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Found 548 hits Enz. Inhib. hit(s) with Target = 'Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)' AND taxid = 9606   
Target
(Institution)
LigandTarget
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
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM195013
PNG
(US9206198, 78 | US9206198, 79)
Show SMILES CC1=C(COC1=O)N1CCC2(CCN(CC(O)c3ccc4C(=O)OCc4c3Cl)CC2)C1=O
Show InChI InChI=1/C23H25ClN2O6/c1-13-17(12-32-20(13)28)26-9-6-23(22(26)30)4-7-25(8-5-23)10-18(27)15-3-2-14-16(19(15)24)11-31-21(14)29/h2-3,18,27H,4-12H2,1H3
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n/an/a 3n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Block of Kir1.1 (ROMK1) currents was examined by whole cell voltage clamp (Hamill et. al. Pfluegers Archives 391:85-100 (1981)) using the IonWorks ...


US Patent US9206198 (2015)

More data for this
Ligand-Target Pair
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM194951
PNG
(US9206198, 5)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CCN(C3=CC(=O)OC3)C2=O)CC1
Show InChI InChI=1/C23H26N2O6/c1-14-16(2-3-17-18(14)13-31-21(17)28)19(26)11-24-7-4-23(5-8-24)6-9-25(22(23)29)15-10-20(27)30-12-15/h2-3,10,19,26H,4-9,11-13H2,1H3/t19-/s2
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Block of Kir1.1 (ROMK1) currents was examined by whole cell voltage clamp (Hamill et. al. Pfluegers Archives 391:85-100 (1981)) using the IonWorks ...


US Patent US9206198 (2015)

More data for this
Ligand-Target Pair
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM194967
PNG
(US9206198, 22)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CCN(C2=O)C2=C(F)C(=O)OC2)CC1
Show InChI InChI=1/C23H25FN2O6/c1-13-14(2-3-15-16(13)11-31-20(15)28)18(27)10-25-7-4-23(5-8-25)6-9-26(22(23)30)17-12-32-21(29)19(17)24/h2-3,18,27H,4-12H2,1H3/t18-/s2
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Block of Kir1.1 (ROMK1) currents was examined by whole cell voltage clamp (Hamill et. al. Pfluegers Archives 391:85-100 (1981)) using the IonWorks ...


US Patent US9206198 (2015)

More data for this
Ligand-Target Pair
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM194963
PNG
(US9206198, 18)
Show SMILES CO[C@@H](CN1CC2CCC(C1)CC1(CCN(C3=CC(=O)OC3)C1=O)C2)c1ccc2C(=O)OCc2c1C
Show InChI InChI=1/C28H34N2O6/c1-17-21(5-6-22-23(17)16-36-26(22)32)24(34-2)14-29-12-18-3-4-19(13-29)11-28(10-18)7-8-30(27(28)33)20-9-25(31)35-15-20/h5-6,9,18-19,24H,3-4,7-8,10-16H2,1-2H3/t18?,19?,24-,28?/s2
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Block of Kir1.1 (ROMK1) currents was examined by whole cell voltage clamp (Hamill et. al. Pfluegers Archives 391:85-100 (1981)) using the IonWorks ...


US Patent US9206198 (2015)

More data for this
Ligand-Target Pair
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM50121348
PNG
(CHEMBL3622114)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CC1)CCN(CC2)c1cnc(cn1)C#N
Show InChI InChI=1/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/t22-/s2
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Temple University School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of human Kir1.1 expressed in HEK293 cells by thallium flux assay


ACS Med Chem Lett 6: 831-3 (2015)

More data for this
Ligand-Target Pair
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM50121344
PNG
(CHEMBL3622105)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CCN(C2)c2ccc(cn2)C#N)CC1
Show InChI InChI=1/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-/s2
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Temple University School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of human Kir1.1 expressed in HEK293 cells by thallium flux assay


ACS Med Chem Lett 6: 831-3 (2015)

More data for this
Ligand-Target Pair
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM195005
PNG
(US9206198, 66)
Show SMILES CCC1CC2(CCN(C[C@H](O)c3ccc4C(=O)OCc4c3C)CC2)C(=O)N1C1=CC(=O)OC1
Show InChI InChI=1/C25H30N2O6/c1-3-16-11-25(24(31)27(16)17-10-22(29)32-13-17)6-8-26(9-7-25)12-21(28)18-4-5-19-20(15(18)2)14-33-23(19)30/h4-5,10,16,21,28H,3,6-9,11-14H2,1-2H3/t16?,21-/s2
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
The ROMK channel functional thallium flux assay is performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells are seeded in Poly-D...


US Patent US9206198 (2015)

More data for this
Ligand-Target Pair
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM195012
PNG
(US9206198, 76 | US9206198, 77)
Show SMILES CC1=C(COC1=O)N1CCC2(CCN(CC(O)c3ccc4C(=O)OCc4c3C3CC3)CC2)C1=O
Show InChI InChI=1/C26H30N2O6/c1-15-20(14-34-23(15)30)28-11-8-26(25(28)32)6-9-27(10-7-26)12-21(29)18-5-4-17-19(13-33-24(17)31)22(18)16-2-3-16/h4-5,16,21,29H,2-3,6-14H2,1H3
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
The ROMK channel functional thallium flux assay is performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells are seeded in Poly-D...


US Patent US9206198 (2015)

More data for this
Ligand-Target Pair
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM195013
PNG
(US9206198, 78 | US9206198, 79)
Show SMILES CC1=C(COC1=O)N1CCC2(CCN(CC(O)c3ccc4C(=O)OCc4c3Cl)CC2)C1=O
Show InChI InChI=1/C23H25ClN2O6/c1-13-17(12-32-20(13)28)26-9-6-23(22(26)30)4-7-25(8-5-23)10-18(27)15-3-2-14-16(19(15)24)11-31-21(14)29/h2-3,18,27H,4-12H2,1H3
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
The ROMK channel functional thallium flux assay is performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells are seeded in Poly-D...


US Patent US9206198 (2015)

More data for this
Ligand-Target Pair
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM195018
PNG
(US9206198, 85A | US9206198, 85B)
Show SMILES CC1=C(COC1=O)N1CCC2(CCN(CC2)C(C)(C)C(O)c2ccc3C(=O)OCc3c2C)C1=O
Show InChI InChI=1/C26H32N2O6/c1-15-17(5-6-18-19(15)13-33-23(18)31)21(29)25(3,4)27-10-7-26(8-11-27)9-12-28(24(26)32)20-14-34-22(30)16(20)2/h5-6,21,29H,7-14H2,1-4H3
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
The ROMK channel functional thallium flux assay is performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells are seeded in Poly-D...


US Patent US9206198 (2015)

More data for this
Ligand-Target Pair
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM194954
PNG
(US9206198, 7)
Show SMILES CC1=C(COC1=O)N1CCC2(CCN(C[C@H](O)c3ccc4C(=O)OCc4c3C)CC2)C1=O
Show InChI InChI=1/C24H28N2O6/c1-14-16(3-4-17-18(14)12-31-22(17)29)20(27)11-25-8-5-24(6-9-25)7-10-26(23(24)30)19-13-32-21(28)15(19)2/h3-4,20,27H,5-13H2,1-2H3/t20-/s2
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Block of Kir1.1 (ROMK1) currents was examined by whole cell voltage clamp (Hamill et. al. Pfluegers Archives 391:85-100 (1981)) using the IonWorks ...


US Patent US9206198 (2015)

More data for this
Ligand-Target Pair
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM194956
PNG
(US9206198, 9)
Show SMILES CC1=C(COC1=O)N1CCCC2(CCN(C[C@H](O)c3ccc4C(=O)OCc4c3C)CC2)C1=O
Show InChI InChI=1/C25H30N2O6/c1-15-17(4-5-18-19(15)13-32-23(18)30)21(28)12-26-10-7-25(8-11-26)6-3-9-27(24(25)31)20-14-33-22(29)16(20)2/h4-5,21,28H,3,6-14H2,1-2H3/t21-/s2
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Block of Kir1.1 (ROMK1) currents was examined by whole cell voltage clamp (Hamill et. al. Pfluegers Archives 391:85-100 (1981)) using the IonWorks ...


US Patent US9206198 (2015)

More data for this
Ligand-Target Pair
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM194968
PNG
(US9206198, 23)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CCCN(C3=CC(=O)OC3)C2=O)CC1
Show InChI InChI=1/C24H28N2O6/c1-15-17(3-4-18-19(15)14-32-22(18)29)20(27)12-25-9-6-24(7-10-25)5-2-8-26(23(24)30)16-11-21(28)31-13-16/h3-4,11,20,27H,2,5-10,12-14H2,1H3/t20-/s2
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Block of Kir1.1 (ROMK1) currents was examined by whole cell voltage clamp (Hamill et. al. Pfluegers Archives 391:85-100 (1981)) using the IonWorks ...


US Patent US9206198 (2015)

More data for this
Ligand-Target Pair
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM194970
PNG
(US9206198, 25)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CCN(C2=O)C2=C(Cl)C(=O)OC2)CC1
Show InChI InChI=1/C23H25ClN2O6/c1-13-14(2-3-15-16(13)11-31-20(15)28)18(27)10-25-7-4-23(5-8-25)6-9-26(22(23)30)17-12-32-21(29)19(17)24/h2-3,18,27H,4-12H2,1H3/t18-/s2
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Block of Kir1.1 (ROMK1) currents was examined by whole cell voltage clamp (Hamill et. al. Pfluegers Archives 391:85-100 (1981)) using the IonWorks ...


US Patent US9206198 (2015)

More data for this
Ligand-Target Pair
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM194992
PNG
(US9206198, 53C)
Show SMILES C[C@H]([C@@H](O)c1ccc2C(=O)OCc2c1C)N1CCC2(CCN(C2=O)C2=C(C)C(=O)OC2)CC1
Show InChI InChI=1/C25H30N2O6/c1-14-17(4-5-18-19(14)12-32-23(18)30)21(28)16(3)26-9-6-25(7-10-26)8-11-27(24(25)31)20-13-33-22(29)15(20)2/h4-5,16,21,28H,6-13H2,1-3H3/t16-,21-/s2
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Block of Kir1.1 (ROMK1) currents was examined by whole cell voltage clamp (Hamill et. al. Pfluegers Archives 391:85-100 (1981)) using the IonWorks ...


US Patent US9206198 (2015)

More data for this
Ligand-Target Pair
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM195011
PNG
(US9206198, 74 | US9206198, 75)
Show SMILES CCc1c2COC(=O)c2ccc1C(O)CN1CCC2(CCN(C2=O)C2=C(C)C(=O)OC2)CC1
Show InChI InChI=1/C25H30N2O6/c1-3-16-17(4-5-18-19(16)13-32-23(18)30)21(28)12-26-9-6-25(7-10-26)8-11-27(24(25)31)20-14-33-22(29)15(20)2/h4-5,21,28H,3,6-14H2,1-2H3
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Block of Kir1.1 (ROMK1) currents was examined by whole cell voltage clamp (Hamill et. al. Pfluegers Archives 391:85-100 (1981)) using the IonWorks ...


US Patent US9206198 (2015)

More data for this
Ligand-Target Pair
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM195012
PNG
(US9206198, 76 | US9206198, 77)
Show SMILES CC1=C(COC1=O)N1CCC2(CCN(CC(O)c3ccc4C(=O)OCc4c3C3CC3)CC2)C1=O
Show InChI InChI=1/C26H30N2O6/c1-15-20(14-34-23(15)30)28-11-8-26(25(28)32)6-9-27(10-7-26)12-21(29)18-5-4-17-19(13-33-24(17)31)22(18)16-2-3-16/h4-5,16,21,29H,2-3,6-14H2,1H3
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Block of Kir1.1 (ROMK1) currents was examined by whole cell voltage clamp (Hamill et. al. Pfluegers Archives 391:85-100 (1981)) using the IonWorks ...


US Patent US9206198 (2015)

More data for this
Ligand-Target Pair
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM195014
PNG
(US9206198, 80 | US9206198, 81)
Show SMILES CC1=C(COC1=O)N1CCC2(CCN(CC(O)c3ccc4C(=O)OCc4c3F)CC2)C1=O
Show InChI InChI=1/C23H25FN2O6/c1-13-17(12-32-20(13)28)26-9-6-23(22(26)30)4-7-25(8-5-23)10-18(27)15-3-2-14-16(19(15)24)11-31-21(14)29/h2-3,18,27H,4-12H2,1H3
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
Block of Kir1.1 (ROMK1) currents was examined by whole cell voltage clamp (Hamill et. al. Pfluegers Archives 391:85-100 (1981)) using the IonWorks ...


US Patent US9206198 (2015)

More data for this
Ligand-Target Pair
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM194947
PNG
(US9206198, 1)
Show SMILES CC1=C(COC1=O)N1CCC2(CCN(CCc3ccc4C(=O)OCc4c3C)CC2)C1=O
Show InChI InChI=1S/C24H28N2O5/c1-15-17(3-4-18-19(15)13-30-22(18)28)5-9-25-10-6-24(7-11-25)8-12-26(23(24)29)20-14-31-21(27)16(20)2/h3-4H,5-14H2,1-2H3
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
The ROMK channel functional thallium flux assay is performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells are seeded in Poly-D...


US Patent US9206198 (2015)

More data for this
Ligand-Target Pair
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM194953
PNG
(US9206198, 6B)
Show SMILES C[C@H]1CC2(CCN(C[C@H](O)c3ccc4C(=O)OCc4c3C)CC2)C(=O)N1C1=CC(=O)OC1
Show InChI InChI=1/C24H28N2O6/c1-14-10-24(23(30)26(14)16-9-21(28)31-12-16)5-7-25(8-6-24)11-20(27)17-3-4-18-19(15(17)2)13-32-22(18)29/h3-4,9,14,20,27H,5-8,10-13H2,1-2H3/t14-,20-/s2
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n/an/a 10n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
The ROMK channel functional thallium flux assay is performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells are seeded in Poly-D...


US Patent US9206198 (2015)

More data for this
Ligand-Target Pair
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM194956
PNG
(US9206198, 9)
Show SMILES CC1=C(COC1=O)N1CCCC2(CCN(C[C@H](O)c3ccc4C(=O)OCc4c3C)CC2)C1=O
Show InChI InChI=1/C25H30N2O6/c1-15-17(4-5-18-19(15)13-32-23(18)30)21(28)12-26-10-7-25(8-11-26)6-3-9-27(24(25)31)20-14-33-22(29)16(20)2/h4-5,21,28H,3,6-14H2,1-2H3/t21-/s2
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n/an/a 10n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
The ROMK channel functional thallium flux assay is performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells are seeded in Poly-D...


US Patent US9206198 (2015)

More data for this
Ligand-Target Pair
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM194965
PNG
(US9206198, 20)
Show SMILES CO[C@@H](CN1C2CCC1CC1(CCN(C1=O)C1=C(C)C(=O)OC1)C2)c1ccc2C(=O)OCc2c1C
Show InChI InChI=1/C27H32N2O6/c1-15-19(6-7-20-21(15)13-34-25(20)31)23(33-3)12-29-17-4-5-18(29)11-27(10-17)8-9-28(26(27)32)22-14-35-24(30)16(22)2/h6-7,17-18,23H,4-5,8-14H2,1-3H3/t17?,18?,23-,27?/s2
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n/an/a 10n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
The ROMK channel functional thallium flux assay is performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells are seeded in Poly-D...


US Patent US9206198 (2015)

More data for this
Ligand-Target Pair
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM194970
PNG
(US9206198, 25)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CCN(C2=O)C2=C(Cl)C(=O)OC2)CC1
Show InChI InChI=1/C23H25ClN2O6/c1-13-14(2-3-15-16(13)11-31-20(15)28)18(27)10-25-7-4-23(5-8-25)6-9-26(22(23)30)17-12-32-21(29)19(17)24/h2-3,18,27H,4-12H2,1H3/t18-/s2
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n/an/a 10n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
The ROMK channel functional thallium flux assay is performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells are seeded in Poly-D...


US Patent US9206198 (2015)

More data for this
Ligand-Target Pair
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM195030
PNG
(US9206198, 53A)
Show SMILES C[C@@H]([C@H](O)c1ccc2C(=O)OCc2c1C)N1CCC2(CCN(C2=O)C2=C(C)C(=O)OC2)CC1
Show InChI InChI=1/C25H30N2O6/c1-14-17(4-5-18-19(14)12-32-23(18)30)21(28)16(3)26-9-6-25(7-10-26)8-11-27(24(25)31)20-13-33-22(29)15(20)2/h4-5,16,21,28H,6-13H2,1-3H3/t16-,21-/s2
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n/an/a 10n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
The ROMK channel functional thallium flux assay is performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells are seeded in Poly-D...


US Patent US9206198 (2015)

More data for this
Ligand-Target Pair
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM194992
PNG
(US9206198, 53C)
Show SMILES C[C@H]([C@@H](O)c1ccc2C(=O)OCc2c1C)N1CCC2(CCN(C2=O)C2=C(C)C(=O)OC2)CC1
Show InChI InChI=1/C25H30N2O6/c1-14-17(4-5-18-19(14)12-32-23(18)30)21(28)16(3)26-9-6-25(7-10-26)8-11-27(24(25)31)20-13-33-22(29)15(20)2/h4-5,16,21,28H,6-13H2,1-3H3/t16-,21-/s2
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Merck Sharp & Dohme Corp.

US Patent


Assay Description
The ROMK channel functional thallium flux assay is performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells are seeded in Poly-D...


US Patent US9206198 (2015)

More data for this
Ligand-Target Pair
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM50121355
PNG
(CHEMBL3622112)
Show SMILES Cc1cc(cnc1C#N)N1CCC2(C1)CCN(C[C@H](O)c1ccc3C(=O)OCc3c1C)CC2
Show InChI InChI=1/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-/s2
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n/an/a 10n/an/an/an/an/an/a



Temple University School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of human Kir1.1 expressed in HEK293 cells by thallium flux assay


ACS Med Chem Lett 6: 831-3 (2015)

More data for this
Ligand-Target Pair
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM50121345
PNG
(CHEMBL3622104)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CN(C(=O)C2)c2ccc(cn2)C#N)CC1
Show InChI InChI=1/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-/s2
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n/an/a 11n/an/an/an/an/an/a



Temple University School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of human Kir1.1 expressed in HEK293 cells by thallium flux assay


ACS Med Chem Lett 6: 831-3 (2015)

More data for this
Ligand-Target Pair
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM50121363
PNG
(CHEMBL3622106)
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



Temple University School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of human Kir1.1 expressed in HEK293 cells by thallium flux assay


ACS Med Chem Lett 6: 831-3 (2015)

More data for this
Ligand-Target Pair
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM167407
PNG
(US9073882, 94)
Show SMILES CC(CN1CCN(CCc2ccc3C(=O)OCc3c2C)CC1)c1ccc2C(=O)OCc2c1C
Show InChI InChI=1/C27H32N2O4/c1-17(21-6-7-23-25(19(21)3)16-33-27(23)31)14-29-12-10-28(11-13-29)9-8-20-4-5-22-24(18(20)2)15-32-26(22)30/h4-7,17H,8-16H2,1-3H3
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n/an/a 12n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
FluxOR Kit Components (Invitrogen F10017) FluxOR Reagent (Component A) FluxOR Assay Buffer (Component B)-10x Concentrate PowerLo...


US Patent US9073882 (2015)

More data for this
Ligand-Target Pair
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM50116796
PNG
(CHEMBL3612814)
Show SMILES Cc1nc(ccc1C#N)C(O)CN1CCN(C[C@H](O)c2ccc3C(=O)OCc3c2C)CC1
Show InChI InChI=1/C24H28N4O4/c1-15-18(4-5-19-20(15)14-32-24(19)31)22(29)12-27-7-9-28(10-8-27)13-23(30)21-6-3-17(11-25)16(2)26-21/h3-6,22-23,29-30H,7-10,12-14H2,1-2H3/t22-,23?/s2
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n/an/a 12n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of ROMK (unknown origin) expressed in HEK293 cells by electrophysiology assay


ACS Med Chem Lett 6: 747-52 (2015)

More data for this
Ligand-Target Pair
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM50116799
PNG
(CHEMBL3612928)
Show SMILES [2H]C([2H])([2H])Oc1cc(ncc1C#N)C(O)CN1CCN(C[C@H](O)c2ccc3C(=O)OCc3c2C)CC1
Show InChI InChI=1/C24H28N4O5/c1-15-17(3-4-18-19(15)14-33-24(18)31)21(29)12-27-5-7-28(8-6-27)13-22(30)20-9-23(32-2)16(10-25)11-26-20/h3-4,9,11,21-22,29-30H,5-8,12-14H2,1-2H3/t21-,22?/s2/i2D3
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n/an/a 13n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of ROMK (unknown origin) expressed in HEK293 cells by electrophysiology assay


ACS Med Chem Lett 6: 747-52 (2015)

More data for this
Ligand-Target Pair
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM50121346
PNG
(CHEMBL3622115)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CC1)CCN(CC2)c1ccc(nn1)C#N
Show InChI InChI=1/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/t22-/s2
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n/an/a 13n/an/an/an/an/an/a



Temple University School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of human Kir1.1 expressed in HEK293 cells by thallium flux assay


ACS Med Chem Lett 6: 831-3 (2015)

More data for this
Ligand-Target Pair
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM50121349
PNG
(CHEMBL3622113)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CC1)CCN(CC2)c1ncc(cn1)C#N
Show InChI InChI=1/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/t22-/s2
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n/an/a 14n/an/an/an/an/an/a



Temple University School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of human Kir1.1 expressed in HEK293 cells by thallium flux assay


ACS Med Chem Lett 6: 831-3 (2015)

More data for this
Ligand-Target Pair
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM181758
PNG
(US9139585, 34B)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCN(C[C@@H](O)c2ccc(nc2)-n2cnnn2)CC1
Show InChI InChI=1/C23H27N7O4/c1-15-17(3-4-18-19(15)13-34-23(18)33)21(32)12-29-8-6-28(7-9-29)11-20(31)16-2-5-22(24-10-16)30-14-25-26-27-30/h2-5,10,14,20-21,31-32H,6-9,11-13H2,1H3/t20-,21+/s2
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n/an/a 14n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Block of Kir1.1 (ROMK1) currents was examined by whole cell voltage clamp (Hamill et. al. Pfluegers Archives 391:85-100 (1981)) using the IonWorks Qu...


US Patent US9139585 (2015)

More data for this
Ligand-Target Pair
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM50121362
PNG
(CHEMBL3622107)
Show SMILES Cc1nc(ccc1C#N)N1CCC2(C1)CCN(C[C@H](O)c1ccc3C(=O)OCc3c1C)CC2
Show InChI InChI=1/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-/s2
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Temple University School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of human Kir1.1 expressed in HEK293 cells by thallium flux assay


ACS Med Chem Lett 6: 831-3 (2015)

More data for this
Ligand-Target Pair
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM50121358
PNG
(CHEMBL3622111)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](N)CN1CCC2(CN(C(=O)C2)c2ccc(cn2)C#N)CC1
Show InChI InChI=1/C25H27N5O3/c1-16-18(3-4-19-20(16)14-33-24(19)32)21(27)13-29-8-6-25(7-9-29)10-23(31)30(15-25)22-5-2-17(11-26)12-28-22/h2-5,12,21H,6-10,13-15,27H2,1H3/t21-/s2
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Temple University School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of human Kir1.1 expressed in HEK293 cells by thallium flux assay


ACS Med Chem Lett 6: 831-3 (2015)

More data for this
Ligand-Target Pair
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM50121359
PNG
(CHEMBL3622110)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CCN(C2)c2ccc(cc2)C#N)CC1
Show InChI InChI=1/C26H29N3O3/c1-18-21(6-7-22-23(18)16-32-25(22)31)24(30)15-28-11-8-26(9-12-28)10-13-29(17-26)20-4-2-19(14-27)3-5-20/h2-7,24,30H,8-13,15-17H2,1H3/t24-/s2
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n/an/a 15n/an/an/an/an/an/a



Temple University School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of human Kir1.1 expressed in HEK293 cells by thallium flux assay


ACS Med Chem Lett 6: 831-3 (2015)

More data for this
Ligand-Target Pair
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM50116799
PNG
(CHEMBL3612928)
Show SMILES [2H]C([2H])([2H])Oc1cc(ncc1C#N)C(O)CN1CCN(C[C@H](O)c2ccc3C(=O)OCc3c2C)CC1
Show InChI InChI=1/C24H28N4O5/c1-15-17(3-4-18-19(15)14-33-24(18)31)21(29)12-27-5-7-28(8-6-27)13-22(30)20-9-23(32-2)16(10-25)11-26-20/h3-4,9,11,21-22,29-30H,5-8,12-14H2,1-2H3/t21-,22?/s2/i2D3
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n/an/a 16n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of ROMK (unknown origin) expressed in HEK293 cells by thallium flux assay


ACS Med Chem Lett 6: 747-52 (2015)

More data for this
Ligand-Target Pair
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM50121361
PNG
(CHEMBL3622108)
Show SMILES Cc1cc(ncc1C#N)N1CCC2(C1)CCN(C[C@H](O)c1ccc3C(=O)OCc3c1C)CC2
Show InChI InChI=1/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-/s2
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n/an/a 17n/an/an/an/an/an/a



Temple University School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of human Kir1.1 expressed in HEK293 cells by thallium flux assay


ACS Med Chem Lett 6: 831-3 (2015)

More data for this
Ligand-Target Pair
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM167405
PNG
(US9073882, 86)
Show SMILES Cc1c2COC(=O)c2ccc1CCN1CCN(CCc2ccc(C#N)c(F)c2Cl)CC1
Show InChI InChI=1S/C24H25ClFN3O2/c1-16-17(4-5-20-21(16)15-31-24(20)30)6-8-28-10-12-29(13-11-28)9-7-18-2-3-19(14-27)23(26)22(18)25/h2-5H,6-13,15H2,1H3
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n/an/a 17n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
FluxOR Kit Components (Invitrogen F10017) FluxOR Reagent (Component A) FluxOR Assay Buffer (Component B)-10x Concentrate PowerLo...


US Patent US9073882 (2015)

More data for this
Ligand-Target Pair
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM181748
PNG
(US9139585, 38A)
Show SMILES C[C@@H]1Cc2cc(ccc2C(=O)O1)[C@@H](O)CN1CCN(C[C@H](O)c2ccc3C(=O)OCc3c2C)CC1
Show InChI InChI=1/C27H32N2O6/c1-16-11-19-12-18(3-4-21(19)27(33)35-16)24(30)13-28-7-9-29(10-8-28)14-25(31)20-5-6-22-23(17(20)2)15-34-26(22)32/h3-6,12,16,24-25,30-31H,7-11,13-15H2,1-2H3/t16-,24+,25+/s2
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n/an/a 17.5n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Block of Kir1.1 (ROMK1) currents was examined by whole cell voltage clamp (Hamill et. al. Pfluegers Archives 391:85-100 (1981)) using the IonWorks Qu...


US Patent US9139585 (2015)

More data for this
Ligand-Target Pair
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM50116795
PNG
(CHEMBL3612807)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCN(C[C@H](O)c2ccc(cn2)C#N)CC1
Show InChI InChI=1/C23H26N4O4/c1-15-17(3-4-18-19(15)14-31-23(18)30)21(28)12-26-6-8-27(9-7-26)13-22(29)20-5-2-16(10-24)11-25-20/h2-5,11,21-22,28-29H,6-9,12-14H2,1H3/t21-,22-/s2
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n/an/a 18n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of ROMK (unknown origin) expressed in HEK293 cells by electrophysiology assay


ACS Med Chem Lett 6: 747-52 (2015)

More data for this
Ligand-Target Pair
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM181768
PNG
(US9139585, 44B)
Show SMILES COc1cc(ncc1C#N)C(O)CN1CCN(CC(O)c2ccc3C(=O)O[C@H](C)Cc3c2)CC1
Show InChI InChI=1/C25H30N4O5/c1-16-9-18-10-17(3-4-20(18)25(32)34-16)22(30)14-28-5-7-29(8-6-28)15-23(31)21-11-24(33-2)19(12-26)13-27-21/h3-4,10-11,13,16,22-23,30-31H,5-9,14-15H2,1-2H3/t16-,22?,23?/s2
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n/an/a 18n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Block of Kir1.1 (ROMK1) currents was examined by whole cell voltage clamp (Hamill et. al. Pfluegers Archives 391:85-100 (1981)) using the IonWorks Qu...


US Patent US9139585 (2015)

More data for this
Ligand-Target Pair
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM50121360
PNG
(CHEMBL3622109)
Show SMILES Cc1cc(cnc1N1CCC2(C1)CCN(C[C@H](O)c1ccc3C(=O)OCc3c1C)CC2)C#N
Show InChI InChI=1/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-/s2
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n/an/a 20n/an/an/an/an/an/a



Temple University School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of human Kir1.1 expressed in HEK293 cells by thallium flux assay


ACS Med Chem Lett 6: 831-3 (2015)

More data for this
Ligand-Target Pair
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM195006
PNG
(US9206198, 69)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CC(C3CC3)N(C3=CC(=O)OC3)C2=O)CC1
Show InChI InChI=1/C26H30N2O6/c1-15-18(4-5-19-20(15)14-34-24(19)31)22(29)12-27-8-6-26(7-9-27)11-21(16-2-3-16)28(25(26)32)17-10-23(30)33-13-17/h4-5,10,16,21-22,29H,2-3,6-9,11-14H2,1H3/t21?,22-/s2
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n/an/a 20n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
The ROMK channel functional thallium flux assay is performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells are seeded in Poly-D...


US Patent US9206198 (2015)

More data for this
Ligand-Target Pair
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM194958
PNG
(US9206198, 11)
Show SMILES CO[C@@H](CN1CCC2(CCN(C2=O)C2=CC(=O)OC2C)CC1)c1ccc2C(=O)OCc2c1C
Show InChI InChI=1/C25H30N2O6/c1-15-17(4-5-18-19(15)14-32-23(18)29)21(31-3)13-26-9-6-25(7-10-26)8-11-27(24(25)30)20-12-22(28)33-16(20)2/h4-5,12,16,21H,6-11,13-14H2,1-3H3/t16?,21-/s2
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n/an/a 20n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Block of Kir1.1 (ROMK1) currents was examined by whole cell voltage clamp (Hamill et. al. Pfluegers Archives 391:85-100 (1981)) using the IonWorks ...


US Patent US9206198 (2015)

More data for this
Ligand-Target Pair
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM194962
PNG
(US9206198, 17)
Show SMILES CCC1=C(COC1=O)N1CCC2(CCN(C[C@H](OC)c3ccc4C(=O)OCc4c3C)CC2)C1=O
Show InChI InChI=1/C26H32N2O6/c1-4-17-21(15-34-23(17)29)28-12-9-26(25(28)31)7-10-27(11-8-26)13-22(32-3)18-5-6-19-20(16(18)2)14-33-24(19)30/h5-6,22H,4,7-15H2,1-3H3/t22-/s2
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n/an/a 20n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Block of Kir1.1 (ROMK1) currents was examined by whole cell voltage clamp (Hamill et. al. Pfluegers Archives 391:85-100 (1981)) using the IonWorks ...


US Patent US9206198 (2015)

More data for this
Ligand-Target Pair
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM195026
PNG
(US9206198, 30)
Show SMILES CC1CC2(CCN(C[C@@H](O)c3ccc4C(=O)OCc4c3C)CC2)C(=O)N1C1=C(C)C(=O)OC1
Show InChI InChI=1/C25H30N2O6/c1-14-10-25(24(31)27(14)20-13-33-22(29)16(20)3)6-8-26(9-7-25)11-21(28)17-4-5-18-19(15(17)2)12-32-23(18)30/h4-5,14,21,28H,6-13H2,1-3H3/t14?,21-/s2
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n/an/a 20n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Block of Kir1.1 (ROMK1) currents was examined by whole cell voltage clamp (Hamill et. al. Pfluegers Archives 391:85-100 (1981)) using the IonWorks ...


US Patent US9206198 (2015)

More data for this
Ligand-Target Pair
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM194990
PNG
(US9206198, 51)
Show SMILES CO[C@@H](CN1CCC2(CCN(C3=CC(=O)OC3)C2=O)CC1)c1ccc2C(=O)OCc2c1C
Show InChI InChI=1/C24H28N2O6/c1-15-17(3-4-18-19(15)14-32-22(18)28)20(30-2)12-25-8-5-24(6-9-25)7-10-26(23(24)29)16-11-21(27)31-13-16/h3-4,11,20H,5-10,12-14H2,1-2H3/t20-/s2
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n/an/a 20n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Block of Kir1.1 (ROMK1) currents was examined by whole cell voltage clamp (Hamill et. al. Pfluegers Archives 391:85-100 (1981)) using the IonWorks ...


US Patent US9206198 (2015)

More data for this
Ligand-Target Pair
Renal Outer Medullary Potassium (ROMK) channel (Kir1.1)


(Homo sapiens)
BDBM195005
PNG
(US9206198, 66)
Show SMILES CCC1CC2(CCN(C[C@H](O)c3ccc4C(=O)OCc4c3C)CC2)C(=O)N1C1=CC(=O)OC1
Show InChI InChI=1/C25H30N2O6/c1-3-16-11-25(24(31)27(16)17-10-22(29)32-13-17)6-8-26(9-7-25)12-21(28)18-4-5-19-20(15(18)2)14-33-23(19)30/h4-5,10,16,21,28H,3,6-9,11-14H2,1-2H3/t16?,21-/s2
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n/an/a 20n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Block of Kir1.1 (ROMK1) currents was examined by whole cell voltage clamp (Hamill et. al. Pfluegers Archives 391:85-100 (1981)) using the IonWorks ...


US Patent US9206198 (2015)

More data for this
Ligand-Target Pair
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