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Compile Data Set for Download or QSAR

Found 16 hits of affinity data for UniProtKB/TrEMBL: Q5JUK3   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Potassium channel subfamily T member 1


(Homo sapiens)
BDBM50557676
PNG
(CHEMBL4763955)
Show SMILES C[C@H](NC(=O)c1cc(nn1C)C(F)(F)F)c1nc(no1)-c1ccnc(c1)C1CC1
Show InChI InChI=1S/C18H17F3N6O2/c1-9(23-16(28)13-8-14(18(19,20)21)25-27(13)2)17-24-15(26-29-17)11-5-6-22-12(7-11)10-3-4-10/h5-10H,3-4H2,1-2H3,(H,23,28)/t9-/m0/s1
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n/an/a 16n/an/an/an/an/an/a



Praxis Precision Medicines

Curated by ChEMBL


Assay Description
Inhibition of recombinant wild type human KNa1.1 expressed in human HEK-TREX cells at -80 mV holding potential by automated patch clamp assay


ACS Med Chem Lett 12: 593-602 (2021)

More data for this
Ligand-Target Pair
Potassium channel subfamily T member 1


(Homo sapiens)
BDBM50557672
PNG
(CHEMBL4788669)
Show SMILES COc1cc(ccn1)-c1noc(n1)[C@H](C)NC(=O)c1cc(nn1C)C(F)(F)F
Show InChI InChI=1S/C16H15F3N6O3/c1-8(21-14(26)10-7-11(16(17,18)19)23-25(10)2)15-22-13(24-28-15)9-4-5-20-12(6-9)27-3/h4-8H,1-3H3,(H,21,26)/t8-/m0/s1
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n/an/a 27n/an/an/an/an/an/a



Praxis Precision Medicines

Curated by ChEMBL


Assay Description
Inhibition of recombinant wild type human KNa1.1 expressed in human HEK-TREX cells at -80 mV holding potential by automated patch clamp assay


ACS Med Chem Lett 12: 593-602 (2021)

More data for this
Ligand-Target Pair
Potassium channel subfamily T member 1


(Homo sapiens)
BDBM50557680
PNG
(CHEMBL4741793)
Show SMILES C[C@H](NC(=O)c1cc(nn1C)C(F)(F)F)c1nc(no1)-c1ccnc(c1)C(F)(F)F
Show InChI InChI=1S/C16H12F6N6O2/c1-7(24-13(29)9-6-11(16(20,21)22)26-28(9)2)14-25-12(27-30-14)8-3-4-23-10(5-8)15(17,18)19/h3-7H,1-2H3,(H,24,29)/t7-/m0/s1
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n/an/a 40n/an/an/an/an/an/a



Praxis Precision Medicines

Curated by ChEMBL


Assay Description
Inhibition of recombinant wild type human KNa1.1 expressed in human HEK-TREX cells at -80 mV holding potential by automated patch clamp assay


ACS Med Chem Lett 12: 593-602 (2021)

More data for this
Ligand-Target Pair
Potassium channel subfamily T member 1


(Homo sapiens)
BDBM50557678
PNG
(CHEMBL4754084)
Show SMILES C[C@H](NC(=O)c1cc(nn1C)C(F)(F)F)c1nc(no1)-c1ccnc(c1)C(F)F
Show InChI InChI=1S/C16H13F5N6O2/c1-7(23-14(28)10-6-11(16(19,20)21)25-27(10)2)15-24-13(26-29-15)8-3-4-22-9(5-8)12(17)18/h3-7,12H,1-2H3,(H,23,28)/t7-/m0/s1
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n/an/a 61n/an/an/an/an/an/a



Praxis Precision Medicines

Curated by ChEMBL


Assay Description
Inhibition of recombinant wild type human KNa1.1 expressed in human HEK-TREX cells at -80 mV holding potential by automated patch clamp assay


ACS Med Chem Lett 12: 593-602 (2021)

More data for this
Ligand-Target Pair
Potassium channel subfamily T member 1


(Homo sapiens)
BDBM50557660
PNG
(CHEMBL4783741)
Show SMILES C[C@H](NC(=O)c1cc(nn1C)C(F)(F)F)c1nc(no1)-c1cccc(F)c1
Show InChI InChI=1S/C16H13F4N5O2/c1-8(15-22-13(24-27-15)9-4-3-5-10(17)6-9)21-14(26)11-7-12(16(18,19)20)23-25(11)2/h3-8H,1-2H3,(H,21,26)/t8-/m0/s1
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n/an/a 136n/an/an/an/an/an/a



Praxis Precision Medicines

Curated by ChEMBL


Assay Description
Inhibition of recombinant wild type human KNa1.1 expressed in human HEK-TREX cells at -80 mV holding potential by automated patch clamp assay


ACS Med Chem Lett 12: 593-602 (2021)

More data for this
Ligand-Target Pair
Potassium channel subfamily T member 1


(Homo sapiens)
BDBM50557666
PNG
(CHEMBL4786255)
Show SMILES C[C@H](NC(=O)c1cc(nn1C)C(F)(F)F)c1nc(no1)-c1ccnc(C)c1
Show InChI InChI=1S/C16H15F3N6O2/c1-8-6-10(4-5-20-8)13-22-15(27-24-13)9(2)21-14(26)11-7-12(16(17,18)19)23-25(11)3/h4-7,9H,1-3H3,(H,21,26)/t9-/m0/s1
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n/an/a 165n/an/an/an/an/an/a



Praxis Precision Medicines

Curated by ChEMBL


Assay Description
Inhibition of recombinant wild type human KNa1.1 expressed in human HEK-TREX cells at -80 mV holding potential by automated patch clamp assay


ACS Med Chem Lett 12: 593-602 (2021)

More data for this
Ligand-Target Pair
Potassium channel subfamily T member 1


(Homo sapiens)
BDBM50557652
PNG
(CHEMBL4793291)
Show SMILES C[C@H](NC(=O)c1cc(nn1C)C1CC1)c1nc(no1)-c1cccc(C)c1
Show InChI InChI=1S/C19H21N5O2/c1-11-5-4-6-14(9-11)17-21-19(26-23-17)12(2)20-18(25)16-10-15(13-7-8-13)22-24(16)3/h4-6,9-10,12-13H,7-8H2,1-3H3,(H,20,25)/t12-/m0/s1
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n/an/a 167n/an/an/an/an/an/a



Praxis Precision Medicines

Curated by ChEMBL


Assay Description
Inhibition of recombinant wild type human KNa1.1 expressed in human HEK-TREX cells at -80 mV holding potential by automated patch clamp assay


ACS Med Chem Lett 12: 593-602 (2021)

More data for this
Ligand-Target Pair
Potassium channel subfamily T member 1


(Homo sapiens)
BDBM50557679
PNG
(CHEMBL4793279)
Show SMILES CNc1cc(ccn1)-c1noc(n1)[C@H](C)NC(=O)c1cc(nn1C)C(F)(F)F
Show InChI InChI=1S/C16H16F3N7O2/c1-8(22-14(27)10-7-11(16(17,18)19)24-26(10)3)15-23-13(25-28-15)9-4-5-21-12(6-9)20-2/h4-8H,1-3H3,(H,20,21)(H,22,27)/t8-/m0/s1
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n/an/a 195n/an/an/an/an/an/a



Praxis Precision Medicines

Curated by ChEMBL


Assay Description
Inhibition of recombinant wild type human KNa1.1 expressed in human HEK-TREX cells at -80 mV holding potential by automated patch clamp assay


ACS Med Chem Lett 12: 593-602 (2021)

More data for this
Ligand-Target Pair
Potassium channel subfamily T member 1


(Homo sapiens)
BDBM50557677
PNG
(CHEMBL4750925)
Show SMILES COCc1cc(ccn1)-c1noc(n1)[C@H](C)NC(=O)c1cc(nn1C)C(F)(F)F
Show InChI InChI=1S/C17H17F3N6O3/c1-9(22-15(27)12-7-13(17(18,19)20)24-26(12)2)16-23-14(25-29-16)10-4-5-21-11(6-10)8-28-3/h4-7,9H,8H2,1-3H3,(H,22,27)/t9-/m0/s1
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n/an/a 322n/an/an/an/an/an/a



Praxis Precision Medicines

Curated by ChEMBL


Assay Description
Inhibition of recombinant wild type human KNa1.1 expressed in human HEK-TREX cells at -80 mV holding potential by automated patch clamp assay


ACS Med Chem Lett 12: 593-602 (2021)

More data for this
Ligand-Target Pair
Potassium channel subfamily T member 1


(Homo sapiens)
BDBM50557656
PNG
(CHEMBL4783466)
Show SMILES CCc1cc(C(=O)N[C@@H](C)c2nc(no2)-c2cccc(C)c2)n(C)n1
Show InChI InChI=1S/C18H21N5O2/c1-5-14-10-15(23(4)21-14)17(24)19-12(3)18-20-16(22-25-18)13-8-6-7-11(2)9-13/h6-10,12H,5H2,1-4H3,(H,19,24)/t12-/m0/s1
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n/an/a 335n/an/an/an/an/an/a



Praxis Precision Medicines

Curated by ChEMBL


Assay Description
Inhibition of recombinant wild type human KNa1.1 expressed in human HEK-TREX cells at -80 mV holding potential by automated patch clamp assay


ACS Med Chem Lett 12: 593-602 (2021)

More data for this
Ligand-Target Pair
Potassium channel subfamily T member 1


(Homo sapiens)
BDBM50557674
PNG
(CHEMBL4795194)
Show SMILES C[C@H](NC(=O)c1cc(nn1C)C(F)(F)F)c1nc(no1)-c1ccnc(c1)N(C)C
Show InChI InChI=1S/C17H18F3N7O2/c1-9(22-15(28)11-8-12(17(18,19)20)24-27(11)4)16-23-14(25-29-16)10-5-6-21-13(7-10)26(2)3/h5-9H,1-4H3,(H,22,28)/t9-/m0/s1
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n/an/a 454n/an/an/an/an/an/a



Praxis Precision Medicines

Curated by ChEMBL


Assay Description
Inhibition of recombinant wild type human KNa1.1 expressed in human HEK-TREX cells at -80 mV holding potential by automated patch clamp assay


ACS Med Chem Lett 12: 593-602 (2021)

More data for this
Ligand-Target Pair
Potassium channel subfamily T member 1


(Homo sapiens)
BDBM50557675
PNG
(CHEMBL4743249)
Show SMILES COc1cc(cc(C)n1)-c1noc(n1)[C@H](C)NC(=O)c1cc(nn1C)C(F)(F)F
Show InChI InChI=1S/C17H17F3N6O3/c1-8-5-10(6-13(21-8)28-4)14-23-16(29-25-14)9(2)22-15(27)11-7-12(17(18,19)20)24-26(11)3/h5-7,9H,1-4H3,(H,22,27)/t9-/m0/s1
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n/an/a 505n/an/an/an/an/an/a



Praxis Precision Medicines

Curated by ChEMBL


Assay Description
Inhibition of recombinant wild type human KNa1.1 expressed in human HEK-TREX cells at -80 mV holding potential by automated patch clamp assay


ACS Med Chem Lett 12: 593-602 (2021)

More data for this
Ligand-Target Pair
Potassium channel subfamily T member 1


(Homo sapiens)
BDBM50557673
PNG
(CHEMBL4781553)
Show SMILES C[C@H](NC(=O)c1cc(nn1C)C(F)(F)F)c1nc(no1)-c1ccnc(c1)N1CCCC1
Show InChI InChI=1S/C19H20F3N7O2/c1-11(24-17(30)13-10-14(19(20,21)22)26-28(13)2)18-25-16(27-31-18)12-5-6-23-15(9-12)29-7-3-4-8-29/h5-6,9-11H,3-4,7-8H2,1-2H3,(H,24,30)/t11-/m0/s1
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n/an/a 573n/an/an/an/an/an/a



Praxis Precision Medicines

Curated by ChEMBL


Assay Description
Inhibition of recombinant wild type human KNa1.1 expressed in human HEK-TREX cells at -80 mV holding potential by automated patch clamp assay


ACS Med Chem Lett 12: 593-602 (2021)

More data for this
Ligand-Target Pair
Potassium channel subfamily T member 1


(Homo sapiens)
BDBM50557682
PNG
(CHEMBL4745211)
Show SMILES CO[C@@H](C)c1cc(ccn1)-c1noc(n1)[C@H](C)NC(=O)c1cc(nn1C)C(F)(F)F
Show InChI InChI=1S/C18H19F3N6O3/c1-9(23-16(28)13-8-14(18(19,20)21)25-27(13)3)17-24-15(26-30-17)11-5-6-22-12(7-11)10(2)29-4/h5-10H,1-4H3,(H,23,28)/t9-,10-/m0/s1
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n/an/a 744n/an/an/an/an/an/a



Praxis Precision Medicines

Curated by ChEMBL


Assay Description
Inhibition of recombinant wild type human KNa1.1 expressed in human HEK-TREX cells at -80 mV holding potential by automated patch clamp assay


ACS Med Chem Lett 12: 593-602 (2021)

More data for this
Ligand-Target Pair
Potassium channel subfamily T member 1


(Homo sapiens)
BDBM50557683
PNG
(CHEMBL4758890)
Show SMILES CO[C@H](C)c1cc(ccn1)-c1noc(n1)[C@H](C)NC(=O)c1cc(nn1C)C(F)(F)F
Show InChI InChI=1S/C18H19F3N6O3/c1-9(23-16(28)13-8-14(18(19,20)21)25-27(13)3)17-24-15(26-30-17)11-5-6-22-12(7-11)10(2)29-4/h5-10H,1-4H3,(H,23,28)/t9-,10+/m0/s1
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n/an/a 778n/an/an/an/an/an/a



Praxis Precision Medicines

Curated by ChEMBL


Assay Description
Inhibition of recombinant wild type human KNa1.1 expressed in human HEK-TREX cells at -80 mV holding potential by automated patch clamp assay


ACS Med Chem Lett 12: 593-602 (2021)

More data for this
Ligand-Target Pair
Potassium channel subfamily T member 1


(Homo sapiens)
BDBM50557659
PNG
(CHEMBL4779088)
Show SMILES CC(NC(=O)c1cc(nn1C)C(F)(F)F)c1noc(n1)-c1cccc(C)c1
Show InChI InChI=1S/C17H16F3N5O2/c1-9-5-4-6-11(7-9)16-22-14(24-27-16)10(2)21-15(26)12-8-13(17(18,19)20)23-25(12)3/h4-8,10H,1-3H3,(H,21,26)
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n/an/a 977n/an/an/an/an/an/a



Praxis Precision Medicines

Curated by ChEMBL


Assay Description
Inhibition of recombinant wild type human KNa1.1 expressed in human HEK-TREX cells at -80 mV holding potential by automated patch clamp assay


ACS Med Chem Lett 12: 593-602 (2021)

More data for this
Ligand-Target Pair