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Compile Data Set for Download or QSAR

Found 8 hits from Atopix Therapeutics Limited   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM102438
PNG
(US8536158, B)
Show SMILES Cc1c(Cc2ccncc2S(=O)(=O)c2ccccc2)c2cc(F)ccc2n1CC(O)=O
Show InChI InChI=1S/C23H19FN2O4S/c1-15-19(20-12-17(24)7-8-21(20)26(15)14-23(27)28)11-16-9-10-25-13-22(16)31(29,30)18-5-3-2-4-6-18/h2-10,12-13H,11,14H2,1H3,(H,27,28)
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US Patent
1n/an/an/an/an/an/an/an/a



Atopix Therapeutics Limited

US Patent


Assay Description
Radioligand binding assay using CRTH2.


US Patent US8536158 (2013)


BindingDB Entry DOI: 10.7270/Q2MK6BH6
More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM102440
PNG
(US8536158, D)
Show SMILES Cc1c(Cc2cccn2S(=O)(=O)c2ccccc2)c2cc(F)ccc2n1CC(O)=O
Show InChI InChI=1S/C22H19FN2O4S/c1-15-19(20-12-16(23)9-10-21(20)24(15)14-22(26)27)13-17-6-5-11-25(17)30(28,29)18-7-3-2-4-8-18/h2-12H,13-14H2,1H3,(H,26,27)
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1n/an/an/an/an/an/an/an/a



Atopix Therapeutics Limited

US Patent


Assay Description
Radioligand binding assay using CRTH2.


US Patent US8536158 (2013)


BindingDB Entry DOI: 10.7270/Q2MK6BH6
More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM102436
PNG
(US8536158, 2)
Show SMILES Cc1c(Cc2cccnc2S(=O)(=O)c2ccc(F)cc2)c2cc(F)ccc2n1CC(O)=O
Show InChI InChI=1S/C23H18F2N2O4S/c1-14-19(20-12-17(25)6-9-21(20)27(14)13-22(28)29)11-15-3-2-10-26-23(15)32(30,31)18-7-4-16(24)5-8-18/h2-10,12H,11,13H2,1H3,(H,28,29)
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2n/an/an/an/an/an/an/an/a



Atopix Therapeutics Limited

US Patent


Assay Description
Radioligand binding assay using CRTH2.


US Patent US8536158 (2013)


BindingDB Entry DOI: 10.7270/Q2MK6BH6
More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM102435
PNG
(US8536158, 1)
Show SMILES Cc1c(Cc2cccnc2S(=O)(=O)c2ccccc2)c2cc(F)ccc2n1CC(O)=O
Show InChI InChI=1S/C23H19FN2O4S/c1-15-19(20-13-17(24)9-10-21(20)26(15)14-22(27)28)12-16-6-5-11-25-23(16)31(29,30)18-7-3-2-4-8-18/h2-11,13H,12,14H2,1H3,(H,27,28)
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2n/an/an/an/an/an/an/an/a



Atopix Therapeutics Limited

US Patent


Assay Description
Radioligand binding assay using CRTH2.


US Patent US8536158 (2013)


BindingDB Entry DOI: 10.7270/Q2MK6BH6
More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM102437
PNG
(US8536158, 3)
Show SMILES Cc1c(Cc2cccnc2S(=O)(=O)c2ccc(Cl)cc2)c2cc(F)ccc2n1CC(O)=O
Show InChI InChI=1S/C23H18ClFN2O4S/c1-14-19(20-12-17(25)6-9-21(20)27(14)13-22(28)29)11-15-3-2-10-26-23(15)32(30,31)18-7-4-16(24)5-8-18/h2-10,12H,11,13H2,1H3,(H,28,29)
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7n/an/an/an/an/an/an/an/a



Atopix Therapeutics Limited

US Patent


Assay Description
Radioligand binding assay using CRTH2.


US Patent US8536158 (2013)


BindingDB Entry DOI: 10.7270/Q2MK6BH6
More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM50397646
PNG
(CHEMBL2181804 | US8536158, A)
Show SMILES Cc1c(Cc2ccc(cc2)S(C)(=O)=O)c2cc(F)ccc2n1CC(O)=O
Show InChI InChI=1S/C19H18FNO4S/c1-12-16(9-13-3-6-15(7-4-13)26(2,24)25)17-10-14(20)5-8-18(17)21(12)11-19(22)23/h3-8,10H,9,11H2,1-2H3,(H,22,23)
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7n/an/an/an/an/an/an/an/a



Atopix Therapeutics Limited

US Patent


Assay Description
Radioligand binding assay using CRTH2.


US Patent US8536158 (2013)


BindingDB Entry DOI: 10.7270/Q2MK6BH6
More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM102441
PNG
(US8536158, E)
Show SMILES Cc1c(Cc2cccnc2)c2cc(F)ccc2n1CC(O)=O
Show InChI InChI=1S/C17H15FN2O2/c1-11-14(7-12-3-2-6-19-9-12)15-8-13(18)4-5-16(15)20(11)10-17(21)22/h2-6,8-9H,7,10H2,1H3,(H,21,22)
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US Patent
258n/an/an/an/an/an/an/an/a



Atopix Therapeutics Limited

US Patent


Assay Description
Radioligand binding assay using CRTH2.


US Patent US8536158 (2013)


BindingDB Entry DOI: 10.7270/Q2MK6BH6
More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM102439
PNG
(US8536158, C)
Show SMILES Cc1c(Cc2ncccc2S(=O)(=O)c2ccccc2)c2cc(F)ccc2n1CC(O)=O
Show InChI InChI=1S/C23H19FN2O4S/c1-15-18(19-12-16(24)9-10-21(19)26(15)14-23(27)28)13-20-22(8-5-11-25-20)31(29,30)17-6-3-2-4-7-17/h2-12H,13-14H2,1H3,(H,27,28)
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US Patent
979n/an/an/an/an/an/an/an/a



Atopix Therapeutics Limited

US Patent


Assay Description
Radioligand binding assay using CRTH2.


US Patent US8536158 (2013)


BindingDB Entry DOI: 10.7270/Q2MK6BH6
More data for this
Ligand-Target Pair