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Compile Data Set for Download or QSAR

Found 122 hits Enz. Inhib. hit(s) with all data for entry = 1302   
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))
BDBM315434
PNG
(US10172856, Example 86)
Show SMILES CC(C)Oc1cc(Br)ccc1N(C(C)C)c1ccnc(N)n1
Show InChI InChI=1S/C16H21BrN4O/c1-10(2)21(15-7-8-19-16(18)20-15)13-6-5-12(17)9-14(13)22-11(3)4/h5-11H,1-4H3,(H2,18,19,20)
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3n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM315466
PNG
(US10172856, Example 115)
Show SMILES CCCc1cc(ccc1N(C(C)C)c1ccnc(N)n1)C(F)(F)F
Show InChI InChI=1S/C17H21F3N4/c1-4-5-12-10-13(17(18,19)20)6-7-14(12)24(11(2)3)15-8-9-22-16(21)23-15/h6-11H,4-5H2,1-3H3,(H2,21,22,23)
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4n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM315348
PNG
(US10172856, Example 1)
Show SMILES CCOc1cc(F)ccc1N(C(C)C)c1ccnc(N)n1
Show InChI InChI=1S/C15H19FN4O/c1-4-21-13-9-11(16)5-6-12(13)20(10(2)3)14-7-8-18-15(17)19-14/h5-10H,4H2,1-3H3,(H2,17,18,19)
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6n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM315377
PNG
(US10172856, Example 30)
Show SMILES CC(C)N(c1ccnc(N)n1)c1ccc(cc1C)S(F)(F)(F)(F)F
Show InChI InChI=1S/C14H17F5N4S/c1-9(2)23(13-6-7-21-14(20)22-13)12-5-4-11(8-10(12)3)24(15,16,17,18)19/h4-9H,1-3H3,(H2,20,21,22)
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7n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM315386
PNG
(US10172856, Example 38)
Show SMILES Cc1cc(ccc1N(Cc1cscn1)c1ccnc(N)n1)S(F)(F)(F)(F)F
Show InChI InChI=1S/C15H14F5N5S2/c1-10-6-12(27(16,17,18,19)20)2-3-13(10)25(7-11-8-26-9-23-11)14-4-5-22-15(21)24-14/h2-6,8-9H,7H2,1H3,(H2,21,22,24)
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7n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM315471
PNG
(US10172856, Example 119)
Show SMILES CCCc1cc(F)ccc1N(C(C)C)c1ccnc(N)n1
Show InChI InChI=1S/C16H21FN4/c1-4-5-12-10-13(17)6-7-14(12)21(11(2)3)15-8-9-19-16(18)20-15/h6-11H,4-5H2,1-3H3,(H2,18,19,20)
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7n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM315465
PNG
(US10172856, Example 114)
Show SMILES C\C=C\c1cc(ccc1N(C(C)C)c1ccnc(N)n1)C(F)(F)F
Show InChI InChI=1S/C17H19F3N4/c1-4-5-12-10-13(17(18,19)20)6-7-14(12)24(11(2)3)15-8-9-22-16(21)23-15/h4-11H,1-3H3,(H2,21,22,23)/b5-4+
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7n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM315391
PNG
(US10172856, Example 43)
Show SMILES CCN(c1ccnc(N)n1)c1ccc(cc1C1CCC1)S(=O)(=O)C(F)(F)F
Show InChI InChI=1S/C17H19F3N4O2S/c1-2-24(15-8-9-22-16(21)23-15)14-7-6-12(27(25,26)17(18,19)20)10-13(14)11-4-3-5-11/h6-11H,2-5H2,1H3,(H2,21,22,23)
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8n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM315370
PNG
(US10172856, Example 23)
Show SMILES CCc1cc(ccc1N(Cc1cocn1)c1ccnc(N)n1)S(F)(F)(F)(F)F
Show InChI InChI=1S/C16H16F5N5OS/c1-2-11-7-13(28(17,18,19,20)21)3-4-14(11)26(8-12-9-27-10-24-12)15-5-6-23-16(22)25-15/h3-7,9-10H,2,8H2,1H3,(H2,22,23,25)
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8n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM315433
PNG
(US10172856, Example 85)
Show SMILES CC(C)N(c1ccnc(N)n1)c1ccc(Br)cc1OC(F)(F)F
Show InChI InChI=1S/C14H14BrF3N4O/c1-8(2)22(12-5-6-20-13(19)21-12)10-4-3-9(15)7-11(10)23-14(16,17)18/h3-8H,1-2H3,(H2,19,20,21)
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8n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM315381
PNG
(US10172856, Example 33)
Show SMILES Cc1ocnc1CN(c1ccnc(N)n1)c1ccc(cc1C)S(F)(F)(F)(F)F
Show InChI InChI=1S/C16H16F5N5OS/c1-10-7-12(28(17,18,19,20)21)3-4-14(10)26(8-13-11(2)27-9-24-13)15-5-6-23-16(22)25-15/h3-7,9H,8H2,1-2H3,(H2,22,23,25)
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9n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM315366
PNG
(US10172856, Example 19)
Show SMILES Cc1cc(ccc1N(Cc1cocn1)c1ccnc(N)n1)S(F)(F)(F)(F)F
Show InChI InChI=1S/C15H14F5N5OS/c1-10-6-12(27(16,17,18,19)20)2-3-13(10)25(7-11-8-26-9-23-11)14-4-5-22-15(21)24-14/h2-6,8-9H,7H2,1H3,(H2,21,22,24)
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9n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM315353
PNG
(US10172856, Example 6)
Show SMILES Nc1nccc(n1)N(Cc1cocn1)c1ccc(OC(F)(F)F)cc1C1CCC1
Show InChI InChI=1S/C19H18F3N5O2/c20-19(21,22)29-14-4-5-16(15(8-14)12-2-1-3-12)27(9-13-10-28-11-25-13)17-6-7-24-18(23)26-17/h4-8,10-12H,1-3,9H2,(H2,23,24,26)
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9n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM315458
PNG
(US10172856, Example 109)
Show SMILES CCc1cc(ccc1N(Cc1cocn1)c1ccnc(N)n1)C(F)(F)F
Show InChI InChI=1S/C17H16F3N5O/c1-2-11-7-12(17(18,19)20)3-4-14(11)25(8-13-9-26-10-23-13)15-5-6-22-16(21)24-15/h3-7,9-10H,2,8H2,1H3,(H2,21,22,24)
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9n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM315372
PNG
(US10172856, Example 25)
Show SMILES CCc1cc(ccc1N(Cc1ccn[nH]1)c1ccnc(N)n1)S(F)(F)(F)(F)F
Show InChI InChI=1S/C16H17F5N6S/c1-2-11-9-13(28(17,18,19,20)21)3-4-14(11)27(10-12-5-8-24-26-12)15-6-7-23-16(22)25-15/h3-9H,2,10H2,1H3,(H,24,26)(H2,22,23,25)
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9n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM315399
PNG
(US10172856, Example 51)
Show SMILES CC(C)N(c1ccnc(N)n1)c1ccc(cc1C1CCC1)S(=O)(=O)C(F)(F)F
Show InChI InChI=1S/C18H21F3N4O2S/c1-11(2)25(16-8-9-23-17(22)24-16)15-7-6-13(28(26,27)18(19,20)21)10-14(15)12-4-3-5-12/h6-12H,3-5H2,1-2H3,(H2,22,23,24)
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10n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM315435
PNG
(US10172856, Example 87)
Show SMILES CC(C)N(c1ccnc(N)n1)c1ccc(Br)cc1OCC(F)(F)F
Show InChI InChI=1S/C15H16BrF3N4O/c1-9(2)23(13-5-6-21-14(20)22-13)11-4-3-10(16)7-12(11)24-8-15(17,18)19/h3-7,9H,8H2,1-2H3,(H2,20,21,22)
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11n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM315470
PNG
(US10172856, Example 118)
Show SMILES C\C=C\c1cc(F)ccc1N(C(C)C)c1ccnc(N)n1
Show InChI InChI=1S/C16H19FN4/c1-4-5-12-10-13(17)6-7-14(12)21(11(2)3)15-8-9-19-16(18)20-15/h4-11H,1-3H3,(H2,18,19,20)/b5-4+
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11n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM315351
PNG
(US10172856, Example 4)
Show SMILES CCOc1cc(F)ccc1N(Cc1ccccc1)c1ccnc(N)n1
Show InChI InChI=1S/C19H19FN4O/c1-2-25-17-12-15(20)8-9-16(17)24(13-14-6-4-3-5-7-14)18-10-11-22-19(21)23-18/h3-12H,2,13H2,1H3,(H2,21,22,23)
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12n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM315385
PNG
(US10172856, Example 37)
Show SMILES Cc1cc(ccc1N(Cc1ncccc1Cl)c1ccnc(N)n1)S(F)(F)(F)(F)F
Show InChI InChI=1S/C17H15ClF5N5S/c1-11-9-12(29(19,20,21,22)23)4-5-15(11)28(16-6-8-26-17(24)27-16)10-14-13(18)3-2-7-25-14/h2-9H,10H2,1H3,(H2,24,26,27)
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12n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM315355
PNG
(US10172856, Example 8)
Show SMILES CC(C)Cc1cc(OC(F)(F)F)ccc1N(Cc1cocn1)c1ccnc(N)n1
Show InChI InChI=1S/C19H20F3N5O2/c1-12(2)7-13-8-15(29-19(20,21)22)3-4-16(13)27(9-14-10-28-11-25-14)17-5-6-24-18(23)26-17/h3-6,8,10-12H,7,9H2,1-2H3,(H2,23,24,26)
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12n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM315392
PNG
(US10172856, Example 44)
Show SMILES Nc1nccc(n1)N(Cc1cocn1)c1ccc(cc1C1CCC1)S(=O)(=O)C(F)(F)F
Show InChI InChI=1S/C19H18F3N5O3S/c20-19(21,22)31(28,29)14-4-5-16(15(8-14)12-2-1-3-12)27(9-13-10-30-11-25-13)17-6-7-24-18(23)26-17/h4-8,10-12H,1-3,9H2,(H2,23,24,26)
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13n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM315352
PNG
(US10172856, Example 5)
Show SMILES CCCc1cc(OC(F)(F)F)ccc1N(Cc1cocn1)c1ccnc(N)n1
Show InChI InChI=1S/C18H18F3N5O2/c1-2-3-12-8-14(28-18(19,20)21)4-5-15(12)26(9-13-10-27-11-24-13)16-6-7-23-17(22)25-16/h4-8,10-11H,2-3,9H2,1H3,(H2,22,23,25)
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Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM315387
PNG
(US10172856, Example 39)
Show SMILES Cc1cc(ccc1N(Cc1n[nH]cc1F)c1ccnc(N)n1)S(F)(F)(F)(F)F
Show InChI InChI=1S/C15H14F6N6S/c1-9-6-10(28(17,18,19,20)21)2-3-13(9)27(8-12-11(16)7-24-26-12)14-4-5-23-15(22)25-14/h2-7H,8H2,1H3,(H,24,26)(H2,22,23,25)
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Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM315383
PNG
(US10172856, Example 35)
Show SMILES Cc1cc(ccc1N(Cc1cnco1)c1ccnc(N)n1)S(F)(F)(F)(F)F
Show InChI InChI=1S/C15H14F5N5OS/c1-10-6-12(27(16,17,18,19)20)2-3-13(10)25(8-11-7-22-9-26-11)14-4-5-23-15(21)24-14/h2-7,9H,8H2,1H3,(H2,21,23,24)
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Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM315382
PNG
(US10172856, Example 34)
Show SMILES Cc1cc(ccc1N(Cc1ccon1)c1ccnc(N)n1)S(F)(F)(F)(F)F
Show InChI InChI=1S/C15H14F5N5OS/c1-10-8-12(27(16,17,18,19)20)2-3-13(10)25(9-11-5-7-26-24-11)14-4-6-22-15(21)23-14/h2-8H,9H2,1H3,(H2,21,22,23)
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Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM315384
PNG
(US10172856, Example 36)
Show SMILES Cc1cc(ccc1N(Cc1ncco1)c1ccnc(N)n1)S(F)(F)(F)(F)F
Show InChI InChI=1S/C15H14F5N5OS/c1-10-8-11(27(16,17,18,19)20)2-3-12(10)25(9-14-22-6-7-26-14)13-4-5-23-15(21)24-13/h2-8H,9H2,1H3,(H2,21,23,24)
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Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM315445
PNG
(US10172856, Example 97)
Show SMILES CCCc1cc(ccc1N(C(C)C)c1ccnc(N)n1)C#N
Show InChI InChI=1S/C17H21N5/c1-4-5-14-10-13(11-18)6-7-15(14)22(12(2)3)16-8-9-20-17(19)21-16/h6-10,12H,4-5H2,1-3H3,(H2,19,20,21)
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Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM315388
PNG
(US10172856, Example 40)
Show SMILES Cc1cc(ccc1N(Cc1n[nH]cc1Cl)c1ccnc(N)n1)S(F)(F)(F)(F)F
Show InChI InChI=1S/C15H14ClF5N6S/c1-9-6-10(28(17,18,19,20)21)2-3-13(9)27(8-12-11(16)7-24-26-12)14-4-5-23-15(22)25-14/h2-7H,8H2,1H3,(H,24,26)(H2,22,23,25)
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Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM315410
PNG
(US10172856, Example 62)
Show SMILES CC(C)Cc1cc(ccc1N(Cc1cocn1)c1ccnc(N)n1)S(=O)(=O)C(F)(F)F
Show InChI InChI=1S/C19H20F3N5O3S/c1-12(2)7-13-8-15(31(28,29)19(20,21)22)3-4-16(13)27(9-14-10-30-11-25-14)17-5-6-24-18(23)26-17/h3-6,8,10-12H,7,9H2,1-2H3,(H2,23,24,26)
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Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM315401
PNG
(US10172856, Example 53)
Show SMILES CCc1cc(OC(F)(F)F)ccc1N(Cc1cocn1)c1ccnc(N)n1
Show InChI InChI=1S/C17H16F3N5O2/c1-2-11-7-13(27-17(18,19)20)3-4-14(11)25(8-12-9-26-10-23-12)15-5-6-22-16(21)24-15/h3-7,9-10H,2,8H2,1H3,(H2,21,22,24)
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Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM315389
PNG
(US10172856, Example 41)
Show SMILES Cc1cc(ccc1N(Cc1cc[nH]n1)c1ccnc(N)n1)S(F)(F)(F)(F)F
Show InChI InChI=1S/C15H15F5N6S/c1-10-8-12(27(16,17,18,19)20)2-3-13(10)26(9-11-4-7-23-25-11)14-5-6-22-15(21)24-14/h2-8H,9H2,1H3,(H,23,25)(H2,21,22,24)
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Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM315467
PNG
(US10172856, Example 116)
Show SMILES CC(C)N(c1ccnc(N)n1)c1ccc(cc1C)C(F)(F)F
Show InChI InChI=1S/C15H17F3N4/c1-9(2)22(13-6-7-20-14(19)21-13)12-5-4-11(8-10(12)3)15(16,17)18/h4-9H,1-3H3,(H2,19,20,21)
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Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM315447
PNG
(US10172856, Example 99)
Show SMILES C\C=C\c1cc(ccc1N(C(C)C)c1ccnc(N)n1)C#N
Show InChI InChI=1S/C17H19N5/c1-4-5-14-10-13(11-18)6-7-15(14)22(12(2)3)16-8-9-20-17(19)21-16/h4-10,12H,1-3H3,(H2,19,20,21)/b5-4+
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Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM315411
PNG
(US10172856, Example 63)
Show SMILES CCc1cc(ccc1N(C(C)C)c1ccnc(N)n1)S(=O)(=O)C(F)(F)F
Show InChI InChI=1S/C16H19F3N4O2S/c1-4-11-9-12(26(24,25)16(17,18)19)5-6-13(11)23(10(2)3)14-7-8-21-15(20)22-14/h5-10H,4H2,1-3H3,(H2,20,21,22)
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Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM315473
PNG
(US10172856, Example 121)
Show SMILES CC(C)N(c1ccnc(N)n1)c1ccc(F)cc1C(C)C
Show InChI InChI=1S/C16H21FN4/c1-10(2)13-9-12(17)5-6-14(13)21(11(3)4)15-7-8-19-16(18)20-15/h5-11H,1-4H3,(H2,18,19,20)
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Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM315380
PNG
(US10172856, Example 32)
Show SMILES Cc1cc(ccc1N(Cc1ncccn1)c1ccnc(N)n1)S(F)(F)(F)(F)F
Show InChI InChI=1S/C16H15F5N6S/c1-11-9-12(28(17,18,19,20)21)3-4-13(11)27(10-14-23-6-2-7-24-14)15-5-8-25-16(22)26-15/h2-9H,10H2,1H3,(H2,22,25,26)
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Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM315420
PNG
(US10172856, Example 72)
Show SMILES CCCN(c1ccnc(N)n1)c1ccc(cc1CC(C)C)S(C)(=O)=O
Show InChI InChI=1S/C18H26N4O2S/c1-5-10-22(17-8-9-20-18(19)21-17)16-7-6-15(25(4,23)24)12-14(16)11-13(2)3/h6-9,12-13H,5,10-11H2,1-4H3,(H2,19,20,21)
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Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM315459
PNG
(US10172856, Example 110)
Show SMILES Cc1cc(ccc1N(Cc1cocn1)c1ccnc(N)n1)C(F)(F)F
Show InChI InChI=1S/C16H14F3N5O/c1-10-6-11(16(17,18)19)2-3-13(10)24(7-12-8-25-9-22-12)14-4-5-21-15(20)23-14/h2-6,8-9H,7H2,1H3,(H2,20,21,23)
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Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM315359
PNG
(US10172856, Example 12)
Show SMILES CCOc1cc(F)ccc1N(Cc1cocn1)c1ccnc(N)n1
Show InChI InChI=1S/C16H16FN5O2/c1-2-24-14-7-11(17)3-4-13(14)22(8-12-9-23-10-20-12)15-5-6-19-16(18)21-15/h3-7,9-10H,2,8H2,1H3,(H2,18,19,21)
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Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM315361
PNG
(US10172856, Example 14)
Show SMILES CCOc1cc(F)ccc1N(Cc1ccon1)c1ccnc(N)n1
Show InChI InChI=1S/C16H16FN5O2/c1-2-23-14-9-11(17)3-4-13(14)22(10-12-6-8-24-21-12)15-5-7-19-16(18)20-15/h3-9H,2,10H2,1H3,(H2,18,19,20)
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Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM315360
PNG
(US10172856, Example 13)
Show SMILES CCOc1cc(F)ccc1N(Cc1n[nH]cc1Cl)c1ccnc(N)n1
Show InChI InChI=1S/C16H16ClFN6O/c1-2-25-14-7-10(18)3-4-13(14)24(9-12-11(17)8-21-23-12)15-5-6-20-16(19)22-15/h3-8H,2,9H2,1H3,(H,21,23)(H2,19,20,22)
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Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM315454
PNG
(US10172856, Example 106)
Show SMILES CCN(c1ccnc(N)n1)c1ccc(cc1C1CCC1)S(=O)(=O)C1CC1
Show InChI InChI=1S/C19H24N4O2S/c1-2-23(18-10-11-21-19(20)22-18)17-9-8-15(26(24,25)14-6-7-14)12-16(17)13-4-3-5-13/h8-14H,2-7H2,1H3,(H2,20,21,22)
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Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM315424
PNG
(US10172856, Example 76)
Show SMILES CCN(c1ccnc(N)n1)c1ccc(cc1CC)S(=O)(=O)C(F)F
Show InChI InChI=1S/C15H18F2N4O2S/c1-3-10-9-11(24(22,23)14(16)17)5-6-12(10)21(4-2)13-7-8-19-15(18)20-13/h5-9,14H,3-4H2,1-2H3,(H2,18,19,20)
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Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM315369
PNG
(US10172856, Example 22)
Show SMILES CCN(c1ccnc(N)n1)c1ccc(cc1C)S(F)(F)(F)(F)F
Show InChI InChI=1S/C13H15F5N4S/c1-3-22(12-6-7-20-13(19)21-12)11-5-4-10(8-9(11)2)23(14,15,16,17)18/h4-8H,3H2,1-2H3,(H2,19,20,21)
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26n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM315363
PNG
(US10172856, Example 16)
Show SMILES CCOc1cc(F)ccc1N(Cc1cnco1)c1ccnc(N)n1
Show InChI InChI=1S/C16H16FN5O2/c1-2-23-14-7-11(17)3-4-13(14)22(9-12-8-19-10-24-12)15-5-6-20-16(18)21-15/h3-8,10H,2,9H2,1H3,(H2,18,20,21)
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27n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM315449
PNG
(US10172856, Example 101)
Show SMILES C\C=C\c1cc(Cl)ccc1N(Cc1cocn1)c1ccnc(N)n1
Show InChI InChI=1S/C17H16ClN5O/c1-2-3-12-8-13(18)4-5-15(12)23(9-14-10-24-11-21-14)16-6-7-20-17(19)22-16/h2-8,10-11H,9H2,1H3,(H2,19,20,22)/b3-2+
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28n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM315354
PNG
(US10172856, Example 7)
Show SMILES Cc1cc(OC(F)(F)F)ccc1N(Cc1cocn1)c1ccnc(N)n1
Show InChI InChI=1S/C16H14F3N5O2/c1-10-6-12(26-16(17,18)19)2-3-13(10)24(7-11-8-25-9-22-11)14-4-5-21-15(20)23-14/h2-6,8-9H,7H2,1H3,(H2,20,21,23)
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29n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM315412
PNG
(US10172856, Example 64)
Show SMILES CCc1cc(ccc1N(Cc1cocn1)c1ccnc(N)n1)S(=O)(=O)C(F)(F)F
Show InChI InChI=1S/C17H16F3N5O3S/c1-2-11-7-13(29(26,27)17(18,19)20)3-4-14(11)25(8-12-9-28-10-23-12)15-5-6-22-16(21)24-15/h3-7,9-10H,2,8H2,1H3,(H2,21,22,24)
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29n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM315364
PNG
(US10172856, Example 17)
Show SMILES CCOc1cc(F)ccc1N(Cc1cscn1)c1ccnc(N)n1
Show InChI InChI=1S/C16H16FN5OS/c1-2-23-14-7-11(17)3-4-13(14)22(8-12-9-24-10-20-12)15-5-6-19-16(18)21-15/h3-7,9-10H,2,8H2,1H3,(H2,18,19,21)
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29n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Receptor binding was assessed using isolated plasma membranes from SKNMC neuroblastoma cell lines stably expressing recombinant human H4 receptor. To...


US Patent US10172856 (2019)


BindingDB Entry DOI: 10.7270/Q2BV7JQ1
More data for this
Ligand-Target Pair
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