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Patent code US8921364

Compile Data Set for Download or QSAR
Found 56 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
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141416
PNG
(US10668051, Compound Example 67 | US8921364, 67)
Show SMILES Fc1cnccc1C(=O)Nc1ccc(cc1)-n1nc(cc1C1CC1)C(F)(F)F
Show InChI InChI=1S/C19H14F4N4O/c20-15-10-24-8-7-14(15)18(28)25-12-3-5-13(6-4-12)27-16(11-1-2-11)9-17(26-27)19(21,22)23/h3-11H,1-2H2,(H,25,28)
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n/an/a 20.4n/an/an/an/an/a37



Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141426
PNG
(US10668051, Compound Example 84 | US8921364, 84)
Show SMILES Cc1oncc1C(=O)Nc1ccc(c(F)c1)-n1nc(cc1C1CC1)C(F)(F)F
Show InChI InChI=1S/C18H14F4N4O2/c1-9-12(8-23-28-9)17(27)24-11-4-5-14(13(19)6-11)26-15(10-2-3-10)7-16(25-26)18(20,21)22/h4-8,10H,2-3H2,1H3,(H,24,27)
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n/an/a 20.8n/an/an/an/an/a37



Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141438
PNG
(US10668051, Compound Example 104 | US8921364, 104)
Show SMILES Cc1ccccc1C(=O)Nc1ccc(nc1)-n1nc(cc1C1CC1)C(F)(F)F
Show InChI InChI=1S/C20H17F3N4O/c1-12-4-2-3-5-15(12)19(28)25-14-8-9-18(24-11-14)27-16(13-6-7-13)10-17(26-27)20(21,22)23/h2-5,8-11,13H,6-7H2,1H3,(H,25,28)
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n/an/a 23.0n/an/an/an/an/a37



Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141428
PNG
(US10668051, Compound Example 87 | US8921364, 87)
Show SMILES Fc1cccc(C(=O)Nc2ccc(c(F)c2)-n2nc(cc2C2CC2)C(F)(F)F)c1F
Show InChI InChI=1S/C20H13F6N3O/c21-13-3-1-2-12(18(13)23)19(30)27-11-6-7-15(14(22)8-11)29-16(10-4-5-10)9-17(28-29)20(24,25)26/h1-3,6-10H,4-5H2,(H,27,30)
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n/an/a 32.6n/an/an/an/an/a37



Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141421
PNG
(US10668051, Compound Example 78 | US8921364, 78)
Show SMILES Cc1ncsc1NC(=O)c1ccc(cc1)-n1nc(cc1C1CC1)C(F)(F)F
Show InChI InChI=1S/C18H15F3N4OS/c1-10-17(27-9-22-10)23-16(26)12-4-6-13(7-5-12)25-14(11-2-3-11)8-15(24-25)18(19,20)21/h4-9,11H,2-3H2,1H3,(H,23,26)
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n/an/a 34.1n/an/an/an/an/a37



Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141424
PNG
(US10668051, Compound Example 82 | US8921364, 82)
Show SMILES Cc1nnsc1C(=O)Nc1ccc(c(F)c1)-n1nc(cc1C1CC1)C(F)(F)F
Show InChI InChI=1S/C17H13F4N5OS/c1-8-15(28-25-23-8)16(27)22-10-4-5-12(11(18)6-10)26-13(9-2-3-9)7-14(24-26)17(19,20)21/h4-7,9H,2-3H2,1H3,(H,22,27)
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n/an/a 35.7n/an/an/an/an/a37



Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141396
PNG
(US10668051, Compound Example 7 | US8921364, 7)
Show SMILES Cc1ccccc1C(=O)Nc1ccc(cc1)-n1nc(cc1C1CC1)C1CC1
Show InChI InChI=1S/C23H23N3O/c1-15-4-2-3-5-20(15)23(27)24-18-10-12-19(13-11-18)26-22(17-8-9-17)14-21(25-26)16-6-7-16/h2-5,10-14,16-17H,6-9H2,1H3,(H,24,27)
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n/an/a 36.4n/an/an/an/an/a37



Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141444
PNG
(US10668051, Compound Example 114 | US8921364, 114)
Show SMILES Fc1cnccc1C(=O)Nc1ccc(nc1)-n1nc(cc1C1CC1)C(F)(F)F
Show InChI InChI=1S/C18H13F4N5O/c19-13-9-23-6-5-12(13)17(28)25-11-3-4-16(24-8-11)27-14(10-1-2-10)7-15(26-27)18(20,21)22/h3-10H,1-2H2,(H,25,28)
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n/an/a 37.6n/an/an/an/an/a37



Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141442
PNG
(US10668051, Compound Example 111 | US8921364, 111)
Show SMILES FC(F)(F)c1cc(C2CC2)n(n1)-c1ccc(NC(=O)c2cccnc2)cn1
Show InChI InChI=1S/C18H14F3N5O/c19-18(20,21)15-8-14(11-3-4-11)26(25-15)16-6-5-13(10-23-16)24-17(27)12-2-1-7-22-9-12/h1-2,5-11H,3-4H2,(H,24,27)
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n/an/a 47.2n/an/an/an/an/a37



Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141419
PNG
(US10668051, Compound Example 74 | US8921364, 74)
Show SMILES Cc1ncsc1CNc1ccc(cc1)-n1nc(cc1C1CC1)C(F)(F)F
Show InChI InChI=1S/C18H17F3N4S/c1-11-16(26-10-23-11)9-22-13-4-6-14(7-5-13)25-15(12-2-3-12)8-17(24-25)18(19,20)21/h4-8,10,12,22H,2-3,9H2,1H3
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n/an/a 48.0n/an/an/an/an/a37



Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141425
PNG
(US10668051, Compound Example 83 | US8921364, 83)
Show SMILES Cc1ncsc1C(=O)Nc1ccc(c(F)c1)-n1nc(cc1C1CC1)C(F)(F)F
Show InChI InChI=1S/C18H14F4N4OS/c1-9-16(28-8-23-9)17(27)24-11-4-5-13(12(19)6-11)26-14(10-2-3-10)7-15(25-26)18(20,21)22/h4-8,10H,2-3H2,1H3,(H,24,27)
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n/an/a 48.2n/an/an/an/an/a37



Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141418
PNG
(US10668051, Compound Example 72 | US8921364, 72)
Show SMILES FC(F)(F)c1cc(C2CC2)n(n1)-c1ccc(NC(=O)Cc2cccnc2)cc1
Show InChI InChI=1S/C20H17F3N4O/c21-20(22,23)18-11-17(14-3-4-14)27(26-18)16-7-5-15(6-8-16)25-19(28)10-13-2-1-9-24-12-13/h1-2,5-9,11-12,14H,3-4,10H2,(H,25,28)
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n/an/a 48.2n/an/an/an/an/a37



Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141441
PNG
(US10668051, Compound Example 108 | US8921364, 108)
Show SMILES Fc1cccc(F)c1C(=O)Nc1ccc(nc1)-n1nc(cc1C1CC1)C(F)(F)F
Show InChI InChI=1S/C19H13F5N4O/c20-12-2-1-3-13(21)17(12)18(29)26-11-6-7-16(25-9-11)28-14(10-4-5-10)8-15(27-28)19(22,23)24/h1-3,6-10H,4-5H2,(H,26,29)
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n/an/a 50.6n/an/an/an/an/a37



Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141448
PNG
(US10668051, Compound Example 126 | US8921364, 126)
Show SMILES Cc1ncsc1C(=O)Nc1ccc(cc1)-n1nc(cc1C(F)F)C(F)(F)F
Show InChI InChI=1S/C16H11F5N4OS/c1-8-13(27-7-22-8)15(26)23-9-2-4-10(5-3-9)25-11(14(17)18)6-12(24-25)16(19,20)21/h2-7,14H,1H3,(H,23,26)
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n/an/a 52.6n/an/an/an/an/a37



Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141439
PNG
(US10668051, Compound Example 106 | US8921364, 106)
Show SMILES Fc1ccccc1C(=O)Nc1ccc(nc1)-n1nc(cc1C1CC1)C(F)(F)F
Show InChI InChI=1S/C19H14F4N4O/c20-14-4-2-1-3-13(14)18(28)25-12-7-8-17(24-10-12)27-15(11-5-6-11)9-16(26-27)19(21,22)23/h1-4,7-11H,5-6H2,(H,25,28)
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n/an/a 60n/an/an/an/an/a37



Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141402
PNG
(US10668051, Compound Example 28 | US8921364, 28)
Show SMILES Cc1nnsc1C(=O)Nc1ccc(c(F)c1)-n1nc(cc1C1CC1)C1CC1
Show InChI InChI=1S/C19H18FN5OS/c1-10-18(27-24-22-10)19(26)21-13-6-7-16(14(20)8-13)25-17(12-4-5-12)9-15(23-25)11-2-3-11/h6-9,11-12H,2-5H2,1H3,(H,21,26)
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n/an/a 60.3n/an/an/an/an/a37



Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141393
PNG
(US10668051, Compound Example 1 | US8921364, 1)
Show SMILES Cc1nnsc1C(=O)Nc1ccc(cc1)-n1nc(cc1C1CC1)C1CC1
Show InChI InChI=1S/C19H19N5OS/c1-11-18(26-23-21-11)19(25)20-14-6-8-15(9-7-14)24-17(13-4-5-13)10-16(22-24)12-2-3-12/h6-10,12-13H,2-5H2,1H3,(H,20,25)
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n/an/a 62.4n/an/an/an/an/a37



Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141443
PNG
(US10668051, Compound Example 113 | US8921364, 113)
Show SMILES FC(F)(F)c1cc(C2CC2)n(n1)-c1ccc(NC(=O)c2ccncc2)cn1
Show InChI InChI=1S/C18H14F3N5O/c19-18(20,21)15-9-14(11-1-2-11)26(25-15)16-4-3-13(10-23-16)24-17(27)12-5-7-22-8-6-12/h3-11H,1-2H2,(H,24,27)
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n/an/a 62.6n/an/an/an/an/a37



Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141412
PNG
(US10668051, Compound Example 56 | US8921364, 56)
Show SMILES Cc1oncc1C(=O)Nc1ccc(cc1)-n1nc(cc1C1CC1)C(F)(F)F
Show InChI InChI=1S/C18H15F3N4O2/c1-10-14(9-22-27-10)17(26)23-12-4-6-13(7-5-12)25-15(11-2-3-11)8-16(24-25)18(19,20)21/h4-9,11H,2-3H2,1H3,(H,23,26)
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n/an/a 63.2n/an/an/an/an/a37



Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141409
PNG
(US10668051, Compound Example 49 | US8921364, 49)
Show SMILES FC(F)(F)c1cc(C2CC2)n(n1)-c1ccc(NC(=O)c2c(Cl)cncc2Cl)cc1
Show InChI InChI=1S/C19H13Cl2F3N4O/c20-13-8-25-9-14(21)17(13)18(29)26-11-3-5-12(6-4-11)28-15(10-1-2-10)7-16(27-28)19(22,23)24/h3-10H,1-2H2,(H,26,29)
PDB

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n/an/a 65.5n/an/an/an/an/a37



Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141440
PNG
(US10668051, Compound Example 107 | US8921364, 107)
Show SMILES Fc1cccc(C(=O)Nc2ccc(nc2)-n2nc(cc2C2CC2)C(F)(F)F)c1F
Show InChI InChI=1S/C19H13F5N4O/c20-13-3-1-2-12(17(13)21)18(29)26-11-6-7-16(25-9-11)28-14(10-4-5-10)8-15(27-28)19(22,23)24/h1-3,6-10H,4-5H2,(H,26,29)
PDB

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n/an/a 70.3n/an/an/an/an/a37



Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141411
PNG
(US10668051, Compound Example 53 | US8921364, 53)
Show SMILES Cc1ncsc1C(=O)Nc1ccc(cc1)-n1nc(cc1C1CC1)C(F)(F)F
Show InChI InChI=1S/C18H15F3N4OS/c1-10-16(27-9-22-10)17(26)23-12-4-6-13(7-5-12)25-14(11-2-3-11)8-15(24-25)18(19,20)21/h4-9,11H,2-3H2,1H3,(H,23,26)
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n/an/a 72.0n/an/an/an/an/a37



Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141445
PNG
(US10668051, Compound Example 122 | US8921364, 122)
Show SMILES Fc1cccc(F)c1NC(=O)c1ccc(nc1)-n1nc(cc1C1CC1)C(F)(F)F
Show InChI InChI=1S/C19H13F5N4O/c20-12-2-1-3-13(21)17(12)26-18(29)11-6-7-16(25-9-11)28-14(10-4-5-10)8-15(27-28)19(22,23)24/h1-3,6-10H,4-5H2,(H,26,29)
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n/an/a 72.1n/an/an/an/an/a37



Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141434
PNG
(US10668051, Compound Example 93 | US8921364, 93)
Show SMILES Cc1ncncc1C(=O)Nc1ccc(c(F)c1)-n1nc(cc1C1CC1)C(F)(F)F
Show InChI InChI=1S/C19H15F4N5O/c1-10-13(8-24-9-25-10)18(29)26-12-4-5-15(14(20)6-12)28-16(11-2-3-11)7-17(27-28)19(21,22)23/h4-9,11H,2-3H2,1H3,(H,26,29)
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n/an/a 81.3n/an/an/an/an/a37



Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141429
PNG
(US10668051, Compound Example 88 | US8921364, 88)
Show SMILES Fc1cccc(F)c1C(=O)Nc1ccc(c(F)c1)-n1nc(cc1C1CC1)C(F)(F)F
Show InChI InChI=1S/C20H13F6N3O/c21-12-2-1-3-13(22)18(12)19(30)27-11-6-7-15(14(23)8-11)29-16(10-4-5-10)9-17(28-29)20(24,25)26/h1-3,6-10H,4-5H2,(H,27,30)
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n/an/a 98.6n/an/an/an/an/a37



Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141436
PNG
(US10668051, Compound Example 100 | US8921364, 100)
Show SMILES Fc1cccc(F)c1NC(=O)c1ccc(c(F)c1)-n1nc(cc1C1CC1)C(F)(F)F
Show InChI InChI=1S/C20H13F6N3O/c21-12-2-1-3-13(22)18(12)27-19(30)11-6-7-15(14(23)8-11)29-16(10-4-5-10)9-17(28-29)20(24,25)26/h1-3,6-10H,4-5H2,(H,27,30)
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n/an/a 99.7n/an/an/an/an/a37



Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141414
PNG
(US10668051, Compound Example 60 | US8921364, 60)
Show SMILES Cc1ccccc1C(=O)Nc1ccc(cc1)-n1nc(cc1C1CC1)C(F)(F)F
Show InChI InChI=1S/C21H18F3N3O/c1-13-4-2-3-5-17(13)20(28)25-15-8-10-16(11-9-15)27-18(14-6-7-14)12-19(26-27)21(22,23)24/h2-5,8-12,14H,6-7H2,1H3,(H,25,28)
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n/an/a 120n/an/an/an/an/a37



Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141422
PNG
(US10668051, Compound Example 79 | US8921364, 79)
Show SMILES Fc1cccc(F)c1NC(=O)c1ccc(cc1)-n1nc(cc1C1CC1)C(F)(F)F
Show InChI InChI=1S/C20H14F5N3O/c21-14-2-1-3-15(22)18(14)26-19(29)12-6-8-13(9-7-12)28-16(11-4-5-11)10-17(27-28)20(23,24)25/h1-3,6-11H,4-5H2,(H,26,29)
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n/an/a 124n/an/an/an/an/a37



Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141413
PNG
(US10668051, Compound Example 57 | US8921364, 57)
Show SMILES Cc1noc(C)c1C(=O)Nc1ccc(cc1)-n1nc(cc1C1CC1)C(F)(F)F
Show InChI InChI=1S/C19H17F3N4O2/c1-10-17(11(2)28-25-10)18(27)23-13-5-7-14(8-6-13)26-15(12-3-4-12)9-16(24-26)19(20,21)22/h5-9,12H,3-4H2,1-2H3,(H,23,27)
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n/an/a 125n/an/an/an/an/a37



Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141399
PNG
(US10668051, Compound Example 17 | US8921364, 17)
Show SMILES Clc1cncc(Cl)c1C(=O)Nc1ccc(cc1)-n1nc(cc1C1CC1)C1CC1
Show InChI InChI=1S/C21H18Cl2N4O/c22-16-10-24-11-17(23)20(16)21(28)25-14-5-7-15(8-6-14)27-19(13-3-4-13)9-18(26-27)12-1-2-12/h5-13H,1-4H2,(H,25,28)
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n/an/a 130n/an/an/an/an/a37



Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141397
PNG
(US10668051, Compound Example 15 | US8921364, 15)
Show SMILES O=C(Nc1ccc(cc1)-n1nc(cc1C1CC1)C1CC1)c1ccncc1
Show InChI InChI=1S/C21H20N4O/c26-21(16-9-11-22-12-10-16)23-17-5-7-18(8-6-17)25-20(15-3-4-15)13-19(24-25)14-1-2-14/h5-15H,1-4H2,(H,23,26)
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n/an/a 141n/an/an/an/an/a37



Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141403
PNG
(US10668051, Compound Example 33 | US8921364, 33)
Show SMILES Fc1cccc(F)c1C(=O)Nc1ccc(c(F)c1)-n1nc(cc1C1CC1)C1CC1
Show InChI InChI=1S/C22H18F3N3O/c23-15-2-1-3-16(24)21(15)22(29)26-14-8-9-19(17(25)10-14)28-20(13-6-7-13)11-18(27-28)12-4-5-12/h1-3,8-13H,4-7H2,(H,26,29)
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n/an/a 145n/an/an/an/an/a37



Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141427
PNG
(US10668051, Compound Example 86 | US8921364, 86)
Show SMILES Cc1ccccc1C(=O)Nc1ccc(c(F)c1)-n1nc(cc1C1CC1)C(F)(F)F
Show InChI InChI=1S/C21H17F4N3O/c1-12-4-2-3-5-15(12)20(29)26-14-8-9-17(16(22)10-14)28-18(13-6-7-13)11-19(27-28)21(23,24)25/h2-5,8-11,13H,6-7H2,1H3,(H,26,29)
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n/an/a 147n/an/an/an/an/a37



Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141437
PNG
(US10668051, Compound Example 101 | US8921364, 101)
Show SMILES Cc1nnsc1C(=O)Nc1ccc(nc1)-n1nc(cc1C1CC1)C(F)(F)F
Show InChI InChI=1S/C16H13F3N6OS/c1-8-14(27-24-22-8)15(26)21-10-4-5-13(20-7-10)25-11(9-2-3-9)6-12(23-25)16(17,18)19/h4-7,9H,2-3H2,1H3,(H,21,26)
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n/an/a 150n/an/an/an/an/a37



Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141432
PNG
(US10668051, Compound Example 91 | US8921364, 91)
Show SMILES Fc1cnccc1C(=O)Nc1ccc(c(F)c1)-n1nc(cc1C1CC1)C(F)(F)F
Show InChI InChI=1S/C19H13F5N4O/c20-13-7-11(26-18(29)12-5-6-25-9-14(12)21)3-4-15(13)28-16(10-1-2-10)8-17(27-28)19(22,23)24/h3-10H,1-2H2,(H,26,29)
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n/an/a 159n/an/an/an/an/a37



Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141433
PNG
(US10668051, Compound Example 92 | US8921364, 92)
Show SMILES Fc1cc(NC(=O)c2c(Cl)cncc2Cl)ccc1-n1nc(cc1C1CC1)C(F)(F)F
Show InChI InChI=1S/C19H12Cl2F4N4O/c20-11-7-26-8-12(21)17(11)18(30)27-10-3-4-14(13(22)5-10)29-15(9-1-2-9)6-16(28-29)19(23,24)25/h3-9H,1-2H2,(H,27,30)
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n/an/a 159n/an/an/an/an/a37



Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141406
PNG
(US10668051, Compound Example 37 | US8921364, 37)
Show SMILES Cc1nnsc1C(=O)Nc1ccc(c(F)c1)-n1nc(C2CC2)c(Cl)c1C1CC1
Show InChI InChI=1S/C19H17ClFN5OS/c1-9-18(28-25-23-9)19(27)22-12-6-7-14(13(21)8-12)26-17(11-4-5-11)15(20)16(24-26)10-2-3-10/h6-8,10-11H,2-5H2,1H3,(H,22,27)
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n/an/a 181n/an/an/an/an/a37



Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141410
PNG
(US10668051, Compound Example 52 | US8921364, 52)
Show SMILES Cc1nnsc1C(=O)Nc1ccc(cc1)-n1nc(cc1C1CC1)C(F)(F)F
Show InChI InChI=1S/C17H14F3N5OS/c1-9-15(27-24-22-9)16(26)21-11-4-6-12(7-5-11)25-13(10-2-3-10)8-14(23-25)17(18,19)20/h4-8,10H,2-3H2,1H3,(H,21,26)
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n/an/a 184n/an/an/an/an/a37



Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141404
PNG
(US10668051, Compound Example 35 | US8921364, 35)
Show SMILES Fc1cc(NC(=O)c2ccncc2)ccc1-n1nc(cc1C1CC1)C1CC1
Show InChI InChI=1S/C21H19FN4O/c22-17-11-16(24-21(27)15-7-9-23-10-8-15)5-6-19(17)26-20(14-3-4-14)12-18(25-26)13-1-2-13/h5-14H,1-4H2,(H,24,27)
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n/an/a 185n/an/an/an/an/a37



Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141423
PNG
(US10668051, Compound Example 80 | US8921364, 80)
Show SMILES Cc1ncsc1C(=O)Nc1ccc(cc1)-n1nc(c(Cl)c1C1CC1)C(F)(F)F
Show InChI InChI=1S/C18H14ClF3N4OS/c1-9-15(28-8-23-9)17(27)24-11-4-6-12(7-5-11)26-14(10-2-3-10)13(19)16(25-26)18(20,21)22/h4-8,10H,2-3H2,1H3,(H,24,27)
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n/an/a 194n/an/an/an/an/a37



Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141430
PNG
(US10668051, Compound Example 89 | US8921364, 89)
Show SMILES Fc1cc(NC(=O)c2cccnc2)ccc1-n1nc(cc1C1CC1)C(F)(F)F
Show InChI InChI=1S/C19H14F4N4O/c20-14-8-13(25-18(28)12-2-1-7-24-10-12)5-6-15(14)27-16(11-3-4-11)9-17(26-27)19(21,22)23/h1-2,5-11H,3-4H2,(H,25,28)
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n/an/a 206n/an/an/an/an/a37



Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141394
PNG
(US10668051, Compound Example 2 | US8921364, 2)
Show SMILES Cc1ncsc1C(=O)Nc1ccc(cc1)-n1nc(cc1C1CC1)C1CC1
Show InChI InChI=1S/C20H20N4OS/c1-12-19(26-11-21-12)20(25)22-15-6-8-16(9-7-15)24-18(14-4-5-14)10-17(23-24)13-2-3-13/h6-11,13-14H,2-5H2,1H3,(H,22,25)
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n/an/a 207n/an/an/an/an/a37



Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141405
PNG
(US10668051, Compound Example 36 | US8921364, 36)
Show SMILES Cc1ncncc1C(=O)Nc1ccc(c(F)c1)-n1nc(cc1C1CC1)C1CC1
Show InChI InChI=1S/C21H20FN5O/c1-12-16(10-23-11-24-12)21(28)25-15-6-7-19(17(22)8-15)27-20(14-4-5-14)9-18(26-27)13-2-3-13/h6-11,13-14H,2-5H2,1H3,(H,25,28)
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n/an/a 224n/an/an/an/an/a37



Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141431
PNG
(US10668051, Compound Example 90 | US8921364, 90)
Show SMILES Fc1cc(NC(=O)c2ccncc2)ccc1-n1nc(cc1C1CC1)C(F)(F)F
Show InChI InChI=1S/C19H14F4N4O/c20-14-9-13(25-18(28)12-5-7-24-8-6-12)3-4-15(14)27-16(11-1-2-11)10-17(26-27)19(21,22)23/h3-11H,1-2H2,(H,25,28)
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n/an/a 232n/an/an/an/an/a37



Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141398
PNG
(US10668051, Compound Example 16 | US8921364, 16)
Show SMILES Fc1cnccc1C(=O)Nc1ccc(cc1)-n1nc(cc1C1CC1)C1CC1
Show InChI InChI=1S/C21H19FN4O/c22-18-12-23-10-9-17(18)21(27)24-15-5-7-16(8-6-15)26-20(14-3-4-14)11-19(25-26)13-1-2-13/h5-14H,1-4H2,(H,24,27)
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n/an/a 244n/an/an/an/an/a37



Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141415
PNG
(US10668051, Compound Example 66 | US8921364, 66)
Show SMILES FC(F)(F)c1cc(C2CC2)n(n1)-c1ccc(NC(=O)c2ccncc2)cc1
Show InChI InChI=1S/C19H15F3N4O/c20-19(21,22)17-11-16(12-1-2-12)26(25-17)15-5-3-14(4-6-15)24-18(27)13-7-9-23-10-8-13/h3-12H,1-2H2,(H,24,27)
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n/an/a 255n/an/an/an/an/a37



Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141395
PNG
(US10668051, Compound Example 4 | US8921364, 4)
Show SMILES Cc1oncc1C(=O)Nc1ccc(cc1)-n1nc(cc1C1CC1)C1CC1
Show InChI InChI=1S/C20H20N4O2/c1-12-17(11-21-26-12)20(25)22-15-6-8-16(9-7-15)24-19(14-4-5-14)10-18(23-24)13-2-3-13/h6-11,13-14H,2-5H2,1H3,(H,22,25)
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n/an/a 256n/an/an/an/an/a37



Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141420
PNG
(US10668051, Compound Example 76 | US8921364, 76)
Show SMILES Cc1ncsc1NC(=O)Nc1ccc(cc1)-n1nc(cc1C1CC1)C(F)(F)F
Show InChI InChI=1S/C18H16F3N5OS/c1-10-16(28-9-22-10)24-17(27)23-12-4-6-13(7-5-12)26-14(11-2-3-11)8-15(25-26)18(19,20)21/h4-9,11H,2-3H2,1H3,(H2,23,24,27)
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Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141446
PNG
(US10668051, Compound Example 124 | US8921364, 124)
Show SMILES Fc1cccc(F)c1C(=O)Nc1cnc(nc1)-n1nc(cc1C1CC1)C(F)(F)F
Show InChI InChI=1S/C18H12F5N5O/c19-11-2-1-3-12(20)15(11)16(29)26-10-7-24-17(25-8-10)28-13(9-4-5-9)6-14(27-28)18(21,22)23/h1-3,6-9H,4-5H2,(H,26,29)
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Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141447
PNG
(US10668051, Compound Example 125 | US8921364, 125)
Show SMILES Cc1ncsc1C(=O)Nc1ccc(cc1)-n1nc(cc1CF)C(F)(F)F
Show InChI InChI=1S/C16H12F4N4OS/c1-9-14(26-8-21-9)15(25)22-10-2-4-11(5-3-10)24-12(7-17)6-13(23-24)16(18,19)20/h2-6,8H,7H2,1H3,(H,22,25)
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Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141408
PNG
(US8921364, 45)
Show SMILES Fc1cccc(F)c1C(=O)Nc1ccc(nc1)-n1nc(cc1C1CC1)C1CC1
Show InChI InChI=1S/C21H18F2N4O/c22-15-2-1-3-16(23)20(15)21(28)25-14-8-9-19(24-11-14)27-18(13-6-7-13)10-17(26-27)12-4-5-12/h1-3,8-13H,4-7H2,(H,25,28)
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Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141400
PNG
(US10668051, Compound Example 19 | US8921364, 19)
Show SMILES O=C(Cc1ccccc1)Nc1ccc(cc1)-n1nc(cc1C1CC1)C1CC1
Show InChI InChI=1S/C23H23N3O/c27-23(14-16-4-2-1-3-5-16)24-19-10-12-20(13-11-19)26-22(18-8-9-18)15-21(25-26)17-6-7-17/h1-5,10-13,15,17-18H,6-9,14H2,(H,24,27)
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Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141435
PNG
(US10668051, Compound Example 97 | US8921364, 97)
Show SMILES Cc1ncncc1NC(=O)Nc1ccc(c(F)c1)-n1nc(cc1C1CC1)C(F)(F)F
Show InChI InChI=1S/C19H16F4N6O/c1-10-14(8-24-9-25-10)27-18(30)26-12-4-5-15(13(20)6-12)29-16(11-2-3-11)7-17(28-29)19(21,22)23/h4-9,11H,2-3H2,1H3,(H2,26,27,30)
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Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141417
PNG
(US10668051, Compound Example 71 | US8921364, 71)
Show SMILES FC(F)(F)c1cc(C2CC2)n(n1)-c1ccc(NC(=O)Cc2ccccn2)cc1
Show InChI InChI=1S/C20H17F3N4O/c21-20(22,23)18-12-17(13-4-5-13)27(26-18)16-8-6-14(7-9-16)25-19(28)11-15-3-1-2-10-24-15/h1-3,6-10,12-13H,4-5,11H2,(H,25,28)
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Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141407
PNG
(BDBM444852 | US8921364, 39)
Show SMILES Cc1ncsc1C(=O)Nc1ccc(c(N)c1)-n1nc(cc1C1CC1)C1CC1
Show InChI InChI=1S/C20H21N5OS/c1-11-19(27-10-22-11)20(26)23-14-6-7-17(15(21)8-14)25-18(13-4-5-13)9-16(24-25)12-2-3-12/h6-10,12-13H,2-5,21H2,1H3,(H,23,26)
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Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
EF-hand calcium-binding domain-containing protein 4B


(Homo sapiens (Human))
BDBM141401
PNG
(US10668051, Compound Example 22 | US8921364, 22)
Show SMILES O=C(Cc1ccccn1)Nc1ccc(cc1)-n1nc(cc1C1CC1)C1CC1
Show InChI InChI=1S/C22H22N4O/c27-22(13-18-3-1-2-12-23-18)24-17-8-10-19(11-9-17)26-21(16-6-7-16)14-20(25-26)15-4-5-15/h1-3,8-12,14-16H,4-7,13H2,(H,24,27)
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Rhizen Pharmaceuticals SA

US Patent


Assay Description
Inhibition of CRAC channels was determined following thapsigargin (Sigma, Cat # T9033) induced endoplasmic calcium release in Jurkat cells. (see Yasu...


US Patent US8921364 (2014)


BindingDB Entry DOI: 10.7270/Q2N58K3N
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%