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Compile Data Set for Download or QSAR

Found 13 hits of ec50 data for polymerid = 50001773   
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
Calcium-activated potassium channel alpha/beta 1


(Homo sapiens)
BDBM50426567
PNG
(BMS-204352 | FLINDOKALNER | MaxiPost)
Show SMILES COc1ccc(Cl)cc1[C@]1(F)C(=O)Nc2cc(ccc12)C(F)(F)F
Show InChI InChI=1S/C16H10ClF4NO2/c1-24-13-5-3-9(17)7-11(13)15(18)10-4-2-8(16(19,20)21)6-12(10)22-14(15)23/h2-7H,1H3,(H,22,23)/t15-/m0/s1
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Article
PubMed
n/an/an/an/a 352n/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Positive modulation of Kca 1.1 (unknown origin)


Citation and Details
More data for this
Ligand-Target Pair
Calcium-activated potassium channel alpha/beta 1


(Homo sapiens)
BDBM50128974
PNG
(2-Azepan-1-yl-1H-pyrrolo[3,2-b]pyridine-3-carbonit...)
Show SMILES N#Cc1c([nH]c2cccnc12)N1CCCCCC1
Show InChI InChI=1S/C14H16N4/c15-10-11-13-12(6-5-7-16-13)17-14(11)18-8-3-1-2-4-9-18/h5-7,17H,1-4,8-9H2
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n/an/an/an/a 3.34E+3n/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
[86Rb+] efflux induced by BKca alpha subunits expressed in HEK293 cells at 10 microM


Bioorg Med Chem Lett 13: 2003-7 (2003)

More data for this
Ligand-Target Pair
Calcium-activated potassium channel alpha/beta 1


(Homo sapiens)
BDBM50128985
PNG
(2-Morpholin-4-yl-1H-pyrrolo[3,2-b]pyridine-3-carbo...)
Show SMILES N#Cc1c([nH]c2cccnc12)N1CCOCC1
Show InChI InChI=1S/C12H12N4O/c13-8-9-11-10(2-1-3-14-11)15-12(9)16-4-6-17-7-5-16/h1-3,15H,4-7H2
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n/an/an/an/a 3.86E+3n/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
[86Rb+] efflux induced by BKca alpha subunits expressed in HEK293 cells at 10 microM


Bioorg Med Chem Lett 13: 2003-7 (2003)

More data for this
Ligand-Target Pair
Calcium-activated potassium channel alpha/beta 1


(Homo sapiens)
BDBM50128979
PNG
(2-(3-Aza-bicyclo[3.2.2]non-3-yl)-1H-pyrrolo[3,2-b]...)
Show SMILES N#Cc1c([nH]c2cccnc12)N1CC2CCC(CC2)C1
Show InChI InChI=1S/C16H18N4/c17-8-13-15-14(2-1-7-18-15)19-16(13)20-9-11-3-4-12(10-20)6-5-11/h1-2,7,11-12,19H,3-6,9-10H2
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n/an/an/an/a 4.43E+3n/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
[86Rb+] efflux induced by BKca alpha subunits expressed in HEK293 cells at 10 microM


Bioorg Med Chem Lett 13: 2003-7 (2003)

More data for this
Ligand-Target Pair
Calcium-activated potassium channel alpha/beta 1


(Homo sapiens)
BDBM50128975
PNG
(2-((S)-3-Hydroxy-piperidin-1-yl)-1H-pyrrolo[3,2-b]...)
Show SMILES O[C@H]1CCCN(C1)c1[nH]c2cccnc2c1C#N
Show InChI InChI=1S/C13H14N4O/c14-7-10-12-11(4-1-5-15-12)16-13(10)17-6-2-3-9(18)8-17/h1,4-5,9,16,18H,2-3,6,8H2/t9-/m0/s1
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n/an/an/an/a 5.07E+3n/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
[86Rb+] efflux induced by BKca alpha subunits expressed in HEK293 cells at 10 microM


Bioorg Med Chem Lett 13: 2003-7 (2003)

More data for this
Ligand-Target Pair
Calcium-activated potassium channel alpha/beta 1


(Homo sapiens)
BDBM50128973
PNG
(2-Dimethylamino-1H-pyrrolo[3,2-b]pyridine-3-carbon...)
Show SMILES CN(C)c1[nH]c2cccnc2c1C#N
Show InChI InChI=1S/C10H10N4/c1-14(2)10-7(6-11)9-8(13-10)4-3-5-12-9/h3-5,13H,1-2H3
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n/an/an/an/a 5.13E+3n/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
[86Rb+] efflux induced by BKca alpha subunits expressed in HEK293 cells at 10 microM


Bioorg Med Chem Lett 13: 2003-7 (2003)

More data for this
Ligand-Target Pair
Calcium-activated potassium channel alpha/beta 1


(Homo sapiens)
BDBM50128978
PNG
(2-Imidazol-1-yl-1H-pyrrolo[3,2-b]pyridine-3-carbon...)
Show SMILES N#Cc1c([nH]c2cccnc12)-n1ccnc1
Show InChI InChI=1S/C11H7N5/c12-6-8-10-9(2-1-3-14-10)15-11(8)16-5-4-13-7-16/h1-5,7,15H
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n/an/an/an/a 5.86E+3n/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
[86Rb+] efflux induced by BKca alpha subunits expressed in HEK293 cells at 10 microM


Bioorg Med Chem Lett 13: 2003-7 (2003)

More data for this
Ligand-Target Pair
Calcium-activated potassium channel alpha/beta 1


(Homo sapiens)
BDBM50128984
PNG
(2-[(2-Dimethylamino-ethyl)-methyl-amino]-1H-pyrrol...)
Show SMILES CN(C)CCN(C)c1[nH]c2cccnc2c1C#N
Show InChI InChI=1S/C13H17N5/c1-17(2)7-8-18(3)13-10(9-14)12-11(16-13)5-4-6-15-12/h4-6,16H,7-8H2,1-3H3
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n/an/an/an/a 6.75E+3n/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
[86Rb+] efflux induced by BKca alpha subunits expressed in HEK293 cells at 10 microM


Bioorg Med Chem Lett 13: 2003-7 (2003)

More data for this
Ligand-Target Pair
Calcium-activated potassium channel alpha/beta 1


(Homo sapiens)
BDBM50128982
PNG
(2-Diethylamino-1H-pyrrolo[3,2-b]pyridine-3-carboni...)
Show SMILES CCN(CC)c1[nH]c2cccnc2c1C#N
Show InChI InChI=1S/C12H14N4/c1-3-16(4-2)12-9(8-13)11-10(15-12)6-5-7-14-11/h5-7,15H,3-4H2,1-2H3
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n/an/an/an/a 6.94E+3n/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
[86Rb+] efflux induced by BKca alpha subunits expressed in HEK293 cells at 10 microM


Bioorg Med Chem Lett 13: 2003-7 (2003)

More data for this
Ligand-Target Pair
Calcium-activated potassium channel alpha/beta 1


(Homo sapiens)
BDBM50128980
PNG
(2-Pyrrolidin-1-yl-1H-pyrrolo[3,2-b]pyridine-3-carb...)
Show SMILES N#Cc1c([nH]c2cccnc12)N1CCCC1
Show InChI InChI=1S/C12H12N4/c13-8-9-11-10(4-3-5-14-11)15-12(9)16-6-1-2-7-16/h3-5,15H,1-2,6-7H2
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PubMed
n/an/an/an/a 8.12E+3n/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
[86Rb+] efflux induced by BKca alpha subunits expressed in HEK293 cells at 10 microM


Bioorg Med Chem Lett 13: 2003-7 (2003)

More data for this
Ligand-Target Pair
Calcium-activated potassium channel alpha/beta 1


(Homo sapiens)
BDBM50128977
PNG
(2-Hydroxy-1H-pyrrolo[3,2-b]pyridine-3-carbonitrile...)
Show SMILES O=c1[nH]c2ccc[nH]c2c1C#N
Show InChI InChI=1S/C8H5N3O/c9-4-5-7-6(11-8(5)12)2-1-3-10-7/h1-3,10H,(H,11,12)
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n/an/an/an/a 1.34E+4n/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
[86Rb+] efflux induced by BKca alpha subunits expressed in HEK293 cells at 10 microM


Bioorg Med Chem Lett 13: 2003-7 (2003)

More data for this
Ligand-Target Pair
Calcium-activated potassium channel alpha/beta 1


(Homo sapiens)
BDBM50128976
PNG
(2-(4-Hydroxy-piperidin-1-yl)-1H-pyrrolo[3,2-b]pyri...)
Show SMILES OC1CCN(CC1)c1[nH]c2cccnc2c1C#N
Show InChI InChI=1S/C13H14N4O/c14-8-10-12-11(2-1-5-15-12)16-13(10)17-6-3-9(18)4-7-17/h1-2,5,9,16,18H,3-4,6-7H2
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n/an/an/an/a 1.51E+4n/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
[86Rb+] efflux induced by BKca alpha subunits expressed in HEK293 cells at 10 microM


Bioorg Med Chem Lett 13: 2003-7 (2003)

More data for this
Ligand-Target Pair
Calcium-activated potassium channel alpha/beta 1


(Homo sapiens)
BDBM50128981
PNG
(1-(3-Cyano-1H-pyrrolo[3,2-b]pyridin-2-yl)-piperidi...)
Show SMILES COC(=O)C1CCN(CC1)c1[nH]c2cccnc2c1C#N
Show InChI InChI=1S/C15H16N4O2/c1-21-15(20)10-4-7-19(8-5-10)14-11(9-16)13-12(18-14)3-2-6-17-13/h2-3,6,10,18H,4-5,7-8H2,1H3
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n/an/an/an/a 1.70E+4n/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
[86Rb+] efflux induced by BKca alpha subunits expressed in HEK293 cells at 10 microM


Bioorg Med Chem Lett 13: 2003-7 (2003)

More data for this
Ligand-Target Pair