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Compile Data Set for Download or QSAR

Found 40 hits Enz. Inhib. hit(s) with all data for entry = 50041452   
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


(Homo sapiens (Human))
BDBM50410935
PNG
(CHEMBL427223)
Show SMILES Fc1ccc(-c2nnnn2Cc2cccnc2)c(Cl)c1Cl
Show InChI InChI=1S/C13H8Cl2FN5/c14-11-9(3-4-10(16)12(11)15)13-18-19-20-21(13)7-8-2-1-5-17-6-8/h1-6H,7H2
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n/an/a 12.6n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human P2X7 receptor expressed in human 1321N1 cells assessed as inhibition of calcium flux by FLIPR


J Med Chem 49: 3659-66 (2006)


Article DOI: 10.1021/jm051202e
BindingDB Entry DOI: 10.7270/Q2VD70P4
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM50410956
PNG
(CHEMBL437703)
Show SMILES FC(F)(F)c1cccc(-c2nnnn2Cc2cccnc2)c1Cl
Show InChI InChI=1S/C14H9ClF3N5/c15-12-10(4-1-5-11(12)14(16,17)18)13-20-21-22-23(13)8-9-3-2-6-19-7-9/h1-7H,8H2
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n/an/a 12.6n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human P2X7 receptor expressed in human 1321N1 cells assessed as inhibition of calcium flux by FLIPR


J Med Chem 49: 3659-66 (2006)


Article DOI: 10.1021/jm051202e
BindingDB Entry DOI: 10.7270/Q2VD70P4
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM50410949
PNG
(CHEMBL210835)
Show SMILES FC(F)(F)c1cccc(c1Cl)-n1nnnc1Cc1cccnc1
Show InChI InChI=1S/C14H9ClF3N5/c15-13-10(14(16,17)18)4-1-5-11(13)23-12(20-21-22-23)7-9-3-2-6-19-8-9/h1-6,8H,7H2
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n/an/a 12.6n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human P2X7 receptor expressed in human 1321N1 cells assessed as inhibition of calcium flux by FLIPR


J Med Chem 49: 3659-66 (2006)


Article DOI: 10.1021/jm051202e
BindingDB Entry DOI: 10.7270/Q2VD70P4
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM50410957
PNG
(CHEMBL380239)
Show SMILES Cc1ccccc1Cn1nnnc1-c1cccc(Cl)c1Cl
Show InChI InChI=1S/C15H12Cl2N4/c1-10-5-2-3-6-11(10)9-21-15(18-19-20-21)12-7-4-8-13(16)14(12)17/h2-8H,9H2,1H3
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n/an/a 15.8n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human P2X7 receptor expressed in human 1321N1 cells assessed as inhibition of calcium flux by FLIPR


J Med Chem 49: 3659-66 (2006)


Article DOI: 10.1021/jm051202e
BindingDB Entry DOI: 10.7270/Q2VD70P4
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM50410944
PNG
(CHEMBL207370)
Show SMILES Fc1ccc(c(Cl)c1C(F)(F)F)-n1nnnc1Cc1cccnc1
Show InChI InChI=1S/C14H8ClF4N5/c15-13-10(4-3-9(16)12(13)14(17,18)19)24-11(21-22-23-24)6-8-2-1-5-20-7-8/h1-5,7H,6H2
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n/an/a 19.9n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human P2X7 receptor expressed in human 1321N1 cells assessed as inhibition of calcium flux by FLIPR


J Med Chem 49: 3659-66 (2006)


Article DOI: 10.1021/jm051202e
BindingDB Entry DOI: 10.7270/Q2VD70P4
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM50410942
PNG
(CHEMBL207525)
Show SMILES Fc1ccc(c(Cl)c1Cl)-n1nnnc1Cc1cccnc1
Show InChI InChI=1S/C13H8Cl2FN5/c14-12-9(16)3-4-10(13(12)15)21-11(18-19-20-21)6-8-2-1-5-17-7-8/h1-5,7H,6H2
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n/an/a 25.1n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human P2X7 receptor expressed in human 1321N1 cells assessed as inhibition of calcium flux by FLIPR


J Med Chem 49: 3659-66 (2006)


Article DOI: 10.1021/jm051202e
BindingDB Entry DOI: 10.7270/Q2VD70P4
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM50410937
PNG
(CHEMBL380023)
Show SMILES Cc1ncccc1Cn1nnnc1-c1cccc(Cl)c1Cl
Show InChI InChI=1S/C14H11Cl2N5/c1-9-10(4-3-7-17-9)8-21-14(18-19-20-21)11-5-2-6-12(15)13(11)16/h2-7H,8H2,1H3
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n/an/a 31.6n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human P2X7 receptor expressed in human 1321N1 cells assessed as inhibition of calcium flux by FLIPR


J Med Chem 49: 3659-66 (2006)


Article DOI: 10.1021/jm051202e
BindingDB Entry DOI: 10.7270/Q2VD70P4
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM50410952
PNG
(CHEMBL208560)
Show SMILES Clc1cccc(-c2nnnn2Cc2ccccc2)c1Cl
Show InChI InChI=1S/C14H10Cl2N4/c15-12-8-4-7-11(13(12)16)14-17-18-19-20(14)9-10-5-2-1-3-6-10/h1-8H,9H2
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n/an/a 39.8n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human P2X7 receptor expressed in human 1321N1 cells assessed as inhibition of calcium flux by FLIPR


J Med Chem 49: 3659-66 (2006)


Article DOI: 10.1021/jm051202e
BindingDB Entry DOI: 10.7270/Q2VD70P4
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM50410940
PNG
(CHEMBL210144)
Show SMILES Cc1nc(C)c(Cn2nnnc2-c2cccc(Cl)c2Cl)s1
Show InChI InChI=1S/C13H11Cl2N5S/c1-7-11(21-8(2)16-7)6-20-13(17-18-19-20)9-4-3-5-10(14)12(9)15/h3-5H,6H2,1-2H3
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n/an/a 50.1n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human P2X7 receptor expressed in human 1321N1 cells assessed as inhibition of calcium flux by FLIPR


J Med Chem 49: 3659-66 (2006)


Article DOI: 10.1021/jm051202e
BindingDB Entry DOI: 10.7270/Q2VD70P4
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Rattus norvegicus (Rat))
BDBM50410949
PNG
(CHEMBL210835)
Show SMILES FC(F)(F)c1cccc(c1Cl)-n1nnnc1Cc1cccnc1
Show InChI InChI=1S/C14H9ClF3N5/c15-13-10(14(16,17)18)4-1-5-11(13)23-12(20-21-22-23)7-9-3-2-6-19-8-9/h1-6,8H,7H2
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n/an/a 50.1n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at rat P2X7 receptor expressed in human 1321N1 cells assessed as inhibition of calcium flux by FLIPR


J Med Chem 49: 3659-66 (2006)


Article DOI: 10.1021/jm051202e
BindingDB Entry DOI: 10.7270/Q2VD70P4
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM50404091
PNG
(CHEMBL441479)
Show SMILES Clc1cccc(C(=O)NCC23CC4CC(CC(C4)C2)C3)c1Cl |TLB:13:14:18:12.11.17,17:12:19:16.18.15,17:16:19:12.11.13,THB:13:12:18:14.19.15|
Show InChI InChI=1S/C18H21Cl2NO/c19-15-3-1-2-14(16(15)20)17(22)21-10-18-7-11-4-12(8-18)6-13(5-11)9-18/h1-3,11-13H,4-10H2,(H,21,22)
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n/an/a 63.1n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human P2X7 receptor expressed in human 1321N1 cells assessed as inhibition of calcium flux by FLIPR


J Med Chem 49: 3659-66 (2006)


Article DOI: 10.1021/jm051202e
BindingDB Entry DOI: 10.7270/Q2VD70P4
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Rattus norvegicus (Rat))
BDBM50410956
PNG
(CHEMBL437703)
Show SMILES FC(F)(F)c1cccc(-c2nnnn2Cc2cccnc2)c1Cl
Show InChI InChI=1S/C14H9ClF3N5/c15-12-10(4-1-5-11(12)14(16,17)18)13-20-21-22-23(13)8-9-3-2-6-19-7-9/h1-7H,8H2
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n/an/a 63.1n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at rat P2X7 receptor expressed in human 1321N1 cells assessed as inhibition of calcium flux by FLIPR


J Med Chem 49: 3659-66 (2006)


Article DOI: 10.1021/jm051202e
BindingDB Entry DOI: 10.7270/Q2VD70P4
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM50410936
PNG
(CHEMBL208234)
Show SMILES Fc1c(cccc1C(F)(F)F)-c1nnnn1Cc1cccnc1
Show InChI InChI=1S/C14H9F4N5/c15-12-10(4-1-5-11(12)14(16,17)18)13-20-21-22-23(13)8-9-3-2-6-19-7-9/h1-7H,8H2
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n/an/a 63.1n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human P2X7 receptor expressed in human 1321N1 cells assessed as inhibition of calcium flux by FLIPR


J Med Chem 49: 3659-66 (2006)


Article DOI: 10.1021/jm051202e
BindingDB Entry DOI: 10.7270/Q2VD70P4
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Rattus norvegicus (Rat))
BDBM50410957
PNG
(CHEMBL380239)
Show SMILES Cc1ccccc1Cn1nnnc1-c1cccc(Cl)c1Cl
Show InChI InChI=1S/C15H12Cl2N4/c1-10-5-2-3-6-11(10)9-21-15(18-19-20-21)12-7-4-8-13(16)14(12)17/h2-8H,9H2,1H3
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n/an/a 63.1n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at rat P2X7 receptor expressed in human 1321N1 cells assessed as inhibition of calcium flux by FLIPR


J Med Chem 49: 3659-66 (2006)


Article DOI: 10.1021/jm051202e
BindingDB Entry DOI: 10.7270/Q2VD70P4
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Rattus norvegicus (Rat))
BDBM50410952
PNG
(CHEMBL208560)
Show SMILES Clc1cccc(-c2nnnn2Cc2ccccc2)c1Cl
Show InChI InChI=1S/C14H10Cl2N4/c15-12-8-4-7-11(13(12)16)14-17-18-19-20(14)9-10-5-2-1-3-6-10/h1-8H,9H2
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n/an/a 79.4n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at rat P2X7 receptor expressed in human 1321N1 cells assessed as inhibition of calcium flux by FLIPR


J Med Chem 49: 3659-66 (2006)


Article DOI: 10.1021/jm051202e
BindingDB Entry DOI: 10.7270/Q2VD70P4
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Rattus norvegicus (Rat))
BDBM50410936
PNG
(CHEMBL208234)
Show SMILES Fc1c(cccc1C(F)(F)F)-c1nnnn1Cc1cccnc1
Show InChI InChI=1S/C14H9F4N5/c15-12-10(4-1-5-11(12)14(16,17)18)13-20-21-22-23(13)8-9-3-2-6-19-7-9/h1-7H,8H2
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n/an/a 79.4n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at rat P2X7 receptor expressed in human 1321N1 cells assessed as inhibition of calcium flux by FLIPR


J Med Chem 49: 3659-66 (2006)


Article DOI: 10.1021/jm051202e
BindingDB Entry DOI: 10.7270/Q2VD70P4
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Rattus norvegicus (Rat))
BDBM50410942
PNG
(CHEMBL207525)
Show SMILES Fc1ccc(c(Cl)c1Cl)-n1nnnc1Cc1cccnc1
Show InChI InChI=1S/C13H8Cl2FN5/c14-12-9(16)3-4-10(13(12)15)21-11(18-19-20-21)6-8-2-1-5-17-7-8/h1-5,7H,6H2
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at rat P2X7 receptor expressed in human 1321N1 cells assessed as inhibition of calcium flux by FLIPR


J Med Chem 49: 3659-66 (2006)


Article DOI: 10.1021/jm051202e
BindingDB Entry DOI: 10.7270/Q2VD70P4
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM50410943
PNG
(CHEMBL210284)
Show SMILES Clc1cccc(c1Cl)-n1nnnc1Cc1cccnc1
Show InChI InChI=1S/C13H9Cl2N5/c14-10-4-1-5-11(13(10)15)20-12(17-18-19-20)7-9-3-2-6-16-8-9/h1-6,8H,7H2
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human P2X7 receptor expressed in human 1321N1 cells assessed as inhibition of calcium flux by FLIPR


J Med Chem 49: 3659-66 (2006)


Article DOI: 10.1021/jm051202e
BindingDB Entry DOI: 10.7270/Q2VD70P4
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM50410955
PNG
(A-438079 | CHEMBL377219)
Show SMILES Clc1cccc(-c2nnnn2Cc2cccnc2)c1Cl
Show InChI InChI=1S/C13H9Cl2N5/c14-11-5-1-4-10(12(11)15)13-17-18-19-20(13)8-9-3-2-6-16-7-9/h1-7H,8H2
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human P2X7 receptor expressed in human 1321N1 cells assessed as inhibition of calcium flux by FLIPR


J Med Chem 49: 3659-66 (2006)


Article DOI: 10.1021/jm051202e
BindingDB Entry DOI: 10.7270/Q2VD70P4
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM50410961
PNG
(CHEMBL378749)
Show SMILES Cc1noc(C)c1Cn1nnnc1-c1cccc(Cl)c1Cl
Show InChI InChI=1S/C13H11Cl2N5O/c1-7-10(8(2)21-17-7)6-20-13(16-18-19-20)9-4-3-5-11(14)12(9)15/h3-5H,6H2,1-2H3
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human P2X7 receptor expressed in human 1321N1 cells assessed as inhibition of calcium flux by FLIPR


J Med Chem 49: 3659-66 (2006)


Article DOI: 10.1021/jm051202e
BindingDB Entry DOI: 10.7270/Q2VD70P4
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Rattus norvegicus (Rat))
BDBM50410937
PNG
(CHEMBL380023)
Show SMILES Cc1ncccc1Cn1nnnc1-c1cccc(Cl)c1Cl
Show InChI InChI=1S/C14H11Cl2N5/c1-9-10(4-3-7-17-9)8-21-14(18-19-20-21)11-5-2-6-12(15)13(11)16/h2-7H,8H2,1H3
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n/an/a 200n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at rat P2X7 receptor expressed in human 1321N1 cells assessed as inhibition of calcium flux by FLIPR


J Med Chem 49: 3659-66 (2006)


Article DOI: 10.1021/jm051202e
BindingDB Entry DOI: 10.7270/Q2VD70P4
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM50410948
PNG
(CHEMBL210320)
Show SMILES Clc1ccc(-c2nnnn2Cc2cccnc2)c(Cl)c1Cl
Show InChI InChI=1S/C13H8Cl3N5/c14-10-4-3-9(11(15)12(10)16)13-18-19-20-21(13)7-8-2-1-5-17-6-8/h1-6H,7H2
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human P2X7 receptor expressed in human 1321N1 cells assessed as inhibition of calcium flux by FLIPR


J Med Chem 49: 3659-66 (2006)


Article DOI: 10.1021/jm051202e
BindingDB Entry DOI: 10.7270/Q2VD70P4
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM50410950
PNG
(CHEMBL209608)
Show SMILES Cc1ccccc1Cn1nnnc1-c1cccc(C)c1C
Show InChI InChI=1S/C17H18N4/c1-12-8-6-10-16(14(12)3)17-18-19-20-21(17)11-15-9-5-4-7-13(15)2/h4-10H,11H2,1-3H3
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human P2X7 receptor expressed in human 1321N1 cells assessed as inhibition of calcium flux by FLIPR


J Med Chem 49: 3659-66 (2006)


Article DOI: 10.1021/jm051202e
BindingDB Entry DOI: 10.7270/Q2VD70P4
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Rattus norvegicus (Rat))
BDBM50410955
PNG
(A-438079 | CHEMBL377219)
Show SMILES Clc1cccc(-c2nnnn2Cc2cccnc2)c1Cl
Show InChI InChI=1S/C13H9Cl2N5/c14-11-5-1-4-10(12(11)15)13-17-18-19-20(13)8-9-3-2-6-16-7-9/h1-7H,8H2
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at rat P2X7 receptor expressed in human 1321N1 cells assessed as inhibition of calcium flux by FLIPR


J Med Chem 49: 3659-66 (2006)


Article DOI: 10.1021/jm051202e
BindingDB Entry DOI: 10.7270/Q2VD70P4
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM50410958
PNG
(CHEMBL207908)
Show SMILES Clc1cccc(-c2nnnn2Cc2ccccn2)c1Cl
Show InChI InChI=1S/C13H9Cl2N5/c14-11-6-3-5-10(12(11)15)13-17-18-19-20(13)8-9-4-1-2-7-16-9/h1-7H,8H2
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human P2X7 receptor expressed in human 1321N1 cells assessed as inhibition of calcium flux by FLIPR


J Med Chem 49: 3659-66 (2006)


Article DOI: 10.1021/jm051202e
BindingDB Entry DOI: 10.7270/Q2VD70P4
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM50410939
PNG
(CHEMBL206904)
Show SMILES Fc1cccc(-c2nnnn2Cc2cccnc2)c1C(F)(F)F
Show InChI InChI=1S/C14H9F4N5/c15-11-5-1-4-10(12(11)14(16,17)18)13-20-21-22-23(13)8-9-3-2-6-19-7-9/h1-7H,8H2
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human P2X7 receptor expressed in human 1321N1 cells assessed as inhibition of calcium flux by FLIPR


J Med Chem 49: 3659-66 (2006)


Article DOI: 10.1021/jm051202e
BindingDB Entry DOI: 10.7270/Q2VD70P4
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM50410938
PNG
(CHEMBL207909)
Show SMILES Clc1cccc(-c2nnnn2Cc2ccncc2)c1Cl
Show InChI InChI=1S/C13H9Cl2N5/c14-11-3-1-2-10(12(11)15)13-17-18-19-20(13)8-9-4-6-16-7-5-9/h1-7H,8H2
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n/an/a 794n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human P2X7 receptor expressed in human 1321N1 cells assessed as inhibition of calcium flux by FLIPR


J Med Chem 49: 3659-66 (2006)


Article DOI: 10.1021/jm051202e
BindingDB Entry DOI: 10.7270/Q2VD70P4
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Rattus norvegicus (Rat))
BDBM50410940
PNG
(CHEMBL210144)
Show SMILES Cc1nc(C)c(Cn2nnnc2-c2cccc(Cl)c2Cl)s1
Show InChI InChI=1S/C13H11Cl2N5S/c1-7-11(21-8(2)16-7)6-20-13(17-18-19-20)9-4-3-5-10(14)12(9)15/h3-5H,6H2,1-2H3
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at rat P2X7 receptor expressed in human 1321N1 cells assessed as inhibition of calcium flux by FLIPR


J Med Chem 49: 3659-66 (2006)


Article DOI: 10.1021/jm051202e
BindingDB Entry DOI: 10.7270/Q2VD70P4
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Rattus norvegicus (Rat))
BDBM50410938
PNG
(CHEMBL207909)
Show SMILES Clc1cccc(-c2nnnn2Cc2ccncc2)c1Cl
Show InChI InChI=1S/C13H9Cl2N5/c14-11-3-1-2-10(12(11)15)13-17-18-19-20(13)8-9-4-6-16-7-5-9/h1-7H,8H2
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at rat P2X7 receptor expressed in human 1321N1 cells assessed as inhibition of calcium flux by FLIPR


J Med Chem 49: 3659-66 (2006)


Article DOI: 10.1021/jm051202e
BindingDB Entry DOI: 10.7270/Q2VD70P4
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM50410959
PNG
(CHEMBL210272)
Show SMILES COc1cccc(-c2nnnn2Cc2ccccc2Cl)c1OC
Show InChI InChI=1S/C16H15ClN4O2/c1-22-14-9-5-7-12(15(14)23-2)16-18-19-20-21(16)10-11-6-3-4-8-13(11)17/h3-9H,10H2,1-2H3
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human P2X7 receptor expressed in human 1321N1 cells assessed as inhibition of calcium flux by FLIPR


J Med Chem 49: 3659-66 (2006)


Article DOI: 10.1021/jm051202e
BindingDB Entry DOI: 10.7270/Q2VD70P4
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM50410945
PNG
(CHEMBL209607)
Show SMILES Clc1ccc(cc1Cl)-c1nnnn1Cc1cccnc1
Show InChI InChI=1S/C13H9Cl2N5/c14-11-4-3-10(6-12(11)15)13-17-18-19-20(13)8-9-2-1-5-16-7-9/h1-7H,8H2
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human P2X7 receptor expressed in human 1321N1 cells assessed as inhibition of calcium flux by FLIPR


J Med Chem 49: 3659-66 (2006)


Article DOI: 10.1021/jm051202e
BindingDB Entry DOI: 10.7270/Q2VD70P4
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM50410953
PNG
(CHEMBL426137)
Show SMILES Clc1cccc(c1)-c1nnnn1Cc1cccnc1
Show InChI InChI=1S/C13H10ClN5/c14-12-5-1-4-11(7-12)13-16-17-18-19(13)9-10-3-2-6-15-8-10/h1-8H,9H2
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human P2X7 receptor expressed in human 1321N1 cells assessed as inhibition of calcium flux by FLIPR


J Med Chem 49: 3659-66 (2006)


Article DOI: 10.1021/jm051202e
BindingDB Entry DOI: 10.7270/Q2VD70P4
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM50410951
PNG
(CHEMBL377837)
Show SMILES Cc1c(C)c(ccc1N1CCCC1)-c1nnnn1Cc1ccccc1
Show InChI InChI=1S/C20H23N5/c1-15-16(2)19(24-12-6-7-13-24)11-10-18(15)20-21-22-23-25(20)14-17-8-4-3-5-9-17/h3-5,8-11H,6-7,12-14H2,1-2H3
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human P2X7 receptor expressed in human 1321N1 cells assessed as inhibition of calcium flux by FLIPR


J Med Chem 49: 3659-66 (2006)


Article DOI: 10.1021/jm051202e
BindingDB Entry DOI: 10.7270/Q2VD70P4
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM50410960
PNG
(CHEMBL210889)
Show SMILES Clc1cccc(-c2nnnn2CCc2cccnc2)c1Cl
Show InChI InChI=1S/C14H11Cl2N5/c15-12-5-1-4-11(13(12)16)14-18-19-20-21(14)8-6-10-3-2-7-17-9-10/h1-5,7,9H,6,8H2
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human P2X7 receptor expressed in human 1321N1 cells assessed as inhibition of calcium flux by FLIPR


J Med Chem 49: 3659-66 (2006)


Article DOI: 10.1021/jm051202e
BindingDB Entry DOI: 10.7270/Q2VD70P4
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM50410954
PNG
(CHEMBL378928)
Show SMILES Clc1ccccc1-c1nnnn1Cc1cccnc1
Show InChI InChI=1S/C13H10ClN5/c14-12-6-2-1-5-11(12)13-16-17-18-19(13)9-10-4-3-7-15-8-10/h1-8H,9H2
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human P2X7 receptor expressed in human 1321N1 cells assessed as inhibition of calcium flux by FLIPR


J Med Chem 49: 3659-66 (2006)


Article DOI: 10.1021/jm051202e
BindingDB Entry DOI: 10.7270/Q2VD70P4
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM50410934
PNG
(CHEMBL209780)
Show SMILES Clc1ccc(Cl)c(c1)-c1nnnn1Cc1cccnc1
Show InChI InChI=1S/C13H9Cl2N5/c14-10-3-4-12(15)11(6-10)13-17-18-19-20(13)8-9-2-1-5-16-7-9/h1-7H,8H2
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human P2X7 receptor expressed in human 1321N1 cells assessed as inhibition of calcium flux by FLIPR


J Med Chem 49: 3659-66 (2006)


Article DOI: 10.1021/jm051202e
BindingDB Entry DOI: 10.7270/Q2VD70P4
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM50410962
PNG
(CHEMBL210834)
Show SMILES C(c1ccccc1)n1nnnc1-c1cccc2ncccc12
Show InChI InChI=1S/C17H13N5/c1-2-6-13(7-3-1)12-22-17(19-20-21-22)15-8-4-10-16-14(15)9-5-11-18-16/h1-11H,12H2
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human P2X7 receptor expressed in human 1321N1 cells assessed as inhibition of calcium flux by FLIPR


J Med Chem 49: 3659-66 (2006)


Article DOI: 10.1021/jm051202e
BindingDB Entry DOI: 10.7270/Q2VD70P4
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM50410946
PNG
(CHEMBL384209)
Show SMILES C(c1cccnc1)n1nnnc1-c1ccccc1
Show InChI InChI=1S/C13H11N5/c1-2-6-12(7-3-1)13-15-16-17-18(13)10-11-5-4-8-14-9-11/h1-9H,10H2
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n/an/a 2.51E+4n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human P2X7 receptor expressed in human 1321N1 cells assessed as inhibition of calcium flux by FLIPR


J Med Chem 49: 3659-66 (2006)


Article DOI: 10.1021/jm051202e
BindingDB Entry DOI: 10.7270/Q2VD70P4
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM50410947
PNG
(CHEMBL379421)
Show SMILES C(c1ccccc1)n1nnnc1-c1cccc2cccnc12
Show InChI InChI=1S/C17H13N5/c1-2-6-13(7-3-1)12-22-17(19-20-21-22)15-10-4-8-14-9-5-11-18-16(14)15/h1-11H,12H2
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human P2X7 receptor expressed in human 1321N1 cells assessed as inhibition of calcium flux by FLIPR


J Med Chem 49: 3659-66 (2006)


Article DOI: 10.1021/jm051202e
BindingDB Entry DOI: 10.7270/Q2VD70P4
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM50410941
PNG
(CHEMBL210367)
Show SMILES C(c1ccccc1)n1nnnc1-c1ccncc1
Show InChI InChI=1S/C13H11N5/c1-2-4-11(5-3-1)10-18-13(15-16-17-18)12-6-8-14-9-7-12/h1-9H,10H2
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human P2X7 receptor expressed in human 1321N1 cells assessed as inhibition of calcium flux by FLIPR


J Med Chem 49: 3659-66 (2006)


Article DOI: 10.1021/jm051202e
BindingDB Entry DOI: 10.7270/Q2VD70P4
More data for this
Ligand-Target Pair