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Compile Data Set for Download or QSAR

Found 200 hits Enz. Inhib. hit(s) with Target = 'Toll-like receptor 7' AND taxid = 9606   
Target
(Institution)
LigandTarget
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
Toll-like receptor 7


(Homo sapiens)
BDBM50380489
PNG
(CHEMBL2018888)
Show SMILES Nc1nc2ccccc2c2n(Cc3ccccc3)c(CCCc3nc4c(N)nc5ccccc5c4n3Cc3ccccc3)nc12
Show InChI InChI=1S/C37H32N8/c38-36-32-34(26-16-7-9-18-28(26)40-36)44(22-24-12-3-1-4-13-24)30(42-32)20-11-21-31-43-33-35(45(31)23-25-14-5-2-6-15-25)27-17-8-10-19-29(27)41-37(33)39/h1-10,12-19H,11,20-23H2,(H2,38,40)(H2,39,41)
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n/an/a 50n/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Antagonist activity at TLR7 in human PBMC assessed as inhibition of gardiquimod-induced IL-1beta release after 12 hrs by bead array assay


Citation and Details
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens)
BDBM50380489
PNG
(CHEMBL2018888)
Show SMILES Nc1nc2ccccc2c2n(Cc3ccccc3)c(CCCc3nc4c(N)nc5ccccc5c4n3Cc3ccccc3)nc12
Show InChI InChI=1S/C37H32N8/c38-36-32-34(26-16-7-9-18-28(26)40-36)44(22-24-12-3-1-4-13-24)30(42-32)20-11-21-31-43-33-35(45(31)23-25-14-5-2-6-15-25)27-17-8-10-19-29(27)41-37(33)39/h1-10,12-19H,11,20-23H2,(H2,38,40)(H2,39,41)
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n/an/a 50n/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Antagonist activity at TLR7 in human PBMC assessed as inhibition of gardiquimod-induced IL-8 release after 12 hrs by bead array assay


Citation and Details
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens)
BDBM50380489
PNG
(CHEMBL2018888)
Show SMILES Nc1nc2ccccc2c2n(Cc3ccccc3)c(CCCc3nc4c(N)nc5ccccc5c4n3Cc3ccccc3)nc12
Show InChI InChI=1S/C37H32N8/c38-36-32-34(26-16-7-9-18-28(26)40-36)44(22-24-12-3-1-4-13-24)30(42-32)20-11-21-31-43-33-35(45(31)23-25-14-5-2-6-15-25)27-17-8-10-19-29(27)41-37(33)39/h1-10,12-19H,11,20-23H2,(H2,38,40)(H2,39,41)
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n/an/a 50n/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Antagonist activity at TLR7 in human PBMC assessed as inhibition of gardiquimod-induced IL-6 release after 12 hrs by bead array assay


Citation and Details
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens)
BDBM50380489
PNG
(CHEMBL2018888)
Show SMILES Nc1nc2ccccc2c2n(Cc3ccccc3)c(CCCc3nc4c(N)nc5ccccc5c4n3Cc3ccccc3)nc12
Show InChI InChI=1S/C37H32N8/c38-36-32-34(26-16-7-9-18-28(26)40-36)44(22-24-12-3-1-4-13-24)30(42-32)20-11-21-31-43-33-35(45(31)23-25-14-5-2-6-15-25)27-17-8-10-19-29(27)41-37(33)39/h1-10,12-19H,11,20-23H2,(H2,38,40)(H2,39,41)
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n/an/a 50n/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Antagonist activity at TLR7 in human PBMC assessed as inhibition of gardiquimod-induced CCL2 release after 12 hrs by bead array assay


Citation and Details
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens)
BDBM50380489
PNG
(CHEMBL2018888)
Show SMILES Nc1nc2ccccc2c2n(Cc3ccccc3)c(CCCc3nc4c(N)nc5ccccc5c4n3Cc3ccccc3)nc12
Show InChI InChI=1S/C37H32N8/c38-36-32-34(26-16-7-9-18-28(26)40-36)44(22-24-12-3-1-4-13-24)30(42-32)20-11-21-31-43-33-35(45(31)23-25-14-5-2-6-15-25)27-17-8-10-19-29(27)41-37(33)39/h1-10,12-19H,11,20-23H2,(H2,38,40)(H2,39,41)
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n/an/a 50n/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Antagonist activity at TLR7 in human PBMC assessed as inhibition of gardiquimod-induced CXCL10 release after 12 hrs by bead array assay


Citation and Details
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens)
BDBM50380489
PNG
(CHEMBL2018888)
Show SMILES Nc1nc2ccccc2c2n(Cc3ccccc3)c(CCCc3nc4c(N)nc5ccccc5c4n3Cc3ccccc3)nc12
Show InChI InChI=1S/C37H32N8/c38-36-32-34(26-16-7-9-18-28(26)40-36)44(22-24-12-3-1-4-13-24)30(42-32)20-11-21-31-43-33-35(45(31)23-25-14-5-2-6-15-25)27-17-8-10-19-29(27)41-37(33)39/h1-10,12-19H,11,20-23H2,(H2,38,40)(H2,39,41)
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n/an/a 50n/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Antagonist activity at TLR7 in human PBMC assessed as inhibition of gardiquimod-induced TNF-alpha release after 12 hrs by bead array assay


Citation and Details
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens)
BDBM50380495
PNG
(CHEMBL2018887)
Show SMILES CCCCc1nc2c(N)nc3ccccc3c2n1Cc1ccc(CNC(=O)CCCCC(=O)NCc2ccc(Cn3c(CCCC)nc4c(N)nc5ccccc5c34)cc2)cc1
Show InChI InChI=1S/C50H56N10O2/c1-3-5-17-41-57-45-47(37-13-7-9-15-39(37)55-49(45)51)59(41)31-35-25-21-33(22-26-35)29-53-43(61)19-11-12-20-44(62)54-30-34-23-27-36(28-24-34)32-60-42(18-6-4-2)58-46-48(60)38-14-8-10-16-40(38)56-50(46)52/h7-10,13-16,21-28H,3-6,11-12,17-20,29-32H2,1-2H3,(H2,51,55)(H2,52,56)(H,53,61)(H,54,62)
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n/an/a 110n/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Agonist activity at human TLR7 expressed in HEK-Blue cells assessed as increase in NFkappaB activation by sAP reporter gene assay


Citation and Details
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens)
BDBM50380497
PNG
(CHEMBL2018897)
Show SMILES CCCCc1nc2c(N)nc3ccccc3c2n1Cc1ccc(CNC(=O)CCCCCCCCCCC(=O)NCc2ccc(Cn3c(CCCC)nc4c(N)nc5ccccc5c34)cc2)cc1
Show InChI InChI=1S/C56H68N10O2/c1-3-5-23-47-63-51-53(43-19-15-17-21-45(43)61-55(51)57)65(47)37-41-31-27-39(28-32-41)35-59-49(67)25-13-11-9-7-8-10-12-14-26-50(68)60-36-40-29-33-42(34-30-40)38-66-48(24-6-4-2)64-52-54(66)44-20-16-18-22-46(44)62-56(52)58/h15-22,27-34H,3-14,23-26,35-38H2,1-2H3,(H2,57,61)(H2,58,62)(H,59,67)(H,60,68)
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n/an/a 170n/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Agonist activity at human TLR7 expressed in HEK-Blue cells assessed as increase in NFkappaB activation by sAP reporter gene assay


Citation and Details
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens)
BDBM50380496
PNG
(CHEMBL2018896)
Show SMILES CCCCc1nc2c(N)nc3ccccc3c2n1Cc1ccc(CNC(=O)CCCCCCC(=O)NCc2ccc(Cn3c(CCCC)nc4c(N)nc5ccccc5c34)cc2)cc1
Show InChI InChI=1S/C52H60N10O2/c1-3-5-19-43-59-47-49(39-15-11-13-17-41(39)57-51(47)53)61(43)33-37-27-23-35(24-28-37)31-55-45(63)21-9-7-8-10-22-46(64)56-32-36-25-29-38(30-26-36)34-62-44(20-6-4-2)60-48-50(62)40-16-12-14-18-42(40)58-52(48)54/h11-18,23-30H,3-10,19-22,31-34H2,1-2H3,(H2,53,57)(H2,54,58)(H,55,63)(H,56,64)
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n/an/a 240n/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Agonist activity at human TLR7 expressed in HEK-Blue cells assessed as increase in NFkappaB activation by sAP reporter gene assay


Citation and Details
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens)
BDBM50380499
PNG
(CHEMBL2018899)
Show SMILES CCCCc1nc2c(N)nc3ccc(N)cc3c2n1Cc1ccc(CN)cc1
Show InChI InChI=1S/C22H26N6/c1-2-3-4-19-27-20-21(17-11-16(24)9-10-18(17)26-22(20)25)28(19)13-15-7-5-14(12-23)6-8-15/h5-11H,2-4,12-13,23-24H2,1H3,(H2,25,26)
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n/an/a 450n/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Agonist activity at human TLR7 expressed in HEK-Blue cells assessed as increase in NFkappaB activation by sAP reporter gene assay


Citation and Details
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens)
BDBM50380491
PNG
(CHEMBL2018893)
Show SMILES CCCCc1nc2c(NCCCCCCCCNc3nc4ccccc4c4n(Cc5ccccc5)c(CCCC)nc34)nc3ccccc3c2n1Cc1ccccc1
Show InChI InChI=1S/C50H58N8/c1-3-5-31-43-55-45-47(57(43)35-37-23-13-11-14-24-37)39-27-17-19-29-41(39)53-49(45)51-33-21-9-7-8-10-22-34-52-50-46-48(40-28-18-20-30-42(40)54-50)58(44(56-46)32-6-4-2)36-38-25-15-12-16-26-38/h11-20,23-30H,3-10,21-22,31-36H2,1-2H3,(H,51,53)(H,52,54)
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n/an/a 560n/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Agonist activity at human TLR7 expressed in HEK-Blue cells assessed as increase in NFkappaB activation by sAP reporter gene assay


Citation and Details
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens)
BDBM50380498
PNG
(CHEMBL2018898)
Show SMILES CCCCc1nc2c(N)nc3ccc(cc3c2n1Cc1ccc(CN)cc1)[N+]([O-])=O
Show InChI InChI=1S/C22H24N6O2/c1-2-3-4-19-26-20-21(27(19)13-15-7-5-14(12-23)6-8-15)17-11-16(28(29)30)9-10-18(17)25-22(20)24/h5-11H,2-4,12-13,23H2,1H3,(H2,24,25)
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n/an/a 560n/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Agonist activity at human TLR7 expressed in HEK-Blue cells assessed as increase in NFkappaB activation by sAP reporter gene assay


Citation and Details
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens)
BDBM50346937
PNG
(CHEMBL1795710)
Show SMILES COc1ccc(Cn2c(nc3c2c[n+](Cc2ccc(OC)cc2)c2ccccc32)-c2ccccc2)cc1
Show InChI InChI=1S/C32H28N3O2/c1-36-26-16-12-23(13-17-26)20-34-22-30-31(28-10-6-7-11-29(28)34)33-32(25-8-4-3-5-9-25)35(30)21-24-14-18-27(37-2)19-15-24/h3-19,22H,20-21H2,1-2H3/q+1
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n/an/a 820n/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Antagonist activity at TLR7 expressed in HEK293 cells co-transfected with NF-kappaB/sAP gene assessed as inhibition of 250 ug/ml of gardiquimod-induc...


Citation and Details
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens)
BDBM50033102
PNG
(CHEMBL3357070)
Show SMILES OCCN1CCN(CC1)c1ccc(cc1)-c1ncc2CCN(CCCN3CCOCC3)c2n1
Show InChI InChI=1S/C25H36N6O2/c32-17-14-29-10-12-30(13-11-29)23-4-2-21(3-5-23)24-26-20-22-6-9-31(25(22)27-24)8-1-7-28-15-18-33-19-16-28/h2-5,20,32H,1,6-19H2
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n/an/a>970n/an/an/an/an/an/a



Sumitomo Dainippon Pharma Co., Ltd.

Curated by ChEMBL


Assay Description
Antagonist activity at human TLR7 transfected in HEK293 cells assessed as hydrolysis of pNPP after 24 hrs by SEAP reporter assay


Citation and Details
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens)
BDBM50380494
PNG
(CHEMBL2018895)
Show SMILES CCCCc1nc2c(NCCCCCCCCCCCCNc3nc4ccccc4c4n(Cc5ccccc5)c(CCCC)nc34)nc3ccccc3c2n1Cc1ccccc1
Show InChI InChI=1S/C54H66N8/c1-3-5-35-47-59-49-51(61(47)39-41-27-17-15-18-28-41)43-31-21-23-33-45(43)57-53(49)55-37-25-13-11-9-7-8-10-12-14-26-38-56-54-50-52(44-32-22-24-34-46(44)58-54)62(48(60-50)36-6-4-2)40-42-29-19-16-20-30-42/h15-24,27-34H,3-14,25-26,35-40H2,1-2H3,(H,55,57)(H,56,58)
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n/an/a 1.42E+3n/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Agonist activity at human TLR7 expressed in HEK-Blue cells assessed as increase in NFkappaB activation by sAP reporter gene assay


Citation and Details
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens)
BDBM50380490
PNG
(CHEMBL2018892)
Show SMILES CCCCc1nc2c(NCCCCNc3nc4ccccc4c4n(Cc5ccccc5)c(CCCC)nc34)nc3ccccc3c2n1Cc1ccccc1
Show InChI InChI=1S/C46H50N8/c1-3-5-27-39-51-41-43(53(39)31-33-19-9-7-10-20-33)35-23-13-15-25-37(35)49-45(41)47-29-17-18-30-48-46-42-44(36-24-14-16-26-38(36)50-46)54(40(52-42)28-6-4-2)32-34-21-11-8-12-22-34/h7-16,19-26H,3-6,17-18,27-32H2,1-2H3,(H,47,49)(H,48,50)
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n/an/a 2.05E+3n/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Agonist activity at human TLR7 expressed in HEK-Blue cells assessed as increase in NFkappaB activation by sAP reporter gene assay


Citation and Details
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens)
BDBM50346937
PNG
(CHEMBL1795710)
Show SMILES COc1ccc(Cn2c(nc3c2c[n+](Cc2ccc(OC)cc2)c2ccccc32)-c2ccccc2)cc1
Show InChI InChI=1S/C32H28N3O2/c1-36-26-16-12-23(13-17-26)20-34-22-30-31(28-10-6-7-11-29(28)34)33-32(25-8-4-3-5-9-25)35(30)21-24-14-18-27(37-2)19-15-24/h3-19,22H,20-21H2,1-2H3/q+1
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n/an/a 2.79E+3n/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Antagonist activity at TLR7 expressed in HEK293 cells co-transfected with NF-kappaB/sAP gene assessed as inhibition of 1 ug/ml of gardiquimod-induced...


Citation and Details
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens)
BDBM50380493
PNG
(CHEMBL2018894)
Show SMILES CCCCc1nc2c(NCCCCCCCCCCNc3nc4ccccc4c4n(Cc5ccccc5)c(CCCC)nc34)nc3ccccc3c2n1Cc1ccccc1
Show InChI InChI=1S/C52H62N8/c1-3-5-33-45-57-47-49(59(45)37-39-25-15-13-16-26-39)41-29-19-21-31-43(41)55-51(47)53-35-23-11-9-7-8-10-12-24-36-54-52-48-50(42-30-20-22-32-44(42)56-52)60(46(58-48)34-6-4-2)38-40-27-17-14-18-28-40/h13-22,25-32H,3-12,23-24,33-38H2,1-2H3,(H,53,55)(H,54,56)
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n/an/a 3.00E+3n/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Agonist activity at human TLR7 expressed in HEK-Blue cells assessed as increase in NFkappaB activation by sAP reporter gene assay


Citation and Details
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens)
BDBM50380489
PNG
(CHEMBL2018888)
Show SMILES Nc1nc2ccccc2c2n(Cc3ccccc3)c(CCCc3nc4c(N)nc5ccccc5c4n3Cc3ccccc3)nc12
Show InChI InChI=1S/C37H32N8/c38-36-32-34(26-16-7-9-18-28(26)40-36)44(22-24-12-3-1-4-13-24)30(42-32)20-11-21-31-43-33-35(45(31)23-25-14-5-2-6-15-25)27-17-8-10-19-29(27)41-37(33)39/h1-10,12-19H,11,20-23H2,(H2,38,40)(H2,39,41)
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n/an/a 3.10E+3n/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Antagonist activity at human TLR7 expressed in HEK-Blue cells assessed as inhibition of gardiquimod-induced NFkappaB activation by sAP reporter gene ...


Citation and Details
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens)
BDBM50380501
PNG
(CHEMBL2018901)
Show SMILES CCCCc1nc2c(N)nc3ccc(NC(=O)CCCCCCC(=O)Nc4ccc5nc(N)c6nc(CCCC)n(Cc7ccc(CN)cc7)c6c5c4)cc3c2n1Cc1ccc(CN)cc1
Show InChI InChI=1S/C52H62N12O2/c1-3-5-11-43-61-47-49(63(43)31-35-19-15-33(29-53)16-20-35)39-27-37(23-25-41(39)59-51(47)55)57-45(65)13-9-7-8-10-14-46(66)58-38-24-26-42-40(28-38)50-48(52(56)60-42)62-44(12-6-4-2)64(50)32-36-21-17-34(30-54)18-22-36/h15-28H,3-14,29-32,53-54H2,1-2H3,(H2,55,59)(H2,56,60)(H,57,65)(H,58,66)
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n/an/a 4.02E+3n/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Agonist activity at human TLR7 expressed in HEK-Blue cells assessed as increase in NFkappaB activation by sAP reporter gene assay


Citation and Details
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens)
BDBM50346937
PNG
(CHEMBL1795710)
Show SMILES COc1ccc(Cn2c(nc3c2c[n+](Cc2ccc(OC)cc2)c2ccccc32)-c2ccccc2)cc1
Show InChI InChI=1S/C32H28N3O2/c1-36-26-16-12-23(13-17-26)20-34-22-30-31(28-10-6-7-11-29(28)34)33-32(25-8-4-3-5-9-25)35(30)21-24-14-18-27(37-2)19-15-24/h3-19,22H,20-21H2,1-2H3/q+1
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n/an/a 4.55E+3n/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Antagonist activity at TLR8 expressed in HEK293 cells co-transfected with NF-kappaB/sAP gene assessed as inhibition of CL075-induced NF-kappaB activa...


Citation and Details
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens)
BDBM50346934
PNG
(CHEMBL1795707)
Show SMILES CCCCCCCCCc1nc2c(cnc3ccccc23)n1CCCO
Show InChI InChI=1S/C22H31N3O/c1-2-3-4-5-6-7-8-14-21-24-22-18-12-9-10-13-19(18)23-17-20(22)25(21)15-11-16-26/h9-10,12-13,17,26H,2-8,11,14-16H2,1H3
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n/an/a 4.81E+3n/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Antagonist activity at TLR8 expressed in HEK293 cells co-transfected with NF-kappaB/sAP gene assessed as inhibition of CL075-induced NF-kappaB activa...


Citation and Details
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens)
BDBM50380502
PNG
(CHEMBL2018902)
Show SMILES CCCCc1nc2c(N)nc3ccc(NC(=O)CCCCCCCCCCC(=O)Nc4ccc5nc(N)c6nc(CCCC)n(Cc7ccc(CN)cc7)c6c5c4)cc3c2n1Cc1ccc(CN)cc1
Show InChI InChI=1S/C56H70N12O2/c1-3-5-15-47-65-51-53(67(47)35-39-23-19-37(33-57)20-24-39)43-31-41(27-29-45(43)63-55(51)59)61-49(69)17-13-11-9-7-8-10-12-14-18-50(70)62-42-28-30-46-44(32-42)54-52(56(60)64-46)66-48(16-6-4-2)68(54)36-40-25-21-38(34-58)22-26-40/h19-32H,3-18,33-36,57-58H2,1-2H3,(H2,59,63)(H2,60,64)(H,61,69)(H,62,70)
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n/an/a 5.40E+3n/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Agonist activity at human TLR7 expressed in HEK-Blue cells assessed as increase in NFkappaB activation by sAP reporter gene assay


Citation and Details
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens)
BDBM50380500
PNG
(CHEMBL2018900)
Show SMILES CCCCc1nc2c(N)nc3ccc(NC(=O)CCCCC(=O)Nc4ccc5nc(N)c6nc(CCCC)n(Cc7ccc(CN)cc7)c6c5c4)cc3c2n1Cc1ccc(CN)cc1
Show InChI InChI=1S/C50H58N12O2/c1-3-5-9-41-59-45-47(61(41)29-33-17-13-31(27-51)14-18-33)37-25-35(21-23-39(37)57-49(45)53)55-43(63)11-7-8-12-44(64)56-36-22-24-40-38(26-36)48-46(50(54)58-40)60-42(10-6-4-2)62(48)30-34-19-15-32(28-52)16-20-34/h13-26H,3-12,27-30,51-52H2,1-2H3,(H2,53,57)(H2,54,58)(H,55,63)(H,56,64)
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n/an/a 7.24E+3n/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Agonist activity at human TLR7 expressed in HEK-Blue cells assessed as increase in NFkappaB activation by sAP reporter gene assay


Citation and Details
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens)
BDBM50278696
PNG
(1-(2-((ethylamino)methyl)-3H-imidazo[4,5-c]quinoli...)
Show SMILES CCNCc1nc2c(cnc3ccccc23)n1CC(C)(C)O
Show InChI InChI=1S/C17H22N4O/c1-4-18-10-15-20-16-12-7-5-6-8-13(12)19-9-14(16)21(15)11-17(2,3)22/h5-9,18,22H,4,10-11H2,1-3H3
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n/an/a 7.50E+3n/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Antagonist activity at TLR7 (unknown origin) expressed in HEK293 cells by spectrophotometry in presence of 250 ng/mL gardiquimod


Citation and Details
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens)
BDBM50346935
PNG
(CHEMBL1795708)
Show SMILES CCCCCCCCCc1nc2c(cnc3ccccc23)n1CC#C
Show InChI InChI=1S/C22H27N3/c1-3-5-6-7-8-9-10-15-21-24-22-18-13-11-12-14-19(18)23-17-20(22)25(21)16-4-2/h2,11-14,17H,3,5-10,15-16H2,1H3
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n/an/a 8.58E+3n/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Antagonist activity at TLR7 expressed in HEK293 cells co-transfected with NF-kappaB/sAP gene assessed as inhibition of 1 ug/ml of gardiquimod-induced...


Citation and Details
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens)
BDBM50346935
PNG
(CHEMBL1795708)
Show SMILES CCCCCCCCCc1nc2c(cnc3ccccc23)n1CC#C
Show InChI InChI=1S/C22H27N3/c1-3-5-6-7-8-9-10-15-21-24-22-18-13-11-12-14-19(18)23-17-20(22)25(21)16-4-2/h2,11-14,17H,3,5-10,15-16H2,1H3
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n/an/a 1.01E+4n/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Antagonist activity at TLR8 expressed in HEK293 cells co-transfected with NF-kappaB/sAP gene assessed as inhibition of CL075-induced NF-kappaB activa...


Citation and Details
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens)
BDBM50346936
PNG
(CHEMBL1795709)
Show SMILES CCCCCCCCCc1nc2c(cnc3ccccc23)n1C
Show InChI InChI=1S/C20H27N3/c1-3-4-5-6-7-8-9-14-19-22-20-16-12-10-11-13-17(16)21-15-18(20)23(19)2/h10-13,15H,3-9,14H2,1-2H3
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n/an/a 1.01E+4n/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Antagonist activity at TLR7 expressed in HEK293 cells co-transfected with NF-kappaB/sAP gene assessed as inhibition of 1 ug/ml of gardiquimod-induced...


Citation and Details
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens)
BDBM50346940
PNG
(CHEMBL1795698)
Show SMILES C#CCn1c(nc2c1cnc1ccccc21)-c1ccccc1
Show InChI InChI=1S/C19H13N3/c1-2-12-22-17-13-20-16-11-7-6-10-15(16)18(17)21-19(22)14-8-4-3-5-9-14/h1,3-11,13H,12H2
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n/an/a 1.37E+4n/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Antagonist activity at TLR8 expressed in HEK293 cells co-transfected with NF-kappaB/sAP gene assessed as inhibition of CL075-induced NF-kappaB activa...


Citation and Details
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens)
BDBM50346932
PNG
(CHEMBL1795705)
Show SMILES CCCCCCCCCc1nc2c(cnc3ccccc23)n1CC(C)(C)O
Show InChI InChI=1S/C23H33N3O/c1-4-5-6-7-8-9-10-15-21-25-22-18-13-11-12-14-19(18)24-16-20(22)26(21)17-23(2,3)27/h11-14,16,27H,4-10,15,17H2,1-3H3
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n/an/a 1.44E+4n/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Antagonist activity at TLR7 expressed in HEK293 cells co-transfected with NF-kappaB/sAP gene assessed as inhibition of 1 ug/ml of gardiquimod-induced...


Citation and Details
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens)
BDBM50346940
PNG
(CHEMBL1795698)
Show SMILES C#CCn1c(nc2c1cnc1ccccc21)-c1ccccc1
Show InChI InChI=1S/C19H13N3/c1-2-12-22-17-13-20-16-11-7-6-10-15(16)18(17)21-19(22)14-8-4-3-5-9-14/h1,3-11,13H,12H2
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n/an/a 1.49E+4n/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Antagonist activity at TLR7 expressed in HEK293 cells co-transfected with NF-kappaB/sAP gene assessed as inhibition of 1 ug/ml of gardiquimod-induced...


Citation and Details
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens)
BDBM50380504
PNG
(CHEMBL2018891)
Show SMILES Nc1nc2ccccc2c2n(Cc3ccccc3)c(CCCCCCCCCCc3nc4c(N)nc5ccccc5c4n3Cc3ccccc3)nc12
Show InChI InChI=1S/C44H46N8/c45-43-39-41(33-23-15-17-25-35(33)47-43)51(29-31-19-9-7-10-20-31)37(49-39)27-13-5-3-1-2-4-6-14-28-38-50-40-42(52(38)30-32-21-11-8-12-22-32)34-24-16-18-26-36(34)48-44(40)46/h7-12,15-26H,1-6,13-14,27-30H2,(H2,45,47)(H2,46,48)
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n/an/a 1.79E+4n/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Antagonist activity at human TLR7 expressed in HEK-Blue cells assessed as inhibition of gardiquimod-induced NFkappaB activation by sAP reporter gene ...


Citation and Details
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens)
BDBM50346933
PNG
(CHEMBL1795706)
Show SMILES CCCCCCCCCc1nc2c(cnc3ccccc23)n1Cc1ccc(OC)cc1
Show InChI InChI=1S/C27H33N3O/c1-3-4-5-6-7-8-9-14-26-29-27-23-12-10-11-13-24(23)28-19-25(27)30(26)20-21-15-17-22(31-2)18-16-21/h10-13,15-19H,3-9,14,20H2,1-2H3
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n/an/a 1.94E+4n/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Antagonist activity at TLR7 expressed in HEK293 cells co-transfected with NF-kappaB/sAP gene assessed as inhibition of 1 ug/ml of gardiquimod-induced...


Citation and Details
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens)
BDBM50346928
PNG
(CHEMBL1795701)
Show SMILES COc1ccc(Cn2c(nc3c2cnc2ccccc32)C2CCCCC2)cc1
Show InChI InChI=1S/C24H25N3O/c1-28-19-13-11-17(12-14-19)16-27-22-15-25-21-10-6-5-9-20(21)23(22)26-24(27)18-7-3-2-4-8-18/h5-6,9-15,18H,2-4,7-8,16H2,1H3
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n/an/a 1.99E+4n/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Antagonist activity at TLR7 expressed in HEK293 cells co-transfected with NF-kappaB/sAP gene assessed as inhibition of 1 ug/ml of gardiquimod-induced...


Citation and Details
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens)
BDBM50346929
PNG
(CHEMBL1795702)
Show SMILES OCCCn1c(nc2c1cnc1ccccc21)C1CCCCC1
Show InChI InChI=1S/C19H23N3O/c23-12-6-11-22-17-13-20-16-10-5-4-9-15(16)18(17)21-19(22)14-7-2-1-3-8-14/h4-5,9-10,13-14,23H,1-3,6-8,11-12H2
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n/an/a 2.03E+4n/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Antagonist activity at TLR8 expressed in HEK293 cells co-transfected with NF-kappaB/sAP gene assessed as inhibition of CL075-induced NF-kappaB activa...


Citation and Details
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens)
BDBM50346930
PNG
(CHEMBL1795703)
Show SMILES C#CCn1c(nc2c1cnc1ccccc21)C1CCCCC1
Show InChI InChI=1S/C19H19N3/c1-2-12-22-17-13-20-16-11-7-6-10-15(16)18(17)21-19(22)14-8-4-3-5-9-14/h1,6-7,10-11,13-14H,3-5,8-9,12H2
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n/an/a 2.11E+4n/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Antagonist activity at TLR8 expressed in HEK293 cells co-transfected with NF-kappaB/sAP gene assessed as inhibition of CL075-induced NF-kappaB activa...


Citation and Details
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens)
BDBM50346943
PNG
(CHEMBL1795690)
Show SMILES CCNCc1nc2c(c(NC(=O)c3ccccc3)nc3ccccc23)n1CC(C)(C)O
Show InChI InChI=1S/C24H27N5O2/c1-4-25-14-19-27-20-17-12-8-9-13-18(17)26-22(21(20)29(19)15-24(2,3)31)28-23(30)16-10-6-5-7-11-16/h5-13,25,31H,4,14-15H2,1-3H3,(H,26,28,30)
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n/an/a 2.12E+4n/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Antagonist activity at TLR8 expressed in HEK293 cells co-transfected with NF-kappaB/sAP gene assessed as inhibition of CL075-induced NF-kappaB activa...


Citation and Details
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens)
BDBM50346941
PNG
(CHEMBL1795699)
Show SMILES Cn1c(nc2c1cnc1ccccc21)-c1ccccc1
Show InChI InChI=1S/C17H13N3/c1-20-15-11-18-14-10-6-5-9-13(14)16(15)19-17(20)12-7-3-2-4-8-12/h2-11H,1H3
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n/an/a 2.16E+4n/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Antagonist activity at TLR7 expressed in HEK293 cells co-transfected with NF-kappaB/sAP gene assessed as inhibition of 1 ug/ml of gardiquimod-induced...


Citation and Details
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens)
BDBM50346930
PNG
(CHEMBL1795703)
Show SMILES C#CCn1c(nc2c1cnc1ccccc21)C1CCCCC1
Show InChI InChI=1S/C19H19N3/c1-2-12-22-17-13-20-16-11-7-6-10-15(16)18(17)21-19(22)14-8-4-3-5-9-14/h1,6-7,10-11,13-14H,3-5,8-9,12H2
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n/an/a 2.19E+4n/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Antagonist activity at TLR7 expressed in HEK293 cells co-transfected with NF-kappaB/sAP gene assessed as inhibition of 1 ug/ml of gardiquimod-induced...


Citation and Details
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens)
BDBM50346931
PNG
(CHEMBL1795704)
Show SMILES Cn1c(nc2c1cnc1ccccc21)C1CCCCC1
Show InChI InChI=1S/C17H19N3/c1-20-15-11-18-14-10-6-5-9-13(14)16(15)19-17(20)12-7-3-2-4-8-12/h5-6,9-12H,2-4,7-8H2,1H3
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n/an/a 2.20E+4n/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Antagonist activity at TLR7 expressed in HEK293 cells co-transfected with NF-kappaB/sAP gene assessed as inhibition of 1 ug/ml of gardiquimod-induced...


Citation and Details
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens)
BDBM50346931
PNG
(CHEMBL1795704)
Show SMILES Cn1c(nc2c1cnc1ccccc21)C1CCCCC1
Show InChI InChI=1S/C17H19N3/c1-20-15-11-18-14-10-6-5-9-13(14)16(15)19-17(20)12-7-3-2-4-8-12/h5-6,9-12H,2-4,7-8H2,1H3
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n/an/a 2.43E+4n/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Antagonist activity at TLR8 expressed in HEK293 cells co-transfected with NF-kappaB/sAP gene assessed as inhibition of CL075-induced NF-kappaB activa...


Citation and Details
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens)
BDBM50278695
PNG
(1-(4-amino-2-((ethylamino)methyl)-3H-imidazo[4,5-c...)
Show SMILES CCNCc1nc2c(c(N)nc3ccccc23)n1CC(C)(C)O
Show InChI InChI=1S/C17H23N5O/c1-4-19-9-13-21-14-11-7-5-6-8-12(11)20-16(18)15(14)22(13)10-17(2,3)23/h5-8,19,23H,4,9-10H2,1-3H3,(H2,18,20)
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n/an/a 2.50E+4n/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Antagonist activity at TLR7 (unknown origin) expressed in HEK293 cells by spectrophotometry in presence of 250 ng/mL gardiquimod


Citation and Details
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens)
BDBM50346941
PNG
(CHEMBL1795699)
Show SMILES Cn1c(nc2c1cnc1ccccc21)-c1ccccc1
Show InChI InChI=1S/C17H13N3/c1-20-15-11-18-14-10-6-5-9-13(14)16(15)19-17(20)12-7-3-2-4-8-12/h2-11H,1H3
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n/an/a 2.58E+4n/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Antagonist activity at TLR8 expressed in HEK293 cells co-transfected with NF-kappaB/sAP gene assessed as inhibition of CL075-induced NF-kappaB activa...


Citation and Details
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens)
BDBM50346945
PNG
(CHEMBL1795693)
Show SMILES CCNCc1nc2c(cnc3ccccc23)n1CC#C
Show InChI InChI=1S/C16H16N4/c1-3-9-20-14-10-18-13-8-6-5-7-12(13)16(14)19-15(20)11-17-4-2/h1,5-8,10,17H,4,9,11H2,2H3
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n/an/a 2.61E+4n/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Antagonist activity at TLR7 expressed in HEK293 cells co-transfected with NF-kappaB/sAP gene assessed as inhibition of 1 ug/ml of gardiquimod-induced...


Citation and Details
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens)
BDBM50346938
PNG
(CHEMBL1795691)
Show SMILES CCNCc1nc2c(cnc3ccccc23)n1Cc1ccc(OC)cc1
Show InChI InChI=1S/C21H22N4O/c1-3-22-13-20-24-21-17-6-4-5-7-18(17)23-12-19(21)25(20)14-15-8-10-16(26-2)11-9-15/h4-12,22H,3,13-14H2,1-2H3
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n/an/a 2.80E+4n/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Antagonist activity at TLR7 expressed in HEK293 cells co-transfected with NF-kappaB/sAP gene assessed as inhibition of 1 ug/ml of gardiquimod-induced...


Citation and Details
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens)
BDBM50346945
PNG
(CHEMBL1795693)
Show SMILES CCNCc1nc2c(cnc3ccccc23)n1CC#C
Show InChI InChI=1S/C16H16N4/c1-3-9-20-14-10-18-13-8-6-5-7-12(13)16(14)19-15(20)11-17-4-2/h1,5-8,10,17H,4,9,11H2,2H3
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n/an/a 2.81E+4n/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Antagonist activity at TLR8 expressed in HEK293 cells co-transfected with NF-kappaB/sAP gene assessed as inhibition of CL075-induced NF-kappaB activa...


Citation and Details
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens)
BDBM50346939
PNG
(CHEMBL1795694)
Show SMILES CCNCc1nc2c(cnc3ccccc23)n1C
Show InChI InChI=1S/C14H16N4/c1-3-15-9-13-17-14-10-6-4-5-7-11(10)16-8-12(14)18(13)2/h4-8,15H,3,9H2,1-2H3
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n/an/a 3.04E+4n/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Antagonist activity at TLR7 expressed in HEK293 cells co-transfected with NF-kappaB/sAP gene assessed as inhibition of 1 ug/ml of gardiquimod-induced...


Citation and Details
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens)
BDBM50346939
PNG
(CHEMBL1795694)
Show SMILES CCNCc1nc2c(cnc3ccccc23)n1C
Show InChI InChI=1S/C14H16N4/c1-3-15-9-13-17-14-10-6-4-5-7-11(10)16-8-12(14)18(13)2/h4-8,15H,3,9H2,1-2H3
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n/an/a 3.54E+4n/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Antagonist activity at TLR8 expressed in HEK293 cells co-transfected with NF-kappaB/sAP gene assessed as inhibition of CL075-induced NF-kappaB activa...


Citation and Details
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens)
BDBM50346947
PNG
(CHEMBL1795697)
Show SMILES OCCCn1c(nc2c1cnc1ccccc21)-c1ccccc1
Show InChI InChI=1S/C19H17N3O/c23-12-6-11-22-17-13-20-16-10-5-4-9-15(16)18(17)21-19(22)14-7-2-1-3-8-14/h1-5,7-10,13,23H,6,11-12H2
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n/an/a 3.72E+4n/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Antagonist activity at TLR8 expressed in HEK293 cells co-transfected with NF-kappaB/sAP gene assessed as inhibition of CL075-induced NF-kappaB activa...


Citation and Details
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens)
BDBM50346946
PNG
(CHEMBL1795695)
Show SMILES CC(C)(O)Cn1c(nc2c1cnc1ccccc21)-c1ccccc1
Show InChI InChI=1S/C20H19N3O/c1-20(2,24)13-23-17-12-21-16-11-7-6-10-15(16)18(17)22-19(23)14-8-4-3-5-9-14/h3-12,24H,13H2,1-2H3
PDB

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n/an/a 3.84E+4n/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Antagonist activity at TLR8 expressed in HEK293 cells co-transfected with NF-kappaB/sAP gene assessed as inhibition of CL075-induced NF-kappaB activa...


Citation and Details
More data for this
Ligand-Target Pair
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