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USPatent US9586959

Compile data set for download or QSAR
Found 169 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
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294419
PNG
(US9586959, Compound 98)
Show SMILES CN1CCN(CC1)c1nc2ncc(Cl)cc2n2nc(C)nc12
Show InChI InChI=1S/C14H16ClN7/c1-9-17-14-13(21-5-3-20(2)4-6-21)18-12-11(22(14)19-9)7-10(15)8-16-12/h7-8H,3-6H2,1-2H3
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n/an/a 11n/an/an/an/a7.525



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US Patent


Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294378
PNG
(US9586959, Compound 31)
Show SMILES CN1CCN(CC1)c1nc2ncc(Cl)cc2c2nc(C)nn12
Show InChI InChI=1S/C14H16ClN7/c1-9-17-13-11-7-10(15)8-16-12(11)18-14(22(13)19-9)21-5-3-20(2)4-6-21/h7-8H,3-6H2,1-2H3
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US Patent


Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294427
PNG
(US9586959, Compound disclosed in WO 2010030785, Ex...)
Show SMILES CN1CCN(CC1)c1nc2ccc(Cl)cc2n2cnnc12
Show InChI InChI=1S/C14H15ClN6/c1-19-4-6-20(7-5-19)13-14-18-16-9-21(14)12-8-10(15)2-3-11(12)17-13/h2-3,8-9H,4-7H2,1H3
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US Patent


Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294418
PNG
(US9586959, Compound 96)
Show SMILES CN1CCN(CC1)c1nc2ncc(Br)cc2n2nnnc12
Show InChI InChI=1S/C12H13BrN8/c1-19-2-4-20(5-3-19)11-12-16-17-18-21(12)9-6-8(13)7-14-10(9)15-11/h6-7H,2-5H2,1H3
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US Patent


Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294373
PNG
(US9586959, Compound 104 | US9586959, Compound 24 |...)
Show SMILES CNC1CN(C1)c1nc2ncc(Br)cc2n2cnnc12
Show InChI InChI=1S/C12H12BrN7/c1-14-8-4-19(5-8)11-12-18-16-6-20(12)9-2-7(13)3-15-10(9)17-11/h2-3,6,8,14H,4-5H2,1H3
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Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294386
PNG
(US9586959, Compound 49)
Show SMILES CN1CCN(CC1)c1nc2ncc(I)cc2n2cnnc12
Show InChI InChI=1S/C13H14IN7/c1-19-2-4-20(5-3-19)12-13-18-16-8-21(13)10-6-9(14)7-15-11(10)17-12/h6-8H,2-5H2,1H3
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US Patent


Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294407
PNG
(US9586959, Compound 69 | US9586959, Compound 95)
Show SMILES CNC1CN(C1)c1nc2ncc(Br)cc2n2nnnc12
Show InChI InChI=1S/C11H11BrN8/c1-13-7-4-19(5-7)10-11-16-17-18-20(11)8-2-6(12)3-14-9(8)15-10/h2-3,7,13H,4-5H2,1H3
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Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294373
PNG
(US9586959, Compound 104 | US9586959, Compound 24 |...)
Show SMILES CNC1CN(C1)c1nc2ncc(Br)cc2n2cnnc12
Show InChI InChI=1S/C12H12BrN7/c1-14-8-4-19(5-8)11-12-18-16-6-20(12)9-2-7(13)3-15-10(9)17-11/h2-3,6,8,14H,4-5H2,1H3
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US Patent


Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294361
PNG
(US9586959, Compound 4)
Show SMILES CN1CCN(CC1)c1nc2ncc(Cl)cc2n2cnnc12
Show InChI InChI=1S/C13H14ClN7/c1-19-2-4-20(5-3-19)12-13-18-16-8-21(13)10-6-9(14)7-15-11(10)17-12/h6-8H,2-5H2,1H3
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Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294414
PNG
(US9586959, Compound 92)
Show SMILES CN1CCN(CC1)C1=Nc2ncc(Cl)cc2C2OC(C)=NC12
Show InChI InChI=1S/C15H18ClN5O/c1-9-18-12-13(22-9)11-7-10(16)8-17-14(11)19-15(12)21-5-3-20(2)4-6-21/h7-8,12-13H,3-6H2,1-2H3
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Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294407
PNG
(US9586959, Compound 69 | US9586959, Compound 95)
Show SMILES CNC1CN(C1)c1nc2ncc(Br)cc2n2nnnc12
Show InChI InChI=1S/C11H11BrN8/c1-13-7-4-19(5-7)10-11-16-17-18-20(11)8-2-6(12)3-14-9(8)15-10/h2-3,7,13H,4-5H2,1H3
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Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294377
PNG
(US9586959, Compound 29)
Show SMILES Clc1cnc2nc(N3CCN4CCCC4C3)c3nncn3c2c1
Show InChI InChI=1S/C15H16ClN7/c16-10-6-12-13(17-7-10)19-14(15-20-18-9-23(12)15)22-5-4-21-3-1-2-11(21)8-22/h6-7,9,11H,1-5,8H2
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US Patent


Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294368
PNG
(US9586959, Compound 18)
Show SMILES CNC1CN(C1)c1nc2ncc(Cl)cc2n2cnnc12
Show InChI InChI=1S/C12H12ClN7/c1-14-8-4-19(5-8)11-12-18-16-6-20(12)9-2-7(13)3-15-10(9)17-11/h2-3,6,8,14H,4-5H2,1H3
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Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294408
PNG
(US9586959, Compound 74)
Show SMILES Brc1cnc2nc(N3CCN4CCCC4C3)c3nncn3c2c1
Show InChI InChI=1S/C15H16BrN7/c16-10-6-12-13(17-7-10)19-14(15-20-18-9-23(12)15)22-5-4-21-3-1-2-11(21)8-22/h6-7,9,11H,1-5,8H2
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Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294416
PNG
(US9586959, Compound 94)
Show SMILES CN1CCN(CC1)c1nc2ncc(Cl)cc2n2nnnc12
Show InChI InChI=1S/C12H13ClN8/c1-19-2-4-20(5-3-19)11-12-16-17-18-21(12)9-6-8(13)7-14-10(9)15-11/h6-7H,2-5H2,1H3
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Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294409
PNG
(US9586959, Compound 75)
Show SMILES Ic1cnc2nc(N3CCN4CCCC4C3)c3nncn3c2c1
Show InChI InChI=1S/C15H16IN7/c16-10-6-12-13(17-7-10)19-14(15-20-18-9-23(12)15)22-5-4-21-3-1-2-11(21)8-22/h6-7,9,11H,1-5,8H2
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Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294415
PNG
(US9586959, Compound 93)
Show SMILES CNC1CN(C1)c1nc2ncc(Cl)cc2n2nnnc12
Show InChI InChI=1S/C11H11ClN8/c1-13-7-4-19(5-7)10-11-16-17-18-20(11)8-2-6(12)3-14-9(8)15-10/h2-3,7,13H,4-5H2,1H3
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Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294385
PNG
(US9586959, Compound 48)
Show SMILES CNC1CN(C1)c1nc2ncc(I)cc2n2cnnc12
Show InChI InChI=1S/C12H12IN7/c1-14-8-4-19(5-8)11-12-18-16-6-20(12)9-2-7(13)3-15-10(9)17-11/h2-3,6,8,14H,4-5H2,1H3
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Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294366
PNG
(US9586959, Compound 16)
Show SMILES Brc1cnc2nc(N3CCNCC3)c3nncn3c2c1
Show InChI InChI=1S/C12H12BrN7/c13-8-5-9-10(15-6-8)17-11(12-18-16-7-20(9)12)19-3-1-14-2-4-19/h5-7,14H,1-4H2
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Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294364
PNG
(US9586959, Compound 12)
Show SMILES CN1CCN(CC1)c1nc2ncc(Br)cc2n2cnnc12
Show InChI InChI=1S/C13H14BrN7/c1-19-2-4-20(5-3-19)12-13-18-16-8-21(13)10-6-9(14)7-15-11(10)17-12/h6-8H,2-5H2,1H3
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Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294382
PNG
(US9586959, Compound 43)
Show SMILES CN1CCN(CC1)c1nc2ncc(Cl)cc2c2cn(C)nc12
Show InChI InChI=1S/C15H17ClN6/c1-20-3-5-22(6-4-20)15-13-12(9-21(2)19-13)11-7-10(16)8-17-14(11)18-15/h7-9H,3-6H2,1-2H3
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Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294379
PNG
(US9586959, Compound 32)
Show SMILES Cc1nc2c3cc(Cl)cnc3nc(N3CCNCC3)n2n1
Show InChI InChI=1S/C13H14ClN7/c1-8-17-12-10-6-9(14)7-16-11(10)18-13(21(12)19-8)20-4-2-15-3-5-20/h6-7,15H,2-5H2,1H3
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Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294374
PNG
(US9586959, Compound 25)
Show SMILES CNC1CN(C1)c1nc2ncc(cc2n2cnnc12)[N+]#[C-]
Show InChI InChI=1S/C13H12N8/c1-14-8-3-10-11(16-4-8)18-12(13-19-17-7-21(10)13)20-5-9(6-20)15-2/h3-4,7,9,15H,5-6H2,2H3
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Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294373
PNG
(US9586959, Compound 104 | US9586959, Compound 24 |...)
Show SMILES CNC1CN(C1)c1nc2ncc(Br)cc2n2cnnc12
Show InChI InChI=1S/C12H12BrN7/c1-14-8-4-19(5-8)11-12-18-16-6-20(12)9-2-7(13)3-15-10(9)17-11/h2-3,6,8,14H,4-5H2,1H3
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US Patent


Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294381
PNG
(US9586959, Compound 39)
Show SMILES Clc1cnc2nc(N3CCNCC3)n3nc(nc3c2c1)C1CC1
Show InChI InChI=1S/C15H16ClN7/c16-10-7-11-13(18-8-10)20-15(22-5-3-17-4-6-22)23-14(11)19-12(21-23)9-1-2-9/h7-9,17H,1-6H2
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Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294362
PNG
(US9586959, Compound 7)
Show SMILES Clc1cnc2nc(N3CCNCC3)c3nncn3c2c1
Show InChI InChI=1S/C12H12ClN7/c13-8-5-9-10(15-6-8)17-11(12-18-16-7-20(9)12)19-3-1-14-2-4-19/h5-7,14H,1-4H2
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US Patent


Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294372
PNG
(US9586959, Compound 23)
Show SMILES CCOc1nc2nc(N3CCN(C)CC3)c3nncn3c2cc1Cl
Show InChI InChI=1S/C15H18ClN7O/c1-3-24-15-10(16)8-11-12(19-15)18-13(14-20-17-9-23(11)14)22-6-4-21(2)5-7-22/h8-9H,3-7H2,1-2H3
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US Patent


Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294383
PNG
(US9586959, Compound 46)
Show SMILES CN1CCN(CC1)c1nc2ncc(Cl)cc2n2ccnc12
Show InChI InChI=1S/C14H15ClN6/c1-19-4-6-20(7-5-19)14-13-16-2-3-21(13)11-8-10(15)9-17-12(11)18-14/h2-3,8-9H,4-7H2,1H3
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US Patent


Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294423
PNG
(US9586959, Compound 110)
Show SMILES CNC1CN(C1)c1nc2ncc(Br)cc2c2ccnn12
Show InChI InChI=1S/C13H13BrN6/c1-15-9-6-19(7-9)13-18-12-10(4-8(14)5-16-12)11-2-3-17-20(11)13/h2-5,9,15H,6-7H2,1H3
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US Patent


Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294380
PNG
(US9586959, Compound 35)
Show SMILES CN1CCN(CC1)c1nc2ncc(Cl)cc2c2ncnn12
Show InChI InChI=1S/C13H14ClN7/c1-19-2-4-20(5-3-19)13-18-11-10(6-9(14)7-15-11)12-16-8-17-21(12)13/h6-8H,2-5H2,1H3
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US Patent


Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294367
PNG
(US9586959, Compound 17)
Show SMILES CN1CCN(CC1)c1nc2nc(Cl)c(Cl)cc2n2cnnc12
Show InChI InChI=1S/C13H13Cl2N7/c1-20-2-4-21(5-3-20)12-13-19-16-7-22(13)9-6-8(14)10(15)17-11(9)18-12/h6-7H,2-5H2,1H3
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US Patent


Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294387
PNG
(US9586959, Compound 50)
Show SMILES CNC1CN(C1)c1nc2ncc(C)cc2n2cnnc12
Show InChI InChI=1S/C13H15N7/c1-8-3-10-11(15-4-8)17-12(13-18-16-7-20(10)13)19-5-9(6-19)14-2/h3-4,7,9,14H,5-6H2,1-2H3
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US Patent


Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294391
PNG
(US9586959, Compound 54)
Show SMILES CNC1CN(C1)c1nc2ncc(cc2n2cnnc12)C#C
Show InChI InChI=1S/C14H13N7/c1-3-9-4-11-12(16-5-9)18-13(14-19-17-8-21(11)14)20-6-10(7-20)15-2/h1,4-5,8,10,15H,6-7H2,2H3
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Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294393
PNG
(US9586959, Compound 58)
Show SMILES CNC1CN(C1)c1nc2ncc(OC)cc2n2cnnc12
Show InChI InChI=1S/C13H15N7O/c1-14-8-5-19(6-8)12-13-18-16-7-20(13)10-3-9(21-2)4-15-11(10)17-12/h3-4,7-8,14H,5-6H2,1-2H3
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Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294426
PNG
(US9586959, Compound 117)
Show SMILES CNC1CN(C1)c1nc2cnc(Cl)cc2n2cnnc12
Show InChI InChI=1S/C12H12ClN7/c1-14-7-4-19(5-7)11-12-18-16-6-20(12)9-2-10(13)15-3-8(9)17-11/h2-3,6-7,14H,4-5H2,1H3
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Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294389
PNG
(US9586959, Compound 52)
Show SMILES NC1CN(C1)c1nc2ncc(cc2n2cnnc12)C(F)(F)F
Show InChI InChI=1S/C12H10F3N7/c13-12(14,15)6-1-8-9(17-2-6)19-10(21-3-7(16)4-21)11-20-18-5-22(8)11/h1-2,5,7H,3-4,16H2
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Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294375
PNG
(US9586959, Compound 26)
Show SMILES [C-]#[N+]c1cnc2nc(N3CCNCC3)c3nncn3c2c1
Show InChI InChI=1S/C13H12N8/c1-14-9-6-10-11(16-7-9)18-12(13-19-17-8-21(10)13)20-4-2-15-3-5-20/h6-8,15H,2-5H2
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Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294420
PNG
(US9586959, Compound 100)
Show SMILES CN1CCN(CC1)c1nc2nc(C)c(Br)cc2n2cnnc12
Show InChI InChI=1S/C14H16BrN7/c1-9-10(15)7-11-12(17-9)18-13(14-19-16-8-22(11)14)21-5-3-20(2)4-6-21/h7-8H,3-6H2,1-2H3
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Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294365
PNG
(US9586959, Compound 13)
Show SMILES CN1CCN(CC1)c1nc2ncc(cc2n2cnnc12)[N+]#[C-]
Show InChI InChI=1S/C14H14N8/c1-15-10-7-11-12(16-8-10)18-13(14-19-17-9-22(11)14)21-5-3-20(2)4-6-21/h7-9H,3-6H2,2H3
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Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294398
PNG
(US9586959, Compound 64)
Show SMILES CN1CCN(CC1)c1nc2nc(OCC(F)(F)F)c(Cl)cc2n2cnnc12
Show InChI InChI=1S/C15H15ClF3N7O/c1-24-2-4-25(5-3-24)12-13-23-20-8-26(13)10-6-9(16)14(22-11(10)21-12)27-7-15(17,18)19/h6,8H,2-5,7H2,1H3
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Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294425
PNG
(US9586959, Compound 116)
Show SMILES CNC1CN(C1)c1nc2ccc(Cl)nc2n2cnnc12
Show InChI InChI=1S/C12H12ClN7/c1-14-7-4-19(5-7)11-12-18-15-6-20(12)10-8(16-11)2-3-9(13)17-10/h2-3,6-7,14H,4-5H2,1H3
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Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294424
PNG
(US9586959, Compound 111)
Show SMILES CNC1CN(C1)c1nc2ncc(cc2n2cnnc12)[N+]([O-])=O
Show InChI InChI=1S/C12H12N8O2/c1-13-7-4-18(5-7)11-12-17-15-6-19(12)9-2-8(20(21)22)3-14-10(9)16-11/h2-3,6-7,13H,4-5H2,1H3
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Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294412
PNG
(US9586959, Compound 88)
Show SMILES CNC1CN(C1)c1nc2ncc(Cl)cc2n2ccnc12
Show InChI InChI=1S/C13H13ClN6/c1-15-9-6-19(7-9)13-12-16-2-3-20(12)10-4-8(14)5-17-11(10)18-13/h2-5,9,15H,6-7H2,1H3
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Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294392
PNG
(US9586959, Compound 55)
Show SMILES CNC1CN(C1)c1nc2ncc(C=C)cc2n2cnnc12
Show InChI InChI=1S/C14H15N7/c1-3-9-4-11-12(16-5-9)18-13(14-19-17-8-21(11)14)20-6-10(7-20)15-2/h3-5,8,10,15H,1,6-7H2,2H3
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Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294371
PNG
(US9586959, Compound 21)
Show SMILES CN1CCN(CC1)c1nc2nc([N+]#[C-])c(Cl)cc2n2cnnc12
Show InChI InChI=1S/C14H13ClN8/c1-16-11-9(15)7-10-12(18-11)19-13(14-20-17-8-23(10)14)22-5-3-21(2)4-6-22/h7-8H,3-6H2,2H3
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Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294390
PNG
(US9586959, Compound 53)
Show SMILES CN1CCN(CC1)c1nc2ncc(cc2n2cnnc12)C(F)(F)F
Show InChI InChI=1S/C14H14F3N7/c1-22-2-4-23(5-3-22)12-13-21-19-8-24(13)10-6-9(14(15,16)17)7-18-11(10)20-12/h6-8H,2-5H2,1H3
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Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294401
PNG
(US9586959, Compound 66)
Show SMILES CN1CCN(CC1)c1nc2ncc(Br)c(C)c2n2cnnc12
Show InChI InChI=1S/C14H16BrN7/c1-9-10(15)7-16-12-11(9)22-8-17-19-14(22)13(18-12)21-5-3-20(2)4-6-21/h7-8H,3-6H2,1-2H3
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Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294405
PNG
(US9586959, Compound 67)
Show SMILES CNC1CN(C1)c1nc2ncc(Cl)c(Cl)c2n2cnnc12
Show InChI InChI=1S/C12H11Cl2N7/c1-15-6-3-20(4-6)11-12-19-17-5-21(12)9-8(14)7(13)2-16-10(9)18-11/h2,5-6,15H,3-4H2,1H3
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Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294413
PNG
(US9586959, Compound 89)
Show SMILES CNC1CN(C1)c1nc2ncc(Br)cc2n2ccnc12
Show InChI InChI=1S/C13H13BrN6/c1-15-9-6-19(7-9)13-12-16-2-3-20(12)10-4-8(14)5-17-11(10)18-13/h2-5,9,15H,6-7H2,1H3
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Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294370
PNG
(US9586959, Compound 20)
Show SMILES C[C@H]1CN(CCN1C)c1nc2ncc(Cl)cc2n2cnnc12
Show InChI InChI=1S/C14H16ClN7/c1-9-7-21(4-3-20(9)2)13-14-19-17-8-22(14)11-5-10(15)6-16-12(11)18-13/h5-6,8-9H,3-4,7H2,1-2H3/t9-/m0/s1
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Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294411
PNG
(US9586959, Compound 78)
Show SMILES CN1C[C@@H]2C[C@H]1CN2c1nc2ncc(Cl)cc2n2cnnc12
Show InChI InChI=1S/C14H14ClN7/c1-20-5-10-3-9(20)6-21(10)13-14-19-17-7-22(14)11-2-8(15)4-16-12(11)18-13/h2,4,7,9-10H,3,5-6H2,1H3/t9-,10-/m0/s1
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Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294376
PNG
(US9586959, Compound 28)
Show SMILES CNC1CN(C1)c1nc2nc([N+]#[C-])c(Cl)cc2n2cnnc12
Show InChI InChI=1S/C13H11ClN8/c1-15-7-4-21(5-7)12-13-20-17-6-22(13)9-3-8(14)10(16-2)18-11(9)19-12/h3,6-7,15H,4-5H2,1H3
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US Patent


Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294410
PNG
(US9586959, Compound 77)
Show SMILES Clc1cnc2nc(N3C[C@@H]4C[C@H]3CN4)c3nncn3c2c1
Show InChI InChI=1S/C13H12ClN7/c14-7-1-10-11(16-3-7)18-12(13-19-17-6-21(10)13)20-5-8-2-9(20)4-15-8/h1,3,6,8-9,15H,2,4-5H2/t8-,9-/m0/s1
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n/an/a 490n/an/an/an/a7.525



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US Patent


Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294360
PNG
(US9586959, Compound 2)
Show SMILES CN1CCN(CC1)c1nc2ncc(C)cc2n2cnnc12
Show InChI InChI=1S/C14H17N7/c1-10-7-11-12(15-8-10)17-13(14-18-16-9-21(11)14)20-5-3-19(2)4-6-20/h7-9H,3-6H2,1-2H3
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n/an/a 506n/an/an/an/a7.525



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US Patent


Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294396
PNG
(US9586959, Compound 62)
Show SMILES Clc1cc2c(nc1Cl)nc(N1CCNCC1)c1nncn21
Show InChI InChI=1S/C12H11Cl2N7/c13-7-5-8-10(17-9(7)14)18-11(12-19-16-6-21(8)12)20-3-1-15-2-4-20/h5-6,15H,1-4H2
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n/an/a 510n/an/an/an/a7.525



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US Patent


Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294397
PNG
(US9586959, Compound 63)
Show SMILES CCOc1nc2nc(N3CCNCC3)c3nncn3c2cc1Cl
Show InChI InChI=1S/C14H16ClN7O/c1-2-23-14-9(15)7-10-11(19-14)18-12(13-20-17-8-22(10)13)21-5-3-16-4-6-21/h7-8,16H,2-6H2,1H3
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US Patent


Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294395
PNG
(US9586959, Compound 60)
Show SMILES COc1nc2nc(N3CCN(C)CC3)c3nncn3c2cc1Cl
Show InChI InChI=1S/C14H16ClN7O/c1-20-3-5-21(6-4-20)12-13-19-16-8-22(13)10-7-9(15)14(23-2)18-11(10)17-12/h7-8H,3-6H2,1-2H3
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n/an/a 610n/an/an/an/a7.525



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US Patent


Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294384
PNG
(US9586959, Compound 47)
Show SMILES Clc1cnc2nc(N3CCNCC3)c3nccn3c2c1
Show InChI InChI=1S/C13H13ClN6/c14-9-7-10-11(17-8-9)18-13(12-16-3-6-20(10)12)19-4-1-15-2-5-19/h3,6-8,15H,1-2,4-5H2
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n/an/a 618n/an/an/an/a7.525



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US Patent


Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294422
PNG
(US9586959, Compound 107)
Show SMILES CNC1CN(C1)C1=Nc2ncc(Br)cc2N2CCN=C12
Show InChI InChI=1S/C13H15BrN6/c1-15-9-6-19(7-9)13-12-16-2-3-20(12)10-4-8(14)5-17-11(10)18-13/h4-5,9,15H,2-3,6-7H2,1H3
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US Patent


Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294388
PNG
(US9586959, Compound 51)
Show SMILES CNC1CN(C1)c1nc2ncc(cc2n2cnnc12)C(F)F
Show InChI InChI=1S/C13H13F2N7/c1-16-8-4-21(5-8)12-13-20-18-6-22(13)9-2-7(10(14)15)3-17-11(9)19-12/h2-3,6,8,10,16H,4-5H2,1H3
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US Patent


Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294400
PNG
(US9586959, Compound 65)
Show SMILES CNC1CN(C1)c1nc2ncc(Br)c(C)c2n2cnnc12
Show InChI InChI=1S/C13H14BrN7/c1-7-9(14)3-16-11-10(7)21-6-17-19-13(21)12(18-11)20-4-8(5-20)15-2/h3,6,8,15H,4-5H2,1-2H3
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US Patent


Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294369
PNG
(US9586959, Compound 19)
Show SMILES C[C@H]1CN(CCN1)c1nc2ncc(Cl)cc2n2cnnc12
Show InChI InChI=1S/C13H14ClN7/c1-8-6-20(3-2-15-8)12-13-19-17-7-21(13)10-4-9(14)5-16-11(10)18-12/h4-5,7-8,15H,2-3,6H2,1H3/t8-/m0/s1
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Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM294394
PNG
(US9586959, Compound 59)
Show SMILES CNC1CN(C1)c1nc2ncc(OC(F)F)cc2n2cnnc12
Show InChI InChI=1S/C13H13F2N7O/c1-16-7-4-21(5-7)11-12-20-18-6-22(12)9-2-8(23-13(14)15)3-17-10(9)19-11/h2-3,6-7,13,16H,4-5H2,1H3
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US Patent


Assay Description
In vitro profiling protein kinases was performed using the HotSpot assay platform. Briefly, specific kinase/substrate pairs along with required cofac...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A


(Homo sapiens (Human))
BDBM294368
PNG
(US9586959, Compound 18)
Show SMILES CNC1CN(C1)c1nc2ncc(Cl)cc2n2cnnc12
Show InChI InChI=1S/C12H12ClN7/c1-14-8-4-19(5-8)11-12-18-16-6-20(12)9-2-7(13)3-15-10(9)17-11/h2-3,6,8,14H,4-5H2,1H3
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n/an/a 2.90E+3n/an/an/an/an/an/a



C&C RESEARCH LABORATORIES

US Patent


Assay Description
The binding assays of the human serotonin 3 receptor for present invention were performed at Cerep (Poitiers, France).


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294427
PNG
(US9586959, Compound disclosed in WO 2010030785, Ex...)
Show SMILES CN1CCN(CC1)c1nc2ccc(Cl)cc2n2cnnc12
Show InChI InChI=1S/C14H15ClN6/c1-19-4-6-20(7-5-19)13-14-18-16-9-21(14)12-8-10(15)2-3-11(12)17-13/h2-3,8-9H,4-7H2,1H3
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n/an/a 9.00E+3n/an/an/an/a7.427



C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A


(Homo sapiens (Human))
BDBM294373
PNG
(US9586959, Compound 104 | US9586959, Compound 24 |...)
Show SMILES CNC1CN(C1)c1nc2ncc(Br)cc2n2cnnc12
Show InChI InChI=1S/C12H12BrN7/c1-14-8-4-19(5-8)11-12-18-16-6-20(12)9-2-7(13)3-15-10(9)17-11/h2-3,6,8,14H,4-5H2,1H3
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n/an/a 9.10E+3n/an/an/an/an/an/a



C&C RESEARCH LABORATORIES

US Patent


Assay Description
The binding assays of the human serotonin 3 receptor for present invention were performed at Cerep (Poitiers, France).


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294466
PNG
(US9586959, Compound 97)
Show SMILES CNC1CN(C1)c1nc2ncc(Cl)cc2n2nc(C)nc12
Show InChI InChI=1S/C13H14ClN7/c1-7-17-13-12(20-5-9(6-20)15-2)18-11-10(21(13)19-7)3-8(14)4-16-11/h3-4,9,15H,5-6H2,1-2H3
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n/an/a 8.70E+4n/an/an/an/a7.427



C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294361
PNG
(US9586959, Compound 4)
Show SMILES CN1CCN(CC1)c1nc2ncc(Cl)cc2n2cnnc12
Show InChI InChI=1S/C13H14ClN7/c1-19-2-4-20(5-3-19)12-13-18-16-8-21(13)10-6-9(14)7-15-11(10)17-12/h6-8H,2-5H2,1H3
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n/an/a 9.00E+4n/an/an/an/a7.427



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US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294382
PNG
(US9586959, Compound 43)
Show SMILES CN1CCN(CC1)c1nc2ncc(Cl)cc2c2cn(C)nc12
Show InChI InChI=1S/C15H17ClN6/c1-20-3-5-22(6-4-20)15-13-12(9-21(2)19-13)11-7-10(16)8-17-14(11)18-15/h7-9H,3-6H2,1-2H3
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n/an/a 9.70E+4n/an/an/an/a7.427



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US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A


(Homo sapiens (Human))
BDBM294407
PNG
(US9586959, Compound 69 | US9586959, Compound 95)
Show SMILES CNC1CN(C1)c1nc2ncc(Br)cc2n2nnnc12
Show InChI InChI=1S/C11H11BrN8/c1-13-7-4-19(5-7)10-11-16-17-18-20(11)8-2-6(12)3-14-9(8)15-10/h2-3,7,13H,4-5H2,1H3
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n/an/a>1.00E+7n/an/an/an/an/an/a



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US Patent


Assay Description
The binding assays of the human serotonin 3 receptor for present invention were performed at Cerep (Poitiers, France).


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A


(Homo sapiens (Human))
BDBM294374
PNG
(US9586959, Compound 25)
Show SMILES CNC1CN(C1)c1nc2ncc(cc2n2cnnc12)[N+]#[C-]
Show InChI InChI=1S/C13H12N8/c1-14-8-3-10-11(16-4-8)18-12(13-19-17-7-21(10)13)20-5-9(6-20)15-2/h3-4,7,9,15H,5-6H2,2H3
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C&C RESEARCH LABORATORIES

US Patent


Assay Description
The binding assays of the human serotonin 3 receptor for present invention were performed at Cerep (Poitiers, France).


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A


(Homo sapiens (Human))
BDBM294415
PNG
(US9586959, Compound 93)
Show SMILES CNC1CN(C1)c1nc2ncc(Cl)cc2n2nnnc12
Show InChI InChI=1S/C11H11ClN8/c1-13-7-4-19(5-7)10-11-16-17-18-20(11)8-2-6(12)3-14-9(8)15-10/h2-3,7,13H,4-5H2,1H3
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US Patent


Assay Description
The binding assays of the human serotonin 3 receptor for present invention were performed at Cerep (Poitiers, France).


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A


(Homo sapiens (Human))
BDBM294385
PNG
(US9586959, Compound 48)
Show SMILES CNC1CN(C1)c1nc2ncc(I)cc2n2cnnc12
Show InChI InChI=1S/C12H12IN7/c1-14-8-4-19(5-8)11-12-18-16-6-20(12)9-2-7(13)3-15-10(9)17-11/h2-3,6,8,14H,4-5H2,1H3
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US Patent


Assay Description
The binding assays of the human serotonin 3 receptor for present invention were performed at Cerep (Poitiers, France).


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294387
PNG
(US9586959, Compound 50)
Show SMILES CNC1CN(C1)c1nc2ncc(C)cc2n2cnnc12
Show InChI InChI=1S/C13H15N7/c1-8-3-10-11(15-4-8)17-12(13-18-16-7-20(10)13)19-5-9(6-19)14-2/h3-4,7,9,14H,5-6H2,1-2H3
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US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294396
PNG
(US9586959, Compound 62)
Show SMILES Clc1cc2c(nc1Cl)nc(N1CCNCC1)c1nncn21
Show InChI InChI=1S/C12H11Cl2N7/c13-7-5-8-10(17-9(7)14)18-11(12-19-16-6-21(8)12)20-3-1-15-2-4-20/h5-6,15H,1-4H2
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US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294407
PNG
(US9586959, Compound 69 | US9586959, Compound 95)
Show SMILES CNC1CN(C1)c1nc2ncc(Br)cc2n2nnnc12
Show InChI InChI=1S/C11H11BrN8/c1-13-7-4-19(5-7)10-11-16-17-18-20(11)8-2-6(12)3-14-9(8)15-10/h2-3,7,13H,4-5H2,1H3
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US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294457
PNG
(US9586959, Compound 79)
Show SMILES Clc1cnc2nc(N3CCCNCC3)c3nncn3c2c1
Show InChI InChI=1S/C13H14ClN7/c14-9-6-10-11(16-7-9)18-12(13-19-17-8-21(10)13)20-4-1-2-15-3-5-20/h6-8,15H,1-5H2
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US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294461
PNG
(US9586959, Compound 84)
Show SMILES CN(C)C1CN(C1)c1nc2ncc(Cl)cc2n2cnnc12
Show InChI InChI=1S/C13H14ClN7/c1-19(2)9-5-20(6-9)12-13-18-16-7-21(13)10-3-8(14)4-15-11(10)17-12/h3-4,7,9H,5-6H2,1-2H3
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n/an/a>1.00E+8n/an/an/an/a7.427



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US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294471
PNG
(US9586959, Compound 106)
Show SMILES CNC1CN(C1)C1=Nc2ncc(Br)cc2N2C[C@@H](C)N=C12
Show InChI InChI=1S/C14H17BrN6/c1-8-5-21-11-3-9(15)4-17-12(11)19-13(14(21)18-8)20-6-10(7-20)16-2/h3-4,8,10,16H,5-7H2,1-2H3/t8-/m1/s1
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US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294473
PNG
(US9586959, Compound 109)
Show SMILES CNC1CN(C1)c1nc2ncc(Br)cc2c2cc(C)nn12
Show InChI InChI=1S/C14H15BrN6/c1-8-3-12-11-4-9(15)5-17-13(11)18-14(21(12)19-8)20-6-10(7-20)16-2/h3-5,10,16H,6-7H2,1-2H3
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US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294362
PNG
(US9586959, Compound 7)
Show SMILES Clc1cnc2nc(N3CCNCC3)c3nncn3c2c1
Show InChI InChI=1S/C12H12ClN7/c13-8-5-9-10(15-6-8)17-11(12-18-16-7-20(9)12)19-3-1-14-2-4-19/h5-7,14H,1-4H2
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US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294433
PNG
(US9586959, Compound 9)
Show SMILES CN(C)[C@@H]1CCN(C1)c1nc2ncc(Cl)cc2n2cnnc12
Show InChI InChI=1S/C14H16ClN7/c1-20(2)10-3-4-21(7-10)13-14-19-17-8-22(14)11-5-9(15)6-16-12(11)18-13/h5-6,8,10H,3-4,7H2,1-2H3/t10-/m1/s1
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US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294434
PNG
(US9586959, Compound 10)
Show SMILES CN[C@@H]1CCN(C1)c1nc2ncc(Cl)cc2n2cnnc12
Show InChI InChI=1S/C13H14ClN7/c1-15-9-2-3-20(6-9)12-13-19-17-7-21(13)10-4-8(14)5-16-11(10)18-12/h4-5,7,9,15H,2-3,6H2,1H3/t9-/m1/s1
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US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294435
PNG
(US9586959, Compound 11)
Show SMILES CN[C@@H]1CCN(C1)c1nc2cc(Cl)cnc2n2cnnc12
Show InChI InChI=1S/C13H14ClN7/c1-15-9-2-3-20(6-9)12-13-19-17-7-21(13)11-10(18-12)4-8(14)5-16-11/h4-5,7,9,15H,2-3,6H2,1H3/t9-/m1/s1
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US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294374
PNG
(US9586959, Compound 25)
Show SMILES CNC1CN(C1)c1nc2ncc(cc2n2cnnc12)[N+]#[C-]
Show InChI InChI=1S/C13H12N8/c1-14-8-3-10-11(16-4-8)18-12(13-19-17-7-21(10)13)20-5-9(6-20)15-2/h3-4,7,9,15H,5-6H2,2H3
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US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294441
PNG
(US9586959, Compound 33)
Show SMILES CNC1CN(C1)c1nc2ncc(Cl)cc2c2nc(C)nn12
Show InChI InChI=1S/C13H14ClN7/c1-7-17-12-10-3-8(14)4-16-11(10)18-13(21(12)19-7)20-5-9(6-20)15-2/h3-4,9,15H,5-6H2,1-2H3
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US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294443
PNG
(US9586959, Compound 37)
Show SMILES Clc1cnc2nc(N3CCNCC3)n3ncnc3c2c1
Show InChI InChI=1S/C12H12ClN7/c13-8-5-9-10(15-6-8)18-12(19-3-1-14-2-4-19)20-11(9)16-7-17-20/h5-7,14H,1-4H2
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US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294444
PNG
(US9586959, Compound 38)
Show SMILES CN1CCN(CC1)c1nc2ncc(Cl)cc2c2nc(nn12)C1CC1
Show InChI InChI=1S/C16H18ClN7/c1-22-4-6-23(7-5-22)16-20-14-12(8-11(17)9-18-14)15-19-13(10-2-3-10)21-24(15)16/h8-10H,2-7H2,1H3
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US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294445
PNG
(US9586959, Compound 40)
Show SMILES COCc1nc2c3cc(Cl)cnc3nc(N3CCN(C)CC3)n2n1
Show InChI InChI=1S/C15H18ClN7O/c1-21-3-5-22(6-4-21)15-19-13-11(7-10(16)8-17-13)14-18-12(9-24-2)20-23(14)15/h7-8H,3-6,9H2,1-2H3
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US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294446
PNG
(US9586959, Compound 41)
Show SMILES CCc1nc2c3cc(Cl)cnc3nc(N3CCN(C)CC3)n2n1
Show InChI InChI=1S/C15H18ClN7/c1-3-12-18-14-11-8-10(16)9-17-13(11)19-15(23(14)20-12)22-6-4-21(2)5-7-22/h8-9H,3-7H2,1-2H3
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C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294392
PNG
(US9586959, Compound 55)
Show SMILES CNC1CN(C1)c1nc2ncc(C=C)cc2n2cnnc12
Show InChI InChI=1S/C14H15N7/c1-3-9-4-11-12(16-5-9)18-13(14-19-17-8-21(11)14)20-6-10(7-20)15-2/h3-5,8,10,15H,1,6-7H2,2H3
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C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294451
PNG
(US9586959, Compound 61)
Show SMILES COc1nc2nc(N3CCNCC3)c3nncn3c2cc1Cl
Show InChI InChI=1S/C13H14ClN7O/c1-22-13-8(14)6-9-10(18-13)17-11(12-19-16-7-21(9)12)20-4-2-15-3-5-20/h6-7,15H,2-5H2,1H3
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US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294452
PNG
(US9586959, Compound 70)
Show SMILES CN1CC2CN(CC2C1)c1nc2ncc(Cl)cc2n2cnnc12
Show InChI InChI=1S/C15H16ClN7/c1-21-4-9-6-22(7-10(9)5-21)14-15-20-18-8-23(15)12-2-11(16)3-17-13(12)19-14/h2-3,8-10H,4-7H2,1H3
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C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294468
PNG
(US9586959, Compound 101)
Show SMILES CNC1CN(C1)c1nc2nc(O)c(Cl)cc2n2cnnc12
Show InChI InChI=1S/C12H12ClN7O/c1-14-6-3-19(4-6)10-11-18-15-5-20(11)8-2-7(13)12(21)17-9(8)16-10/h2,5-6,14H,3-4H2,1H3,(H,17,21)
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C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294422
PNG
(US9586959, Compound 107)
Show SMILES CNC1CN(C1)C1=Nc2ncc(Br)cc2N2CCN=C12
Show InChI InChI=1S/C13H15BrN6/c1-15-9-6-19(7-9)13-12-16-2-3-20(12)10-4-8(14)5-17-11(10)18-13/h4-5,9,15H,2-3,6-7H2,1H3
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US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294476
PNG
(US9586959, Compound 114)
Show SMILES CNC1CN(C1)c1nc2ncc(cc2n2cnnc12)-c1ccco1
Show InChI InChI=1S/C16H15N7O/c1-17-11-7-22(8-11)15-16-21-19-9-23(16)12-5-10(6-18-14(12)20-15)13-3-2-4-24-13/h2-6,9,11,17H,7-8H2,1H3
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C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294426
PNG
(US9586959, Compound 117)
Show SMILES CNC1CN(C1)c1nc2cnc(Cl)cc2n2cnnc12
Show InChI InChI=1S/C12H12ClN7/c1-14-7-4-19(5-7)11-12-18-16-6-20(12)9-2-10(13)15-3-8(9)17-11/h2-3,6-7,14H,4-5H2,1H3
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C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294376
PNG
(US9586959, Compound 28)
Show SMILES CNC1CN(C1)c1nc2nc([N+]#[C-])c(Cl)cc2n2cnnc12
Show InChI InChI=1S/C13H11ClN8/c1-15-7-4-21(5-7)12-13-20-17-6-22(13)9-3-8(14)10(16-2)18-11(9)19-12/h3,6-7,15H,4-5H2,1H3
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C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294379
PNG
(US9586959, Compound 32)
Show SMILES Cc1nc2c3cc(Cl)cnc3nc(N3CCNCC3)n2n1
Show InChI InChI=1S/C13H14ClN7/c1-8-17-12-10-6-9(14)7-16-11(10)18-13(21(12)19-8)20-4-2-15-3-5-20/h6-7,15H,2-5H2,1H3
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C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294405
PNG
(US9586959, Compound 67)
Show SMILES CNC1CN(C1)c1nc2ncc(Cl)c(Cl)c2n2cnnc12
Show InChI InChI=1S/C12H11Cl2N7/c1-15-6-3-20(4-6)11-12-19-17-5-21(12)9-8(14)7(13)2-16-10(9)18-11/h2,5-6,15H,3-4H2,1H3
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US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294373
PNG
(US9586959, Compound 104 | US9586959, Compound 24 |...)
Show SMILES CNC1CN(C1)c1nc2ncc(Br)cc2n2cnnc12
Show InChI InChI=1S/C12H12BrN7/c1-14-8-4-19(5-8)11-12-18-16-6-20(12)9-2-7(13)3-15-10(9)17-11/h2-3,6,8,14H,4-5H2,1H3
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US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294410
PNG
(US9586959, Compound 77)
Show SMILES Clc1cnc2nc(N3C[C@@H]4C[C@H]3CN4)c3nncn3c2c1
Show InChI InChI=1S/C13H12ClN7/c14-7-1-10-11(16-3-7)18-12(13-19-17-6-21(10)13)20-5-8-2-9(20)4-15-8/h1,3,6,8-9,15H,2,4-5H2/t8-,9-/m0/s1
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n/an/a>1.00E+8n/an/an/an/a7.427



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US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294464
PNG
(US9586959, Compound 90)
Show SMILES CN(C1CN(C1)c1nc2ncc(Cl)cc2c2oc(C)nc12)C(=O)OC(C)(C)C
Show InChI InChI=1S/C19H22ClN5O3/c1-10-22-14-15(27-10)13-6-11(20)7-21-16(13)23-17(14)25-8-12(9-25)24(5)18(26)28-19(2,3)4/h6-7,12H,8-9H2,1-5H3
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US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294373
PNG
(US9586959, Compound 104 | US9586959, Compound 24 |...)
Show SMILES CNC1CN(C1)c1nc2ncc(Br)cc2n2cnnc12
Show InChI InChI=1S/C12H12BrN7/c1-14-8-4-19(5-8)11-12-18-16-6-20(12)9-2-7(13)3-15-10(9)17-11/h2-3,6,8,14H,4-5H2,1H3
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US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294474
PNG
(US9586959, Compound 112)
Show SMILES CNC1CN(C1)c1nc2ncc(N)cc2n2cnnc12
Show InChI InChI=1S/C12H14N8/c1-14-8-4-19(5-8)11-12-18-16-6-20(12)9-2-7(13)3-15-10(9)17-11/h2-3,6,8,14H,4-5,13H2,1H3
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US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294432
PNG
(US9586959, Compound 8)
Show SMILES NC1CN(C1)c1nc2ncc(Cl)cc2n2cnnc12
Show InChI InChI=1S/C11H10ClN7/c12-6-1-8-9(14-2-6)16-10(18-3-7(13)4-18)11-17-15-5-19(8)11/h1-2,5,7H,3-4,13H2
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US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294437
PNG
(US9586959, Compound 15)
Show SMILES Cc1nnc2c(nc3ncc(Cl)cc3n12)N1CCNCC1
Show InChI InChI=1S/C13H14ClN7/c1-8-18-19-13-12(20-4-2-15-3-5-20)17-11-10(21(8)13)6-9(14)7-16-11/h6-7,15H,2-5H2,1H3
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US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294366
PNG
(US9586959, Compound 16)
Show SMILES Brc1cnc2nc(N3CCNCC3)c3nncn3c2c1
Show InChI InChI=1S/C12H12BrN7/c13-8-5-9-10(15-6-8)17-11(12-18-16-7-20(9)12)19-3-1-14-2-4-19/h5-7,14H,1-4H2
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US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294439
PNG
(US9586959, Compound 27)
Show SMILES CNC1CN(C1)c1nc2nc(Cl)c(Cl)cc2n2cnnc12
Show InChI InChI=1S/C12H11Cl2N7/c1-15-6-3-20(4-6)11-12-19-16-5-21(12)8-2-7(13)9(14)17-10(8)18-11/h2,5-6,15H,3-4H2,1H3
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US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294448
PNG
(US9586959, Compound 45)
Show SMILES Cn1cc2c(n1)c(nc1ncc(Cl)cc21)N1CCNCC1
Show InChI InChI=1S/C14H15ClN6/c1-20-8-11-10-6-9(15)7-17-13(10)18-14(12(11)19-20)21-4-2-16-3-5-21/h6-8,16H,2-5H2,1H3
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US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294386
PNG
(US9586959, Compound 49)
Show SMILES CN1CCN(CC1)c1nc2ncc(I)cc2n2cnnc12
Show InChI InChI=1S/C13H14IN7/c1-19-2-4-20(5-3-19)12-13-18-16-8-21(13)10-6-9(14)7-15-11(10)17-12/h6-8H,2-5H2,1H3
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US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294388
PNG
(US9586959, Compound 51)
Show SMILES CNC1CN(C1)c1nc2ncc(cc2n2cnnc12)C(F)F
Show InChI InChI=1S/C13H13F2N7/c1-16-8-4-21(5-8)12-13-20-18-6-22(13)9-2-7(10(14)15)3-17-11(9)19-12/h2-3,6,8,10,16H,4-5H2,1H3
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US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294389
PNG
(US9586959, Compound 52)
Show SMILES NC1CN(C1)c1nc2ncc(cc2n2cnnc12)C(F)(F)F
Show InChI InChI=1S/C12H10F3N7/c13-12(14,15)6-1-8-9(17-2-6)19-10(21-3-7(16)4-21)11-20-18-5-22(8)11/h1-2,5,7H,3-4,16H2
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US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294400
PNG
(US9586959, Compound 65)
Show SMILES CNC1CN(C1)c1nc2ncc(Br)c(C)c2n2cnnc12
Show InChI InChI=1S/C13H14BrN7/c1-7-9(14)3-16-11-10(7)21-6-17-19-13(21)12(18-11)20-4-8(5-20)15-2/h3,6,8,15H,4-5H2,1-2H3
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US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294454
PNG
(US9586959, Compound 72)
Show SMILES CC1(N)CN(C1)c1nc2ncc(Br)cc2n2cnnc12
Show InChI InChI=1S/C12H12BrN7/c1-12(14)4-19(5-12)10-11-18-16-6-20(11)8-2-7(13)3-15-9(8)17-10/h2-3,6H,4-5,14H2,1H3
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US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294467
PNG
(US9586959, Compound 99)
Show SMILES CNC1CN(C1)c1nc2nc(C)c(Br)cc2n2cnnc12
Show InChI InChI=1S/C13H14BrN7/c1-7-9(14)3-10-11(17-7)18-12(13-19-16-6-21(10)13)20-4-8(5-20)15-2/h3,6,8,15H,4-5H2,1-2H3
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US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294469
PNG
(US9586959, Compound 102)
Show SMILES CN(O)C1CN(C1)c1nc2ncc(Br)cc2n2cnnc12
Show InChI InChI=1S/C12H12BrN7O/c1-18(21)8-4-19(5-8)11-12-17-15-6-20(12)9-2-7(13)3-14-10(9)16-11/h2-3,6,8,21H,4-5H2,1H3
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US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294475
PNG
(US9586959, Compound 113)
Show SMILES CNC1CN(C1)c1nc2ncc(cc2n2cnnc12)-c1ccccc1
Show InChI InChI=1S/C18H17N7/c1-19-14-9-24(10-14)17-18-23-21-11-25(18)15-7-13(8-20-16(15)22-17)12-5-3-2-4-6-12/h2-8,11,14,19H,9-10H2,1H3
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US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294431
PNG
(US9586959, Compound 6)
Show SMILES CN1CCN(CC1)c1nc2cccnc2n2cnnc12
Show InChI InChI=1S/C13H15N7/c1-18-5-7-19(8-6-18)12-13-17-15-9-20(13)11-10(16-12)3-2-4-14-11/h2-4,9H,5-8H2,1H3
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US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294436
PNG
(US9586959, Compound 14)
Show SMILES CN1CCN(CC1)c1nc2ncc(Cl)cc2n2c(C)nnc12
Show InChI InChI=1S/C14H16ClN7/c1-9-18-19-14-13(21-5-3-20(2)4-6-21)17-12-11(22(9)14)7-10(15)8-16-12/h7-8H,3-6H2,1-2H3
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US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294368
PNG
(US9586959, Compound 18)
Show SMILES CNC1CN(C1)c1nc2ncc(Cl)cc2n2cnnc12
Show InChI InChI=1S/C12H12ClN7/c1-14-8-4-19(5-8)11-12-18-16-6-20(12)9-2-7(13)3-15-10(9)17-11/h2-3,6,8,14H,4-5H2,1H3
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US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294373
PNG
(US9586959, Compound 104 | US9586959, Compound 24 |...)
Show SMILES CNC1CN(C1)c1nc2ncc(Br)cc2n2cnnc12
Show InChI InChI=1S/C12H12BrN7/c1-14-8-4-19(5-8)11-12-18-16-6-20(12)9-2-7(13)3-15-10(9)17-11/h2-3,6,8,14H,4-5H2,1H3
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US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294385
PNG
(US9586959, Compound 48)
Show SMILES CNC1CN(C1)c1nc2ncc(I)cc2n2cnnc12
Show InChI InChI=1S/C12H12IN7/c1-14-8-4-19(5-8)11-12-18-16-6-20(12)9-2-7(13)3-15-10(9)17-11/h2-3,6,8,14H,4-5H2,1H3
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US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294391
PNG
(US9586959, Compound 54)
Show SMILES CNC1CN(C1)c1nc2ncc(cc2n2cnnc12)C#C
Show InChI InChI=1S/C14H13N7/c1-3-9-4-11-12(16-5-9)18-13(14-19-17-8-21(11)14)20-6-10(7-20)15-2/h1,4-5,8,10,15H,6-7H2,2H3
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US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294449
PNG
(US9586959, Compound 56)
Show SMILES CCc1cnc2nc(N3CC(C3)NC)c3nncn3c2c1
Show InChI InChI=1S/C14H17N7/c1-3-9-4-11-12(16-5-9)18-13(14-19-17-8-21(11)14)20-6-10(7-20)15-2/h4-5,8,10,15H,3,6-7H2,1-2H3
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US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294395
PNG
(US9586959, Compound 60)
Show SMILES COc1nc2nc(N3CCN(C)CC3)c3nncn3c2cc1Cl
Show InChI InChI=1S/C14H16ClN7O/c1-20-3-5-21(6-4-20)12-13-19-16-8-22(13)10-7-9(15)14(23-2)18-11(10)17-12/h7-8H,3-6H2,1-2H3
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n/an/a>1.00E+8n/an/an/an/a7.427



C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294453
PNG
(US9586959, Compound 71)
Show SMILES CN1CC2CN(CC2C1)c1nc2ncc(Br)cc2n2cnnc12
Show InChI InChI=1S/C15H16BrN7/c1-21-4-9-6-22(7-10(9)5-21)14-15-20-18-8-23(15)12-2-11(16)3-17-13(12)19-14/h2-3,8-10H,4-7H2,1H3
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n/an/a>1.00E+8n/an/an/an/a7.427



C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294462
PNG
(US9586959, Compound 85)
Show SMILES CN(C)C1CN(C1)c1nc2ncc(Br)cc2n2cnnc12
Show InChI InChI=1S/C13H14BrN7/c1-19(2)9-5-20(6-9)12-13-18-16-7-21(13)10-3-8(14)4-15-11(10)17-12/h3-4,7,9H,5-6H2,1-2H3
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n/an/a>1.00E+8n/an/an/an/a7.427



C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294413
PNG
(US9586959, Compound 89)
Show SMILES CNC1CN(C1)c1nc2ncc(Br)cc2n2ccnc12
Show InChI InChI=1S/C13H13BrN6/c1-15-9-6-19(7-9)13-12-16-2-3-20(12)10-4-8(14)5-17-11(10)18-13/h2-5,9,15H,6-7H2,1H3
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n/an/a>1.00E+8n/an/an/an/a7.427



C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294424
PNG
(US9586959, Compound 111)
Show SMILES CNC1CN(C1)c1nc2ncc(cc2n2cnnc12)[N+]([O-])=O
Show InChI InChI=1S/C12H12N8O2/c1-13-7-4-18(5-7)11-12-17-15-6-19(12)9-2-8(20(21)22)3-14-10(9)16-11/h2-3,6-7,13H,4-5H2,1H3
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n/an/a>1.00E+8n/an/an/an/a7.427



C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294429
PNG
(US9586959, Compound 3)
Show SMILES CN1CCN(CC1)c1nc2ncccc2n2cnnc12
Show InChI InChI=1S/C13H15N7/c1-18-5-7-19(8-6-18)12-13-17-15-9-20(13)10-3-2-4-14-11(10)16-12/h2-4,9H,5-8H2,1H3
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n/an/a>1.00E+8n/an/an/an/a7.427



C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294369
PNG
(US9586959, Compound 19)
Show SMILES C[C@H]1CN(CCN1)c1nc2ncc(Cl)cc2n2cnnc12
Show InChI InChI=1S/C13H14ClN7/c1-8-6-20(3-2-15-8)12-13-19-17-7-21(13)10-4-9(14)5-16-11(10)18-12/h4-5,7-8,15H,2-3,6H2,1H3/t8-/m0/s1
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n/an/a>1.00E+8n/an/an/an/a7.427



C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294370
PNG
(US9586959, Compound 20)
Show SMILES C[C@H]1CN(CCN1C)c1nc2ncc(Cl)cc2n2cnnc12
Show InChI InChI=1S/C14H16ClN7/c1-9-7-21(4-3-20(9)2)13-14-19-17-8-22(14)11-5-10(15)6-16-12(11)18-13/h5-6,8-9H,3-4,7H2,1-2H3/t9-/m0/s1
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n/an/a>1.00E+8n/an/an/an/a7.427



C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294438
PNG
(US9586959, Compound 22)
Show SMILES CC1CN(CC(C)N1C)c1nc2ncc(Cl)cc2n2cnnc12
Show InChI InChI=1S/C15H18ClN7/c1-9-6-22(7-10(2)21(9)3)14-15-20-18-8-23(15)12-4-11(16)5-17-13(12)19-14/h4-5,8-10H,6-7H2,1-3H3
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n/an/a>1.00E+8n/an/an/an/a7.427



C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294381
PNG
(US9586959, Compound 39)
Show SMILES Clc1cnc2nc(N3CCNCC3)n3nc(nc3c2c1)C1CC1
Show InChI InChI=1S/C15H16ClN7/c16-10-7-11-13(18-8-10)20-15(22-5-3-17-4-6-22)23-14(11)19-12(21-23)9-1-2-9/h7-9,17H,1-6H2
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C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294394
PNG
(US9586959, Compound 59)
Show SMILES CNC1CN(C1)c1nc2ncc(OC(F)F)cc2n2cnnc12
Show InChI InChI=1S/C13H13F2N7O/c1-16-7-4-21(5-7)11-12-20-18-6-22(12)9-2-8(23-13(14)15)3-17-10(9)19-11/h2-3,6-7,13,16H,4-5H2,1H3
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C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294397
PNG
(US9586959, Compound 63)
Show SMILES CCOc1nc2nc(N3CCNCC3)c3nncn3c2cc1Cl
Show InChI InChI=1S/C14H16ClN7O/c1-2-23-14-9(15)7-10-11(19-14)18-12(13-20-17-8-22(10)13)21-5-3-16-4-6-21/h7-8,16H,2-6H2,1H3
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n/an/a>1.00E+8n/an/an/an/a7.427



C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294456
PNG
(US9586959, Compound 76)
Show SMILES Clc1cnc2nc(N3CCN(CC3)C3CC3)c3nncn3c2c1
Show InChI InChI=1S/C15H16ClN7/c16-10-7-12-13(17-8-10)19-14(15-20-18-9-23(12)15)22-5-3-21(4-6-22)11-1-2-11/h7-9,11H,1-6H2
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n/an/a>1.00E+8n/an/an/an/a7.427



C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294458
PNG
(US9586959, Compound 81)
Show SMILES CN[C@@H]1CCN(C1)c1nc2ncc(Br)cc2n2cnnc12
Show InChI InChI=1S/C13H14BrN7/c1-15-9-2-3-20(6-9)12-13-19-17-7-21(13)10-4-8(14)5-16-11(10)18-12/h4-5,7,9,15H,2-3,6H2,1H3/t9-/m1/s1
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n/an/a>1.00E+8n/an/an/an/a7.427



C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294459
PNG
(US9586959, Compound 82)
Show SMILES Clc1cnc2nc(N3CC4CCCNC4C3)c3nncn3c2c1
Show InChI InChI=1S/C15H16ClN7/c16-10-4-12-13(18-5-10)20-14(15-21-19-8-23(12)15)22-6-9-2-1-3-17-11(9)7-22/h4-5,8-9,11,17H,1-3,6-7H2
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n/an/a>1.00E+8n/an/an/an/a7.427



C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294420
PNG
(US9586959, Compound 100)
Show SMILES CN1CCN(CC1)c1nc2nc(C)c(Br)cc2n2cnnc12
Show InChI InChI=1S/C14H16BrN7/c1-9-10(15)7-11-12(17-9)18-13(14-19-16-8-22(11)14)21-5-3-20(2)4-6-21/h7-8H,3-6H2,1-2H3
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C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294428
PNG
(US9586959, Compound 1)
Show SMILES CN1CCN(CC1)c1nc2cc(C)cnc2n2cnnc12
Show InChI InChI=1S/C14H17N7/c1-10-7-11-12(15-8-10)21-9-16-18-14(21)13(17-11)20-5-3-19(2)4-6-20/h7-9H,3-6H2,1-2H3
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C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294365
PNG
(US9586959, Compound 13)
Show SMILES CN1CCN(CC1)c1nc2ncc(cc2n2cnnc12)[N+]#[C-]
Show InChI InChI=1S/C14H14N8/c1-15-10-7-11-12(16-8-10)18-13(14-19-17-9-22(11)14)21-5-3-20(2)4-6-21/h7-9H,3-6H2,2H3
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C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294372
PNG
(US9586959, Compound 23)
Show SMILES CCOc1nc2nc(N3CCN(C)CC3)c3nncn3c2cc1Cl
Show InChI InChI=1S/C15H18ClN7O/c1-3-24-15-10(16)8-11-12(19-15)18-13(14-20-17-9-23(11)14)22-6-4-21(2)5-7-22/h8-9H,3-7H2,1-2H3
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C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294378
PNG
(US9586959, Compound 31)
Show SMILES CN1CCN(CC1)c1nc2ncc(Cl)cc2c2nc(C)nn12
Show InChI InChI=1S/C14H16ClN7/c1-9-17-13-11-7-10(15)8-16-12(11)18-14(22(13)19-9)21-5-3-20(2)4-6-21/h7-8H,3-6H2,1-2H3
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C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294460
PNG
(US9586959, Compound 83)
Show SMILES CN1CCCC2CN(CC12)c1nc2ncc(Cl)cc2n2cnnc12
Show InChI InChI=1S/C16H18ClN7/c1-22-4-2-3-10-7-23(8-13(10)22)15-16-21-19-9-24(16)12-5-11(17)6-18-14(12)20-15/h5-6,9-10,13H,2-4,7-8H2,1H3
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C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294463
PNG
(US9586959, Compound 87)
Show SMILES OCCNc1nc2ncc(Cl)cc2n2cnnc12
Show InChI InChI=1S/C10H9ClN6O/c11-6-3-7-8(13-4-6)15-9(12-1-2-18)10-16-14-5-17(7)10/h3-5,18H,1-2H2,(H,12,13,15)
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C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294465
PNG
(US9586959, Compound 91)
Show SMILES CNC1CN(C1)c1nc2ncc(Cl)cc2c2oc(C)nc12
Show InChI InChI=1S/C14H14ClN5O/c1-7-18-11-12(21-7)10-3-8(15)4-17-13(10)19-14(11)20-5-9(6-20)16-2/h3-4,9,16H,5-6H2,1-2H3
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C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294414
PNG
(US9586959, Compound 92)
Show SMILES CN1CCN(CC1)C1=Nc2ncc(Cl)cc2C2OC(C)=NC12
Show InChI InChI=1S/C15H18ClN5O/c1-9-18-12-13(22-9)11-7-10(16)8-17-14(11)19-15(12)21-5-3-20(2)4-6-21/h7-8,12-13H,3-6H2,1-2H3
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C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294470
PNG
(US9586959, Compound 105)
Show SMILES CNC1CN(C1)C1=Nc2ncc(Br)cc2N2C[C@H](C)N=C12
Show InChI InChI=1S/C14H17BrN6/c1-8-5-21-11-3-9(15)4-17-12(11)19-13(14(21)18-8)20-6-10(7-20)16-2/h3-4,8,10,16H,5-7H2,1-2H3/t8-/m0/s1
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C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294423
PNG
(US9586959, Compound 110)
Show SMILES CNC1CN(C1)c1nc2ncc(Br)cc2c2ccnn12
Show InChI InChI=1S/C13H13BrN6/c1-15-9-6-19(7-9)13-18-12-10(4-8(14)5-16-12)11-2-3-17-20(11)13/h2-5,9,15H,6-7H2,1H3
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n/an/a>1.00E+8n/an/an/an/a7.427



C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294425
PNG
(US9586959, Compound 116)
Show SMILES CNC1CN(C1)c1nc2ccc(Cl)nc2n2cnnc12
Show InChI InChI=1S/C12H12ClN7/c1-14-7-4-19(5-7)11-12-18-15-6-20(12)10-8(16-11)2-3-9(13)17-10/h2-3,6-7,14H,4-5H2,1H3
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n/an/a>1.00E+8n/an/an/an/a7.427



C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294360
PNG
(US9586959, Compound 2)
Show SMILES CN1CCN(CC1)c1nc2ncc(C)cc2n2cnnc12
Show InChI InChI=1S/C14H17N7/c1-10-7-11-12(15-8-10)17-13(14-18-16-9-21(11)14)20-5-3-19(2)4-6-20/h7-9H,3-6H2,1-2H3
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n/an/a>1.00E+8n/an/an/an/a7.427



C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294430
PNG
(US9586959, Compound 5)
Show SMILES CN1CCN(CC1)c1nc2cc(Cl)cnc2n2cnnc12
Show InChI InChI=1S/C13H14ClN7/c1-19-2-4-20(5-3-19)12-13-18-16-8-21(13)11-10(17-12)6-9(14)7-15-11/h6-8H,2-5H2,1H3
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n/an/a>1.00E+8n/an/an/an/a7.427



C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294367
PNG
(US9586959, Compound 17)
Show SMILES CN1CCN(CC1)c1nc2nc(Cl)c(Cl)cc2n2cnnc12
Show InChI InChI=1S/C13H13Cl2N7/c1-20-2-4-21(5-3-20)12-13-19-16-7-22(13)9-6-8(14)10(15)17-11(9)18-12/h6-7H,2-5H2,1H3
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n/an/a>1.00E+8n/an/an/an/a7.427



C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294375
PNG
(US9586959, Compound 26)
Show SMILES [C-]#[N+]c1cnc2nc(N3CCNCC3)c3nncn3c2c1
Show InChI InChI=1S/C13H12N8/c1-14-9-6-10-11(16-7-9)18-12(13-19-17-8-21(10)13)20-4-2-15-3-5-20/h6-8,15H,2-5H2
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C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294447
PNG
(US9586959, Compound 44)
Show SMILES CNC1CN(C1)c1nc2ncc(Cl)cc2c2cn(C)nc12
Show InChI InChI=1S/C14H15ClN6/c1-16-9-5-21(6-9)14-12-11(7-20(2)19-12)10-3-8(15)4-17-13(10)18-14/h3-4,7,9,16H,5-6H2,1-2H3
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n/an/a>1.00E+8n/an/an/an/a7.427



C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294450
PNG
(US9586959, Compound 57)
Show SMILES CNC1CN(C1)c1nc2ncc(O)cc2n2cnnc12
Show InChI InChI=1S/C12H13N7O/c1-13-7-4-18(5-7)11-12-17-15-6-19(12)9-2-8(20)3-14-10(9)16-11/h2-3,6-7,13,20H,4-5H2,1H3
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n/an/a>1.00E+8n/an/an/an/a7.427



C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294393
PNG
(US9586959, Compound 58)
Show SMILES CNC1CN(C1)c1nc2ncc(OC)cc2n2cnnc12
Show InChI InChI=1S/C13H15N7O/c1-14-8-5-19(6-8)12-13-18-16-7-20(13)10-3-9(21-2)4-15-11(10)17-12/h3-4,7-8,14H,5-6H2,1-2H3
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n/an/a>1.00E+8n/an/an/an/a7.427



C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294398
PNG
(US9586959, Compound 64)
Show SMILES CN1CCN(CC1)c1nc2nc(OCC(F)(F)F)c(Cl)cc2n2cnnc12
Show InChI InChI=1S/C15H15ClF3N7O/c1-24-2-4-25(5-3-24)12-13-23-20-8-26(13)10-6-9(16)14(22-11(10)21-12)27-7-15(17,18)19/h6,8H,2-5,7H2,1H3
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n/an/a>1.00E+8n/an/an/an/a7.427



C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294455
PNG
(US9586959, Compound 73)
Show SMILES CNC1(C)CN(C1)c1nc2ncc(Br)cc2n2cnnc12
Show InChI InChI=1S/C13H14BrN7/c1-13(15-2)5-20(6-13)11-12-19-17-7-21(12)9-3-8(14)4-16-10(9)18-11/h3-4,7,15H,5-6H2,1-2H3
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n/an/a>1.00E+8n/an/an/an/a7.427



C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294411
PNG
(US9586959, Compound 78)
Show SMILES CN1C[C@@H]2C[C@H]1CN2c1nc2ncc(Cl)cc2n2cnnc12
Show InChI InChI=1S/C14H14ClN7/c1-20-5-10-3-9(20)6-21(10)13-14-19-17-7-22(14)11-2-8(15)4-16-12(11)18-13/h2,4,7,9-10H,3,5-6H2,1H3/t9-,10-/m0/s1
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n/an/a>1.00E+8n/an/an/an/a7.427



C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294412
PNG
(US9586959, Compound 88)
Show SMILES CNC1CN(C1)c1nc2ncc(Cl)cc2n2ccnc12
Show InChI InChI=1S/C13H13ClN6/c1-15-9-6-19(7-9)13-12-16-2-3-20(12)10-4-8(14)5-17-11(10)18-13/h2-5,9,15H,6-7H2,1H3
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n/an/a>1.00E+8n/an/an/an/a7.427



C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294415
PNG
(US9586959, Compound 93)
Show SMILES CNC1CN(C1)c1nc2ncc(Cl)cc2n2nnnc12
Show InChI InChI=1S/C11H11ClN8/c1-13-7-4-19(5-7)10-11-16-17-18-20(11)8-2-6(12)3-14-9(8)15-10/h2-3,7,13H,4-5H2,1H3
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n/an/a>1.00E+8n/an/an/an/a7.427



C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294407
PNG
(US9586959, Compound 69 | US9586959, Compound 95)
Show SMILES CNC1CN(C1)c1nc2ncc(Br)cc2n2nnnc12
Show InChI InChI=1S/C11H11BrN8/c1-13-7-4-19(5-7)10-11-16-17-18-20(11)8-2-6(12)3-14-9(8)15-10/h2-3,7,13H,4-5H2,1H3
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n/an/a>1.00E+8n/an/an/an/a7.427



C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294472
PNG
(US9586959, Compound 108)
Show SMILES CNC1CN(C1)c1nc2ncc(Br)cc2n2cc(C)nc12
Show InChI InChI=1S/C14H15BrN6/c1-8-5-21-11-3-9(15)4-17-12(11)19-13(14(21)18-8)20-6-10(7-20)16-2/h3-5,10,16H,6-7H2,1-2H3
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n/an/a>1.00E+8n/an/an/an/a7.427



C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294477
PNG
(US9586959, Compound 115)
Show SMILES CNC1CN(C1)c1nc2ncc(Br)cc2n2cccc12
Show InChI InChI=1S/C14H14BrN5/c1-16-10-7-19(8-10)14-11-3-2-4-20(11)12-5-9(15)6-17-13(12)18-14/h2-6,10,16H,7-8H2,1H3
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C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294440
PNG
(US9586959, Compound 30)
Show SMILES N[C@@H]1CCN(C1)c1nc2ncc(Cl)cc2n2cnnc12
Show InChI InChI=1S/C12H12ClN7/c13-7-3-9-10(15-4-7)17-11(12-18-16-6-20(9)12)19-2-1-8(14)5-19/h3-4,6,8H,1-2,5,14H2/t8-/m1/s1
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n/an/a>1.00E+8n/an/an/an/a7.427



C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM294442
PNG
(US9586959, Compound 36)
Show SMILES CNC1CN(C1)c1nc2ncc(Cl)cc2c2ncnn12
Show InChI InChI=1S/C12H12ClN7/c1-14-8-4-19(5-8)12-18-10-9(2-7(13)3-15-10)11-16-6-17-20(11)12/h2-3,6,8,14H,4-5H2,1H3
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n/an/a>1.00E+8n/an/an/an/a7.427



C&C RESEARCH LABORATORIES

US Patent


Assay Description
Each compound of the present invention prepared in the examples was prepared in DMSO into concentrations of 0.02, 0.06, 0.3 and 2 mM. 10 uL of the pr...


US Patent US9586959 (2017)

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