t22-/m0/s1
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n/an/a 75.7n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338545
PNG
(US9751881, Example 74)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CN(C(=O)C2)c2ccc(cc2)S(C)(=O)=O)CC1
Show InChI InChI=1S/C26H30N2O6S/c1-17-20(7-8-21-22(17)15-34-25(21)31)23(29)14-27-11-9-26(10-12-27)13-24(30)28(16-26)18-3-5-19(6-4-18)35(2,32)33/h3-8,23,29H,9-16H2,1-2H3/t23-/m0/s1
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n/an/a 82.2n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338534
PNG
(US9751881, Example 63)
Show SMILES CCS(=O)(=O)c1cnc(cn1)N1CCC2(C1)CCN(C[C@H](O)c1ccc3C(=O)OCc3c1C)CC2
Show InChI InChI=1S/C25H32N4O5S/c1-3-35(32,33)23-13-26-22(12-27-23)29-11-8-25(16-29)6-9-28(10-7-25)14-21(30)18-4-5-19-20(17(18)2)15-34-24(19)31/h4-5,12-13,21,30H,3,6-11,14-16H2,1-2H3/t21-/m0/s1
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n/an/a 83.2n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338566
PNG
(US9751881, Example 95)
Show SMILES COc1cc(ncc1C#N)N1CC2(CCN(C[C@H](O)c3ccc4C(=O)OCc4c3C)CC2)OC1=O
Show InChI InChI=1S/C25H26N4O6/c1-15-17(3-4-18-19(15)13-34-23(18)31)20(30)12-28-7-5-25(6-8-28)14-29(24(32)35-25)22-9-21(33-2)16(10-26)11-27-22/h3-4,9,11,20,30H,5-8,12-14H2,1-2H3/t20-/m0/s1
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n/an/a 84n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338526
PNG
(US9751881, Example 55)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CCN(C2=O)c2ccc(nc2)S(C)(=O)=O)CC1
Show InChI InChI=1S/C25H29N3O6S/c1-16-18(4-5-19-20(16)15-34-23(19)30)21(29)14-27-10-7-25(8-11-27)9-12-28(24(25)31)17-3-6-22(26-13-17)35(2,32)33/h3-6,13,21,29H,7-12,14-15H2,1-2H3/t21-/m0/s1
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n/an/a 85.1n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338546
PNG
(US9751881, Example 75)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CCN(C2=O)c2ccc(cc2)S(C)(=O)=O)CC1
Show InChI InChI=1S/C26H30N2O6S/c1-17-20(7-8-21-22(17)16-34-24(21)30)23(29)15-27-12-9-26(10-13-27)11-14-28(25(26)31)18-3-5-19(6-4-18)35(2,32)33/h3-8,23,29H,9-16H2,1-2H3/t23-/m0/s1
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n/an/a 85.2n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338567
PNG
(US9751881, Example 96)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CCN(C2=O)c2ccc(cn2)S(C)(=O)=O)CC1
Show InChI InChI=1S/C25H29N3O6S/c1-16-18(4-5-19-20(16)15-34-23(19)30)21(29)14-27-10-7-25(8-11-27)9-12-28(24(25)31)22-6-3-17(13-26-22)35(2,32)33/h3-6,13,21,29H,7-12,14-15H2,1-2H3/t21-/m0/s1
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n/an/a 86n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338506
PNG
(US9751881, Example 37)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CN(C(=O)C2)c2ncc(s2)S(C)(=O)=O)CC1
Show InChI InChI=1S/C23H27N3O6S2/c1-14-15(3-4-16-17(14)12-32-21(16)29)18(27)11-25-7-5-23(6-8-25)9-19(28)26(13-23)22-24-10-20(33-22)34(2,30)31/h3-4,10,18,27H,5-9,11-13H2,1-2H3/t18-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM50235208
PNG
(CHEMBL4097359)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CCN(C2)c2ccc(nc2)C#N)CC1
Show InChI InChI=1S/C25H28N4O3/c1-17-20(4-5-21-22(17)15-32-24(21)31)23(30)14-28-9-6-25(7-10-28)8-11-29(16-25)19-3-2-18(12-26)27-13-19/h2-5,13,23,30H,6-11,14-16H2,1H3/t23-/m0/s1
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n/an/a 88.7n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338464
PNG
(US9751881, Example 6)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CN(C(=O)C2)c2ccc(cn2)-n2cnnn2)CC1
Show InChI InChI=1S/C25H27N7O4/c1-16-18(3-4-19-20(16)13-36-24(19)35)21(33)12-30-8-6-25(7-9-30)10-23(34)31(14-25)22-5-2-17(11-26-22)32-15-27-28-29-32/h2-5,11,15,21,33H,6-10,12-14H2,1H3/t21-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338536
PNG
(US9751881, Example 65)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(C1)CCN(CC2)c1cnc(cn1)S(C)(=O)=O
Show InChI InChI=1S/C24H30N4O5S/c1-16-17(3-4-18-19(16)14-33-23(18)30)20(29)13-27-8-5-24(15-27)6-9-28(10-7-24)21-11-26-22(12-25-21)34(2,31)32/h3-4,11-12,20,29H,5-10,13-15H2,1-2H3/t20-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338543
PNG
(US9751881, Example 72)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CN(C(=O)C2)c2ccc(nc2)-n2cnnn2)CC1
Show InChI InChI=1S/C25H27N7O4/c1-16-18(3-4-19-20(16)13-36-24(19)35)21(33)12-30-8-6-25(7-9-30)10-23(34)31(14-25)17-2-5-22(26-11-17)32-15-27-28-29-32/h2-5,11,15,21,33H,6-10,12-14H2,1H3/t21-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338547
PNG
(US9751881, Example 76)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CCN(C2=O)c2nnc(s2)S(C)(=O)=O)CC1
Show InChI InChI=1S/C22H26N4O6S2/c1-13-14(3-4-15-16(13)12-32-18(15)28)17(27)11-25-8-5-22(6-9-25)7-10-26(19(22)29)20-23-24-21(33-20)34(2,30)31/h3-4,17,27H,5-12H2,1-2H3/t17-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338510
PNG
(US9751881, Example 41)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CCN(C2)c2ncc(cn2)S(C)(=O)=O)CC1
Show InChI InChI=1S/C24H30N4O5S/c1-16-18(3-4-19-20(16)14-33-22(19)30)21(29)13-27-8-5-24(6-9-27)7-10-28(15-24)23-25-11-17(12-26-23)34(2,31)32/h3-4,11-12,21,29H,5-10,13-15H2,1-2H3/t21-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338537
PNG
(US9751881, Example 66)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CN(C(=O)C2)c2ccc3c(CCS3(=O)=O)c2)CC1
Show InChI InChI=1S/C27H30N2O6S/c1-17-20(3-4-21-22(17)15-35-26(21)32)23(30)14-28-9-7-27(8-10-28)13-25(31)29(16-27)19-2-5-24-18(12-19)6-11-36(24,33)34/h2-5,12,23,30H,6-11,13-16H2,1H3/t23-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338496
PNG
(US9751881, Example 27)
Show SMILES O=C1OCc2c1ccc1C(CN3CCC4(CCN(C4)c4ccc(cn4)C#N)CC3)OCCc21
Show InChI InChI=1S/C26H28N4O3/c27-13-18-1-4-24(28-14-18)30-11-8-26(17-30)6-9-29(10-7-26)15-23-20-2-3-21-22(16-33-25(21)31)19(20)5-12-32-23/h1-4,14,23H,5-12,15-17H2
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM50235207
PNG
(CHEMBL4087753)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CN(C2)c2ccc(cn2)C#N)CC1
Show InChI InChI=1S/C24H26N4O3/c1-16-18(3-4-19-20(16)13-31-23(19)30)21(29)12-27-8-6-24(7-9-27)14-28(15-24)22-5-2-17(10-25)11-26-22/h2-5,11,21,29H,6-9,12-15H2,1H3/t21-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338518
PNG
(US9751881, Example 49)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CN(C2)c2cnc(cn2)S(C)(=O)=O)CC1
Show InChI InChI=1S/C23H28N4O5S/c1-15-16(3-4-17-18(15)12-32-22(17)29)19(28)11-26-7-5-23(6-8-26)13-27(14-23)20-9-25-21(10-24-20)33(2,30)31/h3-4,9-10,19,28H,5-8,11-14H2,1-2H3/t19-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338560
PNG
(US9751881, Example 89)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CCN(C2)c2cccc(c2)C#N)CC1
Show InChI InChI=1S/C26H29N3O3/c1-18-21(5-6-22-23(18)16-32-25(22)31)24(30)15-28-10-7-26(8-11-28)9-12-29(17-26)20-4-2-3-19(13-20)14-27/h2-6,13,24,30H,7-12,15-17H2,1H3/t24-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338563
PNG
(US9751881, Example 92)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CN(C(=O)O2)c2cnc(cn2)S(C)(=O)=O)CC1
Show InChI InChI=1S/C23H26N4O7S/c1-14-15(3-4-16-17(14)12-33-21(16)29)18(28)11-26-7-5-23(6-8-26)13-27(22(30)34-23)19-9-25-20(10-24-19)35(2,31)32/h3-4,9-10,18,28H,5-8,11-13H2,1-2H3/t18-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM50235210
PNG
(CHEMBL4074870)
Show SMILES CCS(=O)(=O)c1cnc(cn1)N1CC2(CC1=O)CCN(C[C@H](O)c1ccc3C(=O)OCc3c1C)CC2
Show InChI InChI=1S/C25H30N4O6S/c1-3-36(33,34)22-12-26-21(11-27-22)29-15-25(10-23(29)31)6-8-28(9-7-25)13-20(30)17-4-5-18-19(16(17)2)14-35-24(18)32/h4-5,11-12,20,30H,3,6-10,13-15H2,1-2H3/t20-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338581
PNG
(US9751881, Example 110)
Show SMILES Cc1c2COC(=O)c2ccc1C(O)CN1CCC2(CC1)CCN(CC2)c1nccnc1C#N
Show InChI InChI=1S/C25H29N5O3/c1-17-18(2-3-19-20(17)16-33-24(19)32)22(31)15-29-10-4-25(5-11-29)6-12-30(13-7-25)23-21(14-26)27-8-9-28-23/h2-3,8-9,22,31H,4-7,10-13,15-16H2,1H3
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338491
PNG
(US9751881, Example 23)
Show SMILES Cc1cc(cnc1S(C)(=O)=O)N1CCC2(C1)CCN(C[C@H](O)c1ccc3C(=O)OCc3c1C)CC2
Show InChI InChI=1S/C26H33N3O5S/c1-17-12-19(13-27-24(17)35(3,32)33)29-11-8-26(16-29)6-9-28(10-7-26)14-23(30)20-4-5-21-22(18(20)2)15-34-25(21)31/h4-5,12-13,23,30H,6-11,14-16H2,1-3H3/t23-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338585
PNG
(US9751881, Example 114)
Show SMILES Cc1nc(ccc1C#N)N1CCC2(CCN(CC(O)c3ccc4C(=O)OCc4c3C)CC2)CC1
Show InChI InChI=1S/C27H32N4O3/c1-18-21(4-5-22-23(18)17-34-26(22)33)24(32)16-30-11-7-27(8-12-30)9-13-31(14-10-27)25-6-3-20(15-28)19(2)29-25/h3-6,24,32H,7-14,16-17H2,1-2H3
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338542
PNG
(US9751881, Example 71)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CN(C(=O)C2)c2nnc(s2)S(C)(=O)=O)CC1
Show InChI InChI=1S/C22H26N4O6S2/c1-13-14(3-4-15-16(13)11-32-19(15)29)17(27)10-25-7-5-22(6-8-25)9-18(28)26(12-22)20-23-24-21(33-20)34(2,30)31/h3-4,17,27H,5-12H2,1-2H3/t17-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338564
PNG
(US9751881, Example 93)
Show SMILES CCS(=O)(=O)c1cnc(cn1)N1CC2(CCN(C[C@H](O)c3ccc4C(=O)OCc4c3C)CC2)OC1=O
Show InChI InChI=1S/C24H28N4O7S/c1-3-36(32,33)21-11-25-20(10-26-21)28-14-24(35-23(28)31)6-8-27(9-7-24)12-19(29)16-4-5-17-18(15(16)2)13-34-22(17)30/h4-5,10-11,19,29H,3,6-9,12-14H2,1-2H3/t19-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338486
PNG
(US9751881, Example 18)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CCN(C2)c2ccc(nn2)C#N)CC1
Show InChI InChI=1S/C24H27N5O3/c1-16-18(3-4-19-20(16)14-32-23(19)31)21(30)13-28-9-6-24(7-10-28)8-11-29(15-24)22-5-2-17(12-25)26-27-22/h2-5,21,30H,6-11,13-15H2,1H3/t21-/m0/s1
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n/an/a 156n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338565
PNG
(US9751881, Example 94)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CN(C(=O)O2)c2ccc(cc2)S(C)(=O)=O)CC1
Show InChI InChI=1S/C25H28N2O7S/c1-16-19(7-8-20-21(16)14-33-23(20)29)22(28)13-26-11-9-25(10-12-26)15-27(24(30)34-25)17-3-5-18(6-4-17)35(2,31)32/h3-8,22,28H,9-15H2,1-2H3/t22-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338583
PNG
(US9751881, Example 112)
Show SMILES Cc1cc(C#N)c(nn1)N1CCC2(CCN(CC(O)c3ccc4C(=O)OCc4c3C)CC2)CC1
Show InChI InChI=1S/C26H31N5O3/c1-17-13-19(14-27)24(29-28-17)31-11-7-26(8-12-31)5-9-30(10-6-26)15-23(32)20-3-4-21-22(18(20)2)16-34-25(21)33/h3-4,13,23,32H,5-12,15-16H2,1-2H3
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338570
PNG
(US9751881, Example 99)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CC1)CN(CCO2)c1ccc(nc1)S(C)(=O)=O
Show InChI InChI=1S/C25H31N3O6S/c1-17-19(4-5-20-21(17)15-33-24(20)30)22(29)14-27-9-7-25(8-10-27)16-28(11-12-34-25)18-3-6-23(26-13-18)35(2,31)32/h3-6,13,22,29H,7-12,14-16H2,1-2H3/t22-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338509
PNG
(US9751881, Example 40)
Show SMILES COc1cc(C(O)CN2CCC3(CCN(C3)c3ccc(cn3)S(C)(=O)=O)CC2)c(Cl)cc1C#N
Show InChI InChI=1S/C24H29ClN4O4S/c1-33-22-12-19(20(25)11-17(22)13-26)21(30)15-28-8-5-24(6-9-28)7-10-29(16-24)23-4-3-18(14-27-23)34(2,31)32/h3-4,11-12,14,21,30H,5-10,15-16H2,1-2H3
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338540
PNG
(US9751881, Example 69)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CN(C(=O)C2)c2ccc(c(F)c2)-n2cnnn2)CC1
Show InChI InChI=1S/C26H27FN6O4/c1-16-18(3-4-19-20(16)13-37-25(19)36)23(34)12-31-8-6-26(7-9-31)11-24(35)32(14-26)17-2-5-22(21(27)10-17)33-15-28-29-30-33/h2-5,10,15,23,34H,6-9,11-14H2,1H3/t23-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338501
PNG
(US9751881, Example 32)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CCN(C2)c2ccc(nn2)S(C)(=O)=O)CC1
Show InChI InChI=1S/C24H30N4O5S/c1-16-17(3-4-18-19(16)14-33-23(18)30)20(29)13-27-10-7-24(8-11-27)9-12-28(15-24)21-5-6-22(26-25-21)34(2,31)32/h3-6,20,29H,7-15H2,1-2H3/t20-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338578
PNG
(US9751881, Example 107)
Show SMILES Cc1c2COC(=O)c2ccc1C(O)CN1CCC2(CC1)CCN(CC2)c1ncccc1C#N
Show InChI InChI=1S/C26H30N4O3/c1-18-20(4-5-21-22(18)17-33-25(21)32)23(31)16-29-11-6-26(7-12-29)8-13-30(14-9-26)24-19(15-27)3-2-10-28-24/h2-5,10,23,31H,6-9,11-14,16-17H2,1H3
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338568
PNG
(US9751881, Example 97)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CC1)OCCN(C2=O)c1ccc(cn1)S(C)(=O)=O
Show InChI InChI=1S/C25H29N3O7S/c1-16-18(4-5-19-20(16)15-34-23(19)30)21(29)14-27-9-7-25(8-10-27)24(31)28(11-12-35-25)22-6-3-17(13-26-22)36(2,32)33/h3-6,13,21,29H,7-12,14-15H2,1-2H3/t21-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338485
PNG
(US9751881, Example 17)
Show SMILES Cc1c2COC(=O)c2ccc1CCN1CCC2(CCN(C2)c2ccc(cn2)-c2ncon2)CC1
Show InChI InChI=1S/C26H29N5O3/c1-18-19(2-4-21-22(18)15-33-25(21)32)6-10-30-11-7-26(8-12-30)9-13-31(16-26)23-5-3-20(14-27-23)24-28-17-34-29-24/h2-5,14,17H,6-13,15-16H2,1H3
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338508
PNG
(US9751881, Example 39)
Show SMILES Cc1cc2C(=O)OCc2cc1C(O)CN1CCC2(CCN(C2)c2ccc(cn2)S(C)(=O)=O)CC1
Show InChI InChI=1S/C25H31N3O5S/c1-17-11-21-18(15-33-24(21)30)12-20(17)22(29)14-27-8-5-25(6-9-27)7-10-28(16-25)23-4-3-19(13-26-23)34(2,31)32/h3-4,11-13,22,29H,5-10,14-16H2,1-2H3
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338498
PNG
(US9751881, Example 29)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1C2CCC1CC1(CN(C(=O)C1)c1ccc(cn1)C#N)C2
Show InChI InChI=1S/C27H28N4O4/c1-16-20(5-6-21-22(16)14-35-26(21)34)23(32)13-30-18-3-4-19(30)9-27(8-18)10-25(33)31(15-27)24-7-2-17(11-28)12-29-24/h2,5-7,12,18-19,23,32H,3-4,8-10,13-15H2,1H3/t18?,19?,23-,27?/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338562
PNG
(US9751881, Example 91)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CN(C(=O)O2)c2ccc(cn2)S(C)(=O)=O)CC1
Show InChI InChI=1S/C24H27N3O7S/c1-15-17(4-5-18-19(15)13-33-22(18)29)20(28)12-26-9-7-24(8-10-26)14-27(23(30)34-24)21-6-3-16(11-25-21)35(2,31)32/h3-6,11,20,28H,7-10,12-14H2,1-2H3/t20-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338533
PNG
(US9751881, Example 62)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CCN(C2)c2nnc(s2)S(C)(=O)=O)CC1
Show InChI InChI=1S/C22H28N4O5S2/c1-14-15(3-4-16-17(14)12-31-19(16)28)18(27)11-25-8-5-22(6-9-25)7-10-26(13-22)20-23-24-21(32-20)33(2,29)30/h3-4,18,27H,5-13H2,1-2H3/t18-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338511
PNG
(US9751881, Example 42)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CCN(C2=O)c2cnc(cn2)S(C)(=O)=O)CC1
Show InChI InChI=1S/C24H28N4O6S/c1-15-16(3-4-17-18(15)14-34-22(17)30)19(29)13-27-8-5-24(6-9-27)7-10-28(23(24)31)20-11-26-21(12-25-20)35(2,32)33/h3-4,11-12,19,29H,5-10,13-14H2,1-2H3/t19-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338516
PNG
(US9751881, Example 47)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CN(C2)c2ccc(cn2)S(C)(=O)=O)CC1
Show InChI InChI=1S/C24H29N3O5S/c1-16-18(4-5-19-20(16)13-32-23(19)29)21(28)12-26-9-7-24(8-10-26)14-27(15-24)22-6-3-17(11-25-22)33(2,30)31/h3-6,11,21,28H,7-10,12-15H2,1-2H3/t21-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM50235195
PNG
(CHEMBL4087218)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CCN(C2)c2ccc(nc2)S(C)(=O)=O)CC1
Show InChI InChI=1S/C25H31N3O5S/c1-17-19(4-5-20-21(17)15-33-24(20)30)22(29)14-27-10-7-25(8-11-27)9-12-28(16-25)18-3-6-23(26-13-18)34(2,31)32/h3-6,13,22,29H,7-12,14-16H2,1-2H3/t22-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338556
PNG
(US9751881, Example 85)
Show SMILES COc1ccc(cc1N1CCC2(C1)CCN(C[C@H](O)c1ccc3C(=O)OCc3c1C)CC2)C#N
Show InChI InChI=1S/C27H31N3O4/c1-18-20(4-5-21-22(18)16-34-26(21)32)24(31)15-29-10-7-27(8-11-29)9-12-30(17-27)23-13-19(14-28)3-6-25(23)33-2/h3-6,13,24,31H,7-12,15-17H2,1-2H3/t24-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338541
PNG
(US9751881, Example 70)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CN(C(=O)C2)c2ccc(cc2)S(=O)(=O)C2CC2)CC1
Show InChI InChI=1S/C28H32N2O6S/c1-18-22(8-9-23-24(18)16-36-27(23)33)25(31)15-29-12-10-28(11-13-29)14-26(32)30(17-28)19-2-4-20(5-3-19)37(34,35)21-6-7-21/h2-5,8-9,21,25,31H,6-7,10-17H2,1H3/t25-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338579
PNG
(US9751881, Example 108)
Show SMILES Cc1cc(cnc1N1CCC2(CCN(CC(O)c3ccc4C(=O)OCc4c3C)CC2)CC1)C#N
Show InChI InChI=1S/C27H32N4O3/c1-18-13-20(14-28)15-29-25(18)31-11-7-27(8-12-31)5-9-30(10-6-27)16-24(32)21-3-4-22-23(19(21)2)17-34-26(22)33/h3-4,13,15,24,32H,5-12,16-17H2,1-2H3
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338555
PNG
(US9751881, Example 84)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CCN(C2)c2cc(ccc2F)C#N)CC1
Show InChI InChI=1S/C26H28FN3O3/c1-17-19(3-4-20-21(17)15-33-25(20)32)24(31)14-29-9-6-26(7-10-29)8-11-30(16-26)23-12-18(13-28)2-5-22(23)27/h2-5,12,24,31H,6-11,14-16H2,1H3/t24-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338515
PNG
(US9751881, Example 46)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CN(C2)c2ccc(nc2)S(C)(=O)=O)CC1
Show InChI InChI=1S/C24H29N3O5S/c1-16-18(4-5-19-20(16)13-32-23(19)29)21(28)12-26-9-7-24(8-10-26)14-27(15-24)17-3-6-22(25-11-17)33(2,30)31/h3-6,11,21,28H,7-10,12-15H2,1-2H3/t21-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338525
PNG
(US9751881, Example 54)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(C1)CCN(CC2)c1ncc(cn1)-n1cnnn1
Show InChI InChI=1S/C24H28N8O3/c1-16-18(2-3-19-20(16)13-35-22(19)34)21(33)12-30-7-4-24(14-30)5-8-31(9-6-24)23-25-10-17(11-26-23)32-15-27-28-29-32/h2-3,10-11,15,21,33H,4-9,12-14H2,1H3/t21-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338499
PNG
(US9751881, Example 30)
Show SMILES CCS(=O)(=O)c1ccc(cn1)N1CCC2(C1)CCN(C[C@H](O)c1ccc3C(=O)OCc3c1C)CC2
Show InChI InChI=1S/C26H33N3O5S/c1-3-35(32,33)24-7-4-19(14-27-24)29-13-10-26(17-29)8-11-28(12-9-26)15-23(30)20-5-6-21-22(18(20)2)16-34-25(21)31/h4-7,14,23,30H,3,8-13,15-17H2,1-2H3/t23-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338535
PNG
(US9751881, Example 64)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(C1)CCN(CC2)c1ccc(cn1)S(C)(=O)=O
Show InChI InChI=1S/C25H31N3O5S/c1-17-19(4-5-20-21(17)15-33-24(20)30)22(29)14-27-10-7-25(16-27)8-11-28(12-9-25)23-6-3-18(13-26-23)34(2,31)32/h3-6,13,22,29H,7-12,14-16H2,1-2H3/t22-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338586
PNG
(US9751881, Example 115)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CCN(C2=O)c2ccnc(n2)-c2ccoc2)CC1
Show InChI InChI=1S/C27H28N4O5/c1-17-19(2-3-20-21(17)16-36-25(20)33)22(32)14-30-10-6-27(7-11-30)8-12-31(26(27)34)23-4-9-28-24(29-23)18-5-13-35-15-18/h2-5,9,13,15,22,32H,6-8,10-12,14,16H2,1H3/t22-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338571
PNG
(US9751881, Example 100)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CC1)CN(CCO2)c1cnc(cn1)S(C)(=O)=O
Show InChI InChI=1S/C24H30N4O6S/c1-16-17(3-4-18-19(16)14-33-23(18)30)20(29)13-27-7-5-24(6-8-27)15-28(9-10-34-24)21-11-26-22(12-25-21)35(2,31)32/h3-4,11-12,20,29H,5-10,13-15H2,1-2H3/t20-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM50235206
PNG
(CHEMBL4105076)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CN(C(=O)C2)c2ccc(nc2)S(C)(=O)=O)CC1
Show InChI InChI=1S/C25H29N3O6S/c1-16-18(4-5-19-20(16)14-34-24(19)31)21(29)13-27-9-7-25(8-10-27)11-23(30)28(15-25)17-3-6-22(26-12-17)35(2,32)33/h3-6,12,21,29H,7-11,13-15H2,1-2H3/t21-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338527
PNG
(US9751881, Example 56)
Show SMILES Cc1c2COC(=O)c2ccc1[C@H](O)CN1CCC2(CCN(C2)c2ccc(cn2)S(C)(=O)=O)CC1
Show InChI InChI=1S/C25H31N3O5S/c1-17-19(4-5-20-21(17)15-33-24(20)30)22(29)14-27-10-7-25(8-11-27)9-12-28(16-25)23-6-3-18(13-26-23)34(2,31)32/h3-6,13,22,29H,7-12,14-16H2,1-2H3/t22-/m1/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338559
PNG
(US9751881, Example 88)
Show SMILES CC1=CS(=O)(=O)c2ccc(cc12)N1CCC2(C1)CCN(C[C@H](O)c1ccc3C(=O)OCc3c1C)CC2
Show InChI InChI=1S/C28H32N2O5S/c1-18-16-36(33,34)26-6-3-20(13-23(18)26)30-12-9-28(17-30)7-10-29(11-8-28)14-25(31)21-4-5-22-24(19(21)2)15-35-27(22)32/h3-6,13,16,25,31H,7-12,14-15,17H2,1-2H3/t25-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338520
PNG
(US9751881, Example 51A | US9751881, Example 51B)
Show SMILES COc1cc(ncc1C#N)C(O)CN1CCC2(CN(C2)c2ccc(cn2)C#N)CC1
Show InChI InChI=1S/C22H24N6O2/c1-30-20-8-18(25-12-17(20)10-24)19(29)13-27-6-4-22(5-7-27)14-28(15-22)21-3-2-16(9-23)11-26-21/h2-3,8,11-12,19,29H,4-7,13-15H2,1H3
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338544
PNG
(US9751881, Example 73)
Show SMILES Cc1nc(ccc1-n1cnnn1)N1CC2(CC1=O)CCN(C[C@H](O)c1ccc3C(=O)OCc3c1C)CC2
Show InChI InChI=1S/C26H29N7O4/c1-16-18(3-4-19-20(16)13-37-25(19)36)22(34)12-31-9-7-26(8-10-31)11-24(35)32(14-26)23-6-5-21(17(2)28-23)33-15-27-29-30-33/h3-6,15,22,34H,7-14H2,1-2H3/t22-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338513
PNG
(US9751881, Example 44)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CN(C2=O)c2ccc(cn2)C#N)CC1
Show InChI InChI=1S/C24H24N4O4/c1-15-17(3-4-18-19(15)13-32-22(18)30)20(29)12-27-8-6-24(7-9-27)14-28(23(24)31)21-5-2-16(10-25)11-26-21/h2-5,11,20,29H,6-9,12-14H2,1H3/t20-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338569
PNG
(US9751881, Example 98)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CC1)CN(CCO2)c1ccc(cn1)S(C)(=O)=O
Show InChI InChI=1S/C25H31N3O6S/c1-17-19(4-5-20-21(17)15-33-24(20)30)22(29)14-27-9-7-25(8-10-27)16-28(11-12-34-25)23-6-3-18(13-26-23)35(2,31)32/h3-6,13,22,29H,7-12,14-16H2,1-2H3/t22-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338520
PNG
(US9751881, Example 51A | US9751881, Example 51B)
Show SMILES COc1cc(ncc1C#N)C(O)CN1CCC2(CN(C2)c2ccc(cn2)C#N)CC1
Show InChI InChI=1S/C22H24N6O2/c1-30-20-8-18(25-12-17(20)10-24)19(29)13-27-6-4-22(5-7-27)14-28(15-22)21-3-2-16(9-23)11-26-21/h2-3,8,11-12,19,29H,4-7,13-15H2,1H3
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338495
PNG
(US9751881, Example 26)
Show SMILES OC(CN1CCC2(CCN(C2)c2ccc(cn2)C#N)CC1)c1ccc2C(=O)OCc2c1C1CC1
Show InChI InChI=1S/C27H30N4O3/c28-13-18-1-6-24(29-14-18)31-12-9-27(17-31)7-10-30(11-8-27)15-23(32)21-5-4-20-22(16-34-26(20)33)25(21)19-2-3-19/h1,4-6,14,19,23,32H,2-3,7-12,15-17H2
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338584
PNG
(US9751881, Example 113)
Show SMILES Cc1c2COC(=O)c2ccc1C(O)CN1CCC2(CC1)CCN(CC2)c1ncc(cc1F)C#N
Show InChI InChI=1S/C26H29FN4O3/c1-17-19(2-3-20-21(17)16-34-25(20)33)23(32)15-30-8-4-26(5-9-30)6-10-31(11-7-26)24-22(27)12-18(13-28)14-29-24/h2-3,12,14,23,32H,4-11,15-16H2,1H3
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
ATP-regulated potassium channel ROMK


(Homo sapiens (Human))
BDBM338574
PNG
(US9751881, Example 103)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CC1)CCN(CC2)c1ccc(nc1)S(C)(=O)=O
Show InChI InChI=1S/C26H33N3O5S/c1-18-20(4-5-21-22(18)17-34-25(21)31)23(30)16-28-11-7-26(8-12-28)9-13-29(14-10-26)19-3-6-24(27-15-19)35(2,32)33/h3-6,15,23,30H,7-14,16-17H2,1-2H3/t23-/m0/s1
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Assay Protocol: The ROMK channel functional thallium flux assay was performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells were ...


US Patent US9751881 (2017)

More data for this
Ligand-Target Pair
* indicates data uncertainty>20%