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Patent code US9464084

Compile Data Set for Download or QSAR

Found 843 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
P2X purinoceptor 7 (P2X7)


(Rattus norvegicus (Rat))
BDBM254320
PNG
(US9464084, 220)
Show SMILES C[C@H]1Cc2c(CN1C(=O)c1cccc(c1F)C(F)(F)F)nnn2-c1ncc(F)cn1
Show InChI InChI=1S/C18H13F5N6O/c1-9-5-14-13(26-27-29(14)17-24-6-10(19)7-25-17)8-28(9)16(30)11-3-2-4-12(15(11)20)18(21,22)23/h2-4,6-7,9H,5,8H2,1H3/t9-/m0/s1
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1.20n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


Citation and Details
More data for this
Ligand-Target Pair
P2X purinoceptor 7 (P2X7)


(Rattus norvegicus (Rat))
BDBM254247
PNG
(US9464084, 133)
Show SMILES C[C@H]1N(CCc2c1nnn2-c1cc[nH]n1)C(=O)c1cccc(c1Cl)C(F)(F)F
Show InChI InChI=1S/C17H14ClF3N6O/c1-9-15-12(27(25-24-15)13-5-7-22-23-13)6-8-26(9)16(28)10-3-2-4-11(14(10)18)17(19,20)21/h2-5,7,9H,6,8H2,1H3,(H,22,23)/t9-/m1/s1
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Janssen Pharmaceutica NV

US Patent


Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


Citation and Details
More data for this
Ligand-Target Pair
P2X purinoceptor 7 (P2X7)


(Rattus norvegicus (Rat))
BDBM254310
PNG
(US9464084, 208)
Show SMILES C[C@H]1Cc2c(CN1C(=O)c1cccc(c1C)C(F)(F)F)nnn2-c1ncc(F)cn1
Show InChI InChI=1S/C19H16F4N6O/c1-10-6-16-15(26-27-29(16)18-24-7-12(20)8-25-18)9-28(10)17(30)13-4-3-5-14(11(13)2)19(21,22)23/h3-5,7-8,10H,6,9H2,1-2H3/t10-/m0/s1
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Janssen Pharmaceutica NV

US Patent


Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


Citation and Details
More data for this
Ligand-Target Pair
P2X purinoceptor 7 (P2X7)


(Rattus norvegicus (Rat))
BDBM254203
PNG
(US9464084, 88)
Show SMILES C[C@H]1N(CCc2c1nnn2-c1ncccn1)C(=O)c1cccc(c1Cl)C(F)(F)F
Show InChI InChI=1S/C18H14ClF3N6O/c1-10-15-13(28(26-25-15)17-23-7-3-8-24-17)6-9-27(10)16(29)11-4-2-5-12(14(11)19)18(20,21)22/h2-5,7-8,10H,6,9H2,1H3/t10-/m1/s1
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Janssen Pharmaceutica NV

US Patent


Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


Citation and Details
More data for this
Ligand-Target Pair
P2X purinoceptor 7 (P2X7)


(Rattus norvegicus (Rat))
BDBM254344
PNG
(US9464084, 249)
Show SMILES COCCn1ccc(n1)-n1nnc2[C@H](C)N(CCc12)C(=O)c1cccc(c1Cl)C(F)(F)F
Show InChI InChI=1S/C20H20ClF3N6O2/c1-12-18-15(30(27-25-18)16-7-8-28(26-16)10-11-32-2)6-9-29(12)19(31)13-4-3-5-14(17(13)21)20(22,23)24/h3-5,7-8,12H,6,9-11H2,1-2H3/t12-/m0/s1
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Janssen Pharmaceutica NV

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Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


Citation and Details
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM254374
PNG
(US9464084, 281)
Show SMILES Cc1c(cccc1C(F)(F)F)C(=O)N1CCc2c(C1)nnn2-c1ncccn1
Show InChI InChI=1S/C18H15F3N6O/c1-11-12(4-2-5-13(11)18(19,20)21)16(28)26-9-6-15-14(10-26)24-25-27(15)17-22-7-3-8-23-17/h2-5,7-8H,6,9-10H2,1H3
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Janssen Pharmaceutica NV

US Patent


Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


Citation and Details
More data for this
Ligand-Target Pair
P2X purinoceptor 7 (P2X7)


(Rattus norvegicus (Rat))
BDBM254234
PNG
(US9464084, 119)
Show SMILES C[C@@H]1Cc2c(CN1C(=O)c1cccc(c1Cl)C(F)(F)F)nnn2-c1ccccn1
Show InChI InChI=1S/C19H15ClF3N5O/c1-11-9-15-14(25-26-28(15)16-7-2-3-8-24-16)10-27(11)18(29)12-5-4-6-13(17(12)20)19(21,22)23/h2-8,11H,9-10H2,1H3/t11-/m1/s1
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Janssen Pharmaceutica NV

US Patent


Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


Citation and Details
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM254319
PNG
(US9464084, 218)
Show SMILES C[C@H]1Cc2c(CN1C(=O)c1ccc(Cl)c(F)c1Cl)nnn2-c1ncc(F)cn1
Show InChI InChI=1S/C17H12Cl2F2N6O/c1-8-4-13-12(24-25-27(13)17-22-5-9(20)6-23-17)7-26(8)16(28)10-2-3-11(18)15(21)14(10)19/h2-3,5-6,8H,4,7H2,1H3/t8-/m0/s1
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Janssen Pharmaceutica NV

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Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


Citation and Details
More data for this
Ligand-Target Pair
P2X purinoceptor 7 (P2X7)


(Rattus norvegicus (Rat))
BDBM254305
PNG
(US9464084, 202)
Show SMILES C[C@H]1Cc2c(CN1C(=O)c1cccc(c1Cl)C(F)(F)F)nnn2-c1ncc(F)cn1
Show InChI InChI=1S/C18H13ClF4N6O/c1-9-5-14-13(26-27-29(14)17-24-6-10(20)7-25-17)8-28(9)16(30)11-3-2-4-12(15(11)19)18(21,22)23/h2-4,6-7,9H,5,8H2,1H3/t9-/m0/s1
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Janssen Pharmaceutica NV

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Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


Citation and Details
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM254271
PNG
(US9464084, 166)
Show SMILES C[C@H]1Cc2c(CN1C(=O)c1cccc(Cl)c1Cl)nnn2-c1ncccc1F
Show InChI InChI=1S/C18H14Cl2FN5O/c1-10-8-15-14(23-24-26(15)17-13(21)6-3-7-22-17)9-25(10)18(27)11-4-2-5-12(19)16(11)20/h2-7,10H,8-9H2,1H3/t10-/m0/s1
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Janssen Pharmaceutica NV

US Patent


Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


Citation and Details
More data for this
Ligand-Target Pair
P2X purinoceptor 7 (P2X7)


(Rattus norvegicus (Rat))
BDBM254332
PNG
(US9464084, 235)
Show SMILES C[C@H]1N(CCc2c1nnn2-c1nccc(C)n1)C(=O)c1cccc(c1Cl)C(F)(F)F
Show InChI InChI=1S/C19H16ClF3N6O/c1-10-6-8-24-18(25-10)29-14-7-9-28(11(2)16(14)26-27-29)17(30)12-4-3-5-13(15(12)20)19(21,22)23/h3-6,8,11H,7,9H2,1-2H3/t11-/m1/s1
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Janssen Pharmaceutica NV

US Patent


Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


Citation and Details
More data for this
Ligand-Target Pair
P2X purinoceptor 7 (P2X7)


(Rattus norvegicus (Rat))
BDBM254274
PNG
(US9464084, 170)
Show SMILES C[C@@H]1N(CCc2c1nnn2-c1ccn(C)n1)C(=O)c1cccc(c1Cl)C(F)(F)F
Show InChI InChI=1S/C18H16ClF3N6O/c1-10-16-13(28(25-23-16)14-7-8-26(2)24-14)6-9-27(10)17(29)11-4-3-5-12(15(11)19)18(20,21)22/h3-5,7-8,10H,6,9H2,1-2H3/t10-/m0/s1
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Janssen Pharmaceutica NV

US Patent


Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


Citation and Details
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM254273
PNG
(US9464084, 168)
Show SMILES C[C@H]1Cc2c(CN1C(=O)c1cccc(c1Cl)C(F)(F)F)nnn2-c1ncccc1F
Show InChI InChI=1S/C19H14ClF4N5O/c1-10-8-15-14(26-27-29(15)17-13(21)6-3-7-25-17)9-28(10)18(30)11-4-2-5-12(16(11)20)19(22,23)24/h2-7,10H,8-9H2,1H3/t10-/m0/s1
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Janssen Pharmaceutica NV

US Patent


Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


Citation and Details
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM254254
PNG
(US9464084, 144)
Show SMILES C[C@@H]1N(CCc2c1nnn2-c1cnccn1)C(=O)c1ccc(F)c(Cl)c1Cl
Show InChI InChI=1S/C17H13Cl2FN6O/c1-9-16-12(26(24-23-16)13-8-21-5-6-22-13)4-7-25(9)17(27)10-2-3-11(20)15(19)14(10)18/h2-3,5-6,8-9H,4,7H2,1H3/t9-/m0/s1
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Janssen Pharmaceutica NV

US Patent


Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


Citation and Details
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM254307
PNG
(US9464084, 205)
Show SMILES C[C@H]1Cc2c(CN1C(=O)c1cccc(Cl)c1Cl)nnn2-c1ncc(F)cn1
Show InChI InChI=1S/C17H13Cl2FN6O/c1-9-5-14-13(23-24-26(14)17-21-6-10(20)7-22-17)8-25(9)16(27)11-3-2-4-12(18)15(11)19/h2-4,6-7,9H,5,8H2,1H3/t9-/m0/s1
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Janssen Pharmaceutica NV

US Patent


Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


Citation and Details
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM254326
PNG
(US9464084, 228)
Show SMILES C[C@H]1Cc2c(CN1C(=O)c1ccnc(c1F)C(F)(F)F)nnn2-c1ncc(F)cn1
Show InChI InChI=1S/C17H12F5N7O/c1-8-4-12-11(26-27-29(12)16-24-5-9(18)6-25-16)7-28(8)15(30)10-2-3-23-14(13(10)19)17(20,21)22/h2-3,5-6,8H,4,7H2,1H3/t8-/m0/s1
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Janssen Pharmaceutica NV

US Patent


Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


Citation and Details
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM254314
PNG
(US9464084, 212)
Show SMILES C[C@H]1Cc2c(CN1C(=O)c1cccc(c1Cl)C(F)(F)F)nnn2-c1cnccn1
Show InChI InChI=1S/C18H14ClF3N6O/c1-10-7-14-13(25-26-28(14)15-8-23-5-6-24-15)9-27(10)17(29)11-3-2-4-12(16(11)19)18(20,21)22/h2-6,8,10H,7,9H2,1H3/t10-/m0/s1
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Janssen Pharmaceutica NV

US Patent


Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


Citation and Details
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM254312
PNG
(US9464084, 210)
Show SMILES CC1Cc2c(CN1C(=O)c1cccc(c1Cl)C(F)(F)F)nnn2-c1cc[nH]n1
Show InChI InChI=1S/C17H14ClF3N6O/c1-9-7-13-12(23-25-27(13)14-5-6-22-24-14)8-26(9)16(28)10-3-2-4-11(15(10)18)17(19,20)21/h2-6,9H,7-8H2,1H3,(H,22,24)
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Janssen Pharmaceutica NV

US Patent


Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


Citation and Details
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM254402
PNG
(US9464084, 310)
Show SMILES C[C@H]1Cc2c(nnn2-c2ccn[nH]2)[C@@H](C)N1C(=O)c1cccc(c1Cl)C(F)(F)F
Show InChI InChI=1S/C18H16ClF3N6O/c1-9-8-13-16(25-26-28(13)14-6-7-23-24-14)10(2)27(9)17(29)11-4-3-5-12(15(11)19)18(20,21)22/h3-7,9-10H,8H2,1-2H3,(H,23,24)/t9-,10+/m0/s1
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Janssen Pharmaceutica NV

US Patent


Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


Citation and Details
More data for this
Ligand-Target Pair
P2X purinoceptor 7 (P2X7)


(Rattus norvegicus (Rat))
BDBM254276
PNG
(US9464084, 172)
Show SMILES C[C@@H]1N(CCc2c1nnn2-c1ccn(CCF)n1)C(=O)c1cccc(c1Cl)C(F)(F)F
Show InChI InChI=1S/C19H17ClF4N6O/c1-11-17-14(30(27-25-17)15-6-8-28(26-15)10-7-21)5-9-29(11)18(31)12-3-2-4-13(16(12)20)19(22,23)24/h2-4,6,8,11H,5,7,9-10H2,1H3/t11-/m0/s1
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Janssen Pharmaceutica NV

US Patent


Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


Citation and Details
More data for this
Ligand-Target Pair
P2X purinoceptor 7 (P2X7)


(Rattus norvegicus (Rat))
BDBM254266
PNG
(US9464084, 158)
Show SMILES C[C@H]1N(CCc2c1nnn2-c1ncc(F)cn1)C(=O)c1cccc(c1Cl)C(F)(F)F
Show InChI InChI=1S/C18H13ClF4N6O/c1-9-15-13(29(27-26-15)17-24-7-10(20)8-25-17)5-6-28(9)16(30)11-3-2-4-12(14(11)19)18(21,22)23/h2-4,7-9H,5-6H2,1H3/t9-/m1/s1
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Janssen Pharmaceutica NV

US Patent


Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


Citation and Details
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM254320
PNG
(US9464084, 220)
Show SMILES C[C@H]1Cc2c(CN1C(=O)c1cccc(c1F)C(F)(F)F)nnn2-c1ncc(F)cn1
Show InChI InChI=1S/C18H13F5N6O/c1-9-5-14-13(26-27-29(14)17-24-6-10(19)7-25-17)8-28(9)16(30)11-3-2-4-12(15(11)20)18(21,22)23/h2-4,6-7,9H,5,8H2,1H3/t9-/m0/s1
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Janssen Pharmaceutica NV

US Patent


Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


Citation and Details
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM254369
PNG
(US9464084, 276)
Show SMILES Cc1c(cccc1C(F)(F)F)C(=O)N1CCc2c(C1)nnn2-c1cnccn1
Show InChI InChI=1S/C18H15F3N6O/c1-11-12(3-2-4-13(11)18(19,20)21)17(28)26-8-5-15-14(10-26)24-25-27(15)16-9-22-6-7-23-16/h2-4,6-7,9H,5,8,10H2,1H3
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5.80n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


Citation and Details
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM254364
PNG
(US9464084, 271)
Show SMILES C[C@H]1N(CCc2c1nnn2-c1ncccn1)C(=O)c1cccc(c1F)C(F)(F)F
Show InChI InChI=1S/C18H14F4N6O/c1-10-15-13(28(26-25-15)17-23-7-3-8-24-17)6-9-27(10)16(29)11-4-2-5-12(14(11)19)18(20,21)22/h2-5,7-8,10H,6,9H2,1H3/t10-/m1/s1
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5.90n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


Citation and Details
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM254381
PNG
(US9464084, 288)
Show SMILES C[C@H]1Cc2c(CN1C(=O)c1cccc(c1Cl)C(F)(F)F)nnn2-c1ccccc1
Show InChI InChI=1S/C20H16ClF3N4O/c1-12-10-17-16(25-26-28(17)13-6-3-2-4-7-13)11-27(12)19(29)14-8-5-9-15(18(14)21)20(22,23)24/h2-9,12H,10-11H2,1H3/t12-/m0/s1
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5.90n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


Citation and Details
More data for this
Ligand-Target Pair
P2X purinoceptor 7 (P2X7)


(Rattus norvegicus (Rat))
BDBM254190
PNG
(US9464084, 75)
Show SMILES C[C@@H]1N(CCc2c1nnn2-c1cnccn1)C(=O)c1cccc(c1Cl)C(F)(F)F
Show InChI InChI=1S/C18H14ClF3N6O/c1-10-16-13(28(26-25-16)14-9-23-6-7-24-14)5-8-27(10)17(29)11-3-2-4-12(15(11)19)18(20,21)22/h2-4,6-7,9-10H,5,8H2,1H3/t10-/m0/s1
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6.20n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


Citation and Details
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM254376
PNG
(US9464084, 283)
Show SMILES CC1N(CCc2c1nnn2-c1ncccn1)C(=O)c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C17H14Cl2N6O/c1-10-15-14(25(23-22-15)17-20-6-2-7-21-17)5-8-24(10)16(26)12-4-3-11(18)9-13(12)19/h2-4,6-7,9-10H,5,8H2,1H3
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6.30n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


Citation and Details
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM254234
PNG
(US9464084, 119)
Show SMILES C[C@@H]1Cc2c(CN1C(=O)c1cccc(c1Cl)C(F)(F)F)nnn2-c1ccccn1
Show InChI InChI=1S/C19H15ClF3N5O/c1-11-9-15-14(25-26-28(15)16-7-2-3-8-24-16)10-27(11)18(29)12-5-4-6-13(17(12)20)19(21,22)23/h2-8,11H,9-10H2,1H3/t11-/m1/s1
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6.30n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


Citation and Details
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM254235
PNG
(US9464084, 120)
Show SMILES CC1Cc2c(CN1C(=O)c1cccc(Cl)c1Cl)nnn2-c1ccccn1
Show InChI InChI=1S/C18H15Cl2N5O/c1-11-9-15-14(22-23-25(15)16-7-2-3-8-21-16)10-24(11)18(26)12-5-4-6-13(19)17(12)20/h2-8,11H,9-10H2,1H3
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Janssen Pharmaceutica NV

US Patent


Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


Citation and Details
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM254231
PNG
(US9464084, 116)
Show SMILES CC1Cc2c(CN1C(=O)c1cccc(c1Cl)C(F)(F)F)nnn2-c1ccccn1
Show InChI InChI=1S/C19H15ClF3N5O/c1-11-9-15-14(25-26-28(15)16-7-2-3-8-24-16)10-27(11)18(29)12-5-4-6-13(17(12)20)19(21,22)23/h2-8,11H,9-10H2,1H3
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Janssen Pharmaceutica NV

US Patent


Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


Citation and Details
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM254160
PNG
(US9464084, 40)
Show SMILES C[C@H]1N(CCc2c1ncn2-c1ccc(F)cn1)C(=O)c1cccc(c1Cl)C(F)(F)F
Show InChI InChI=1S/C20H15ClF4N4O/c1-11-18-15(29(10-27-18)16-6-5-12(22)9-26-16)7-8-28(11)19(30)13-3-2-4-14(17(13)21)20(23,24)25/h2-6,9-11H,7-8H2,1H3/t11-/m1/s1
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7.10n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


Citation and Details
More data for this
Ligand-Target Pair
P2X purinoceptor 7 (P2X7)


(Rattus norvegicus (Rat))
BDBM254160
PNG
(US9464084, 40)
Show SMILES C[C@H]1N(CCc2c1ncn2-c1ccc(F)cn1)C(=O)c1cccc(c1Cl)C(F)(F)F
Show InChI InChI=1S/C20H15ClF4N4O/c1-11-18-15(29(10-27-18)16-6-5-12(22)9-26-16)7-8-28(11)19(30)13-3-2-4-14(17(13)21)20(23,24)25/h2-6,9-11H,7-8H2,1H3/t11-/m1/s1
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7.80n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


Citation and Details
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM254306
PNG
(US9464084, 203)
Show SMILES CC1Cc2c(CN1C(=O)c1cccc(Cl)c1Cl)nnn2-c1ncc(F)cn1
Show InChI InChI=1S/C17H13Cl2FN6O/c1-9-5-14-13(23-24-26(14)17-21-6-10(20)7-22-17)8-25(9)16(27)11-3-2-4-12(18)15(11)19/h2-4,6-7,9H,5,8H2,1H3
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7.90n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


Citation and Details
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM254291
PNG
(US9464084, 188)
Show SMILES C[C@H]1N(CCc2c1nnn2-c1ncccn1)C(=O)c1cccc(c1C)C(F)(F)F
Show InChI InChI=1S/C19H17F3N6O/c1-11-13(5-3-6-14(11)19(20,21)22)17(29)27-10-7-15-16(12(27)2)25-26-28(15)18-23-8-4-9-24-18/h3-6,8-9,12H,7,10H2,1-2H3/t12-/m1/s1
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7.90n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


Citation and Details
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM254383
PNG
(US9464084, 290)
Show SMILES CC1Cc2c(CN1C(=O)c1cccc(c1Cl)C(F)(F)F)nnn2-c1ccccc1
Show InChI InChI=1S/C20H16ClF3N4O/c1-12-10-17-16(25-26-28(17)13-6-3-2-4-7-13)11-27(12)19(29)14-8-5-9-15(18(14)21)20(22,23)24/h2-9,12H,10-11H2,1H3
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7.90n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


Citation and Details
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM254182
PNG
(US9464084, 67)
Show SMILES Clc1cccc(C(=O)N2CCc3c(C2)nnn3-c2ncccn2)c1Cl
Show InChI InChI=1S/C16H12Cl2N6O/c17-11-4-1-3-10(14(11)18)15(25)23-8-5-13-12(9-23)21-22-24(13)16-19-6-2-7-20-16/h1-4,6-7H,5,8-9H2
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Janssen Pharmaceutica NV

US Patent


Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


Citation and Details
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM254324
PNG
(US9464084, 225)
Show SMILES CC1N(CCc2c1nnn2-c1nccc(C)n1)C(=O)c1cccc(Cl)c1Cl
Show InChI InChI=1S/C18H16Cl2N6O/c1-10-6-8-21-18(22-10)26-14-7-9-25(11(2)16(14)23-24-26)17(27)12-4-3-5-13(19)15(12)20/h3-6,8,11H,7,9H2,1-2H3
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9.10n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


Citation and Details
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM254266
PNG
(US9464084, 158)
Show SMILES C[C@H]1N(CCc2c1nnn2-c1ncc(F)cn1)C(=O)c1cccc(c1Cl)C(F)(F)F
Show InChI InChI=1S/C18H13ClF4N6O/c1-9-15-13(29(27-26-15)17-24-7-10(20)8-25-17)5-6-28(9)16(30)11-3-2-4-12(14(11)19)18(21,22)23/h2-4,7-9H,5-6H2,1H3/t9-/m1/s1
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9.40n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


Citation and Details
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM254317
PNG
(US9464084, 215)
Show SMILES C[C@H]1Cc2c(CN1C(=O)c1ccc(F)c(Cl)c1Cl)nnn2-c1ncc(F)cn1
Show InChI InChI=1S/C17H12Cl2F2N6O/c1-8-4-13-12(24-25-27(13)17-22-5-9(20)6-23-17)7-26(8)16(28)10-2-3-11(21)15(19)14(10)18/h2-3,5-6,8H,4,7H2,1H3/t8-/m0/s1
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Janssen Pharmaceutica NV

US Patent


Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


Citation and Details
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM254310
PNG
(US9464084, 208)
Show SMILES C[C@H]1Cc2c(CN1C(=O)c1cccc(c1C)C(F)(F)F)nnn2-c1ncc(F)cn1
Show InChI InChI=1S/C19H16F4N6O/c1-10-6-16-15(26-27-29(16)18-24-7-12(20)8-25-18)9-28(10)17(30)13-4-3-5-14(11(13)2)19(21,22)23/h3-5,7-8,10H,6,9H2,1-2H3/t10-/m0/s1
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Janssen Pharmaceutica NV

US Patent


Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


Citation and Details
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM254252
PNG
(US9464084, 142)
Show SMILES C[C@@H]1N(CCc2c1nnn2-c1ccccn1)C(=O)c1ccc(F)c(Cl)c1Cl
Show InChI InChI=1S/C18H14Cl2FN5O/c1-10-17-13(26(24-23-17)14-4-2-3-8-22-14)7-9-25(10)18(27)11-5-6-12(21)16(20)15(11)19/h2-6,8,10H,7,9H2,1H3/t10-/m0/s1
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Janssen Pharmaceutica NV

US Patent


Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


Citation and Details
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM254298
PNG
(US9464084, 195)
Show SMILES C[C@@H]1Cc2c(CN1C(=O)c1cccc(Cl)c1Cl)nnn2-c1cc(F)ccn1
Show InChI InChI=1S/C18H14Cl2FN5O/c1-10-7-15-14(23-24-26(15)16-8-11(21)5-6-22-16)9-25(10)18(27)12-3-2-4-13(19)17(12)20/h2-6,8,10H,7,9H2,1H3/t10-/m1/s1
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Janssen Pharmaceutica NV

US Patent


Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


Citation and Details
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM254361
PNG
(US9464084, 267)
Show SMILES CC1Cc2c(CN1C(=O)c1cccc(c1Cl)C(F)(F)F)[nH]nc2-c1ccn[nH]1
Show InChI InChI=1S/C18H13ClF3N5O/c1-9-7-11-14(25-26-16(11)13-5-6-23-24-13)8-27(9)17(28)10-3-2-4-12(15(10)19)18(20,21)22/h2-6,9H,7-8H2,1H3/b16-13+
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Janssen Pharmaceutica NV

US Patent


Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


Citation and Details
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM254390
PNG
(US9464084, 297 | US9464084, 309)
Show SMILES C[C@@H]1Cc2c(nnn2-c2ccn[nH]2)[C@H](C)N1C(=O)c1cccc(c1Cl)C(F)(F)F
Show InChI InChI=1S/C18H16ClF3N6O/c1-9-8-13-16(25-26-28(13)14-6-7-23-24-14)10(2)27(9)17(29)11-4-3-5-12(15(11)19)18(20,21)22/h3-7,9-10H,8H2,1-2H3,(H,23,24)/t9-,10+/m1/s1
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Janssen Pharmaceutica NV

US Patent


Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


Citation and Details
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM254305
PNG
(US9464084, 202)
Show SMILES C[C@H]1Cc2c(CN1C(=O)c1cccc(c1Cl)C(F)(F)F)nnn2-c1ncc(F)cn1
Show InChI InChI=1S/C18H13ClF4N6O/c1-9-5-14-13(26-27-29(14)17-24-6-10(20)7-25-17)8-28(9)16(30)11-3-2-4-12(15(11)19)18(21,22)23/h2-4,6-7,9H,5,8H2,1H3/t9-/m0/s1
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Janssen Pharmaceutica NV

US Patent


Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


Citation and Details
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM254247
PNG
(US9464084, 133)
Show SMILES C[C@H]1N(CCc2c1nnn2-c1cc[nH]n1)C(=O)c1cccc(c1Cl)C(F)(F)F
Show InChI InChI=1S/C17H14ClF3N6O/c1-9-15-12(27(25-24-15)13-5-7-22-23-13)6-8-26(9)16(28)10-3-2-4-11(14(10)18)17(19,20)21/h2-5,7,9H,6,8H2,1H3,(H,22,23)/t9-/m1/s1
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10n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


Citation and Details
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM254236
PNG
(US9464084, 121)
Show SMILES CC1Cc2c(CN1C(=O)c1ccc(F)c(Cl)c1Cl)nnn2-c1ccccn1
Show InChI InChI=1S/C18H14Cl2FN5O/c1-10-8-14-13(23-24-26(14)15-4-2-3-7-22-15)9-25(10)18(27)11-5-6-12(21)17(20)16(11)19/h2-7,10H,8-9H2,1H3
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11.2n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


Citation and Details
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM254372
PNG
(US9464084, 279)
Show SMILES CC1N(CCc2c1nnn2-c1cnccn1)C(=O)c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C17H14Cl2N6O/c1-10-16-14(25(23-22-16)15-9-20-5-6-21-15)4-7-24(10)17(26)12-3-2-11(18)8-13(12)19/h2-3,5-6,8-10H,4,7H2,1H3
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11.5n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


Citation and Details
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM254178
PNG
(US9464084, 63)
Show SMILES FC(F)(F)c1cccc(C(=O)N2CCc3c(C2)nnn3-c2ccccn2)c1Cl
Show InChI InChI=1S/C18H13ClF3N5O/c19-16-11(4-3-5-12(16)18(20,21)22)17(28)26-9-7-14-13(10-26)24-25-27(14)15-6-1-2-8-23-15/h1-6,8H,7,9-10H2
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11.7n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


Citation and Details
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM254185
PNG
(US9464084, 70)
Show SMILES Clc1cccc(C(=O)N2CCc3c(C2)nnn3-c2cnccn2)c1Cl
Show InChI InChI=1S/C16H12Cl2N6O/c17-11-3-1-2-10(15(11)18)16(25)23-7-4-13-12(9-23)21-22-24(13)14-8-19-5-6-20-14/h1-3,5-6,8H,4,7,9H2
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12.6n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
human or rat P2X7-1321 N1 cells were collected and frozen @−80 C. On the day of the experiment, cell membrane preparations were made according...


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