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Compile Data Set for Download or QSAR

Found 50 hits from Corning Inc.   
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 35


(Homo sapiens)
BDBM50357187
PNG
(CHEMBL1914576)
Show SMILES CC1=C(C#N)C(OC1(C)c1ccc(Cl)c(Cl)c1)=C(C#N)C#N
Show InChI InChI=1S/C16H9Cl2N3O/c1-9-12(8-21)15(10(6-19)7-20)22-16(9,2)11-3-4-13(17)14(18)5-11/h3-5H,1-2H3
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n/an/a 60n/an/an/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human HT-29 cells assessed as desensitization of 1 uM zaprinast-induced DMR after 1 hr by dynamic mass redistribution as...


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens)
BDBM50357192
PNG
(CHEMBL1914588)
Show SMILES Cc1c(sc2c(Br)csc12)C(O)=O
Show InChI InChI=1S/C8H5BrO2S2/c1-3-5-7(4(9)2-12-5)13-6(3)8(10)11/h2H,1H3,(H,10,11)
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n/an/a 110n/an/an/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human HT-29 cells assessed as desensitization of 1 uM zaprinast-induced DMR after 1 hr by dynamic mass redistribution as...


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens)
BDBM50357190
PNG
(CHEMBL1914590)
Show SMILES CCCCCCCCCCCc1c(sc2c(Br)csc12)C(O)=O
Show InChI InChI=1S/C18H25BrO2S2/c1-2-3-4-5-6-7-8-9-10-11-13-15-17(14(19)12-22-15)23-16(13)18(20)21/h12H,2-11H2,1H3,(H,20,21)
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n/an/a 570n/an/an/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human HT-29 cells assessed as desensitization of 1 uM zaprinast-induced DMR after 1 hr by dynamic mass redistribution as...


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens)
BDBM50357191
PNG
(CHEMBL1914589)
Show SMILES CCCCCCCCc1c(sc2c(Br)csc12)C(O)=O
Show InChI InChI=1S/C15H19BrO2S2/c1-2-3-4-5-6-7-8-10-12-14(11(16)9-19-12)20-13(10)15(17)18/h9H,2-8H2,1H3,(H,17,18)
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n/an/a 1.05E+3n/an/an/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human HT-29 cells assessed as desensitization of 1 uM zaprinast-induced DMR after 1 hr by dynamic mass redistribution as...


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens)
BDBM14363
PNG
(3-(2-propoxyphenyl)-2,4,7,8,9-pentazabicyclo[4.3.0...)
Show SMILES CCCOc1ccccc1-c1nc2nn[nH]c2c(=O)[nH]1
Show InChI InChI=1S/C13H13N5O2/c1-2-7-20-9-6-4-3-5-8(9)11-14-12-10(13(19)15-11)16-18-17-12/h3-6H,2,7H2,1H3,(H2,14,15,16,17,18,19)
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n/an/a 1.22E+3n/an/an/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human HT-29 cells assessed as desensitization of 1 uM zaprinast-induced DMR after 1 hr by dynamic mass redistribution as...


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens)
BDBM50357203
PNG
(CHEMBL1914585)
Show SMILES CCCCCCc1c(sc2ccsc12)C(O)=O
Show InChI InChI=1S/C13H16O2S2/c1-2-3-4-5-6-9-11-10(7-8-16-11)17-12(9)13(14)15/h7-8H,2-6H2,1H3,(H,14,15)
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n/an/a 1.49E+3n/an/an/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human HT-29 cells assessed as desensitization of 1 uM zaprinast-induced DMR after 1 hr by dynamic mass redistribution as...


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens)
BDBM50357189
PNG
(CHEMBL1914591)
Show SMILES CCCCCCCCCCCCCc1c(sc2c(Br)csc12)C(O)=O
Show InChI InChI=1S/C20H29BrO2S2/c1-2-3-4-5-6-7-8-9-10-11-12-13-15-17-19(16(21)14-24-17)25-18(15)20(22)23/h14H,2-13H2,1H3,(H,22,23)
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n/an/a 1.87E+3n/an/an/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human HT-29 cells assessed as desensitization of 1 uM zaprinast-induced DMR after 1 hr by dynamic mass redistribution as...


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens)
BDBM50357201
PNG
(CHEMBL1914578)
Show SMILES CC1=C(C#N)C(OC1(c1ccccc1)C(F)(F)F)=C(C#N)C#N
Show InChI InChI=1S/C16H8F3N3O/c1-10-13(9-22)14(11(7-20)8-21)23-15(10,16(17,18)19)12-5-3-2-4-6-12/h2-6H,1H3
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n/an/a 1.94E+3n/an/an/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human HT-29 cells assessed as desensitization of 1 uM zaprinast-induced DMR after 1 hr by dynamic mass redistribution as...


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens)
BDBM50357202
PNG
(CHEMBL1914577)
Show SMILES CC1=C(C#N)C(OC1(C)c1c(F)c(F)c(F)c(F)c1F)=C(C#N)C#N
Show InChI InChI=1S/C16H6F5N3O/c1-6-8(5-24)15(7(3-22)4-23)25-16(6,2)9-10(17)12(19)14(21)13(20)11(9)18/h1-2H3
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n/an/a 4.48E+3n/an/an/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human HT-29 cells assessed as desensitization of 1 uM zaprinast-induced DMR after 1 hr by dynamic mass redistribution as...


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens)
BDBM50357194
PNG
(CHEMBL1914586)
Show SMILES CCCCCCc1csc2cc(sc12)C(O)=O
Show InChI InChI=1S/C13H16O2S2/c1-2-3-4-5-6-9-8-16-10-7-11(13(14)15)17-12(9)10/h7-8H,2-6H2,1H3,(H,14,15)
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n/an/a 4.69E+3n/an/an/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human HT-29 cells assessed as desensitization of 1 uM zaprinast-induced DMR after 1 hr by dynamic mass redistribution as...


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens)
BDBM50357188
PNG
(CHEMBL1914592)
Show SMILES CCCCCCCCCCCCCCCc1c(sc2c(Br)csc12)C(O)=O
Show InChI InChI=1S/C22H33BrO2S2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17-19-21(18(23)16-26-19)27-20(17)22(24)25/h16H,2-15H2,1H3,(H,24,25)
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n/an/a 5.92E+3n/an/an/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human HT-29 cells assessed as desensitization of 1 uM zaprinast-induced DMR after 1 hr by dynamic mass redistribution as...


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens)
BDBM50357193
PNG
(CHEMBL1914587)
Show SMILES Cc1csc2c1sc1cc(sc21)C(O)=O
Show InChI InChI=1S/C10H6O2S3/c1-4-3-13-9-7(4)14-5-2-6(10(11)12)15-8(5)9/h2-3H,1H3,(H,11,12)
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n/an/a 6.07E+3n/an/an/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human HT-29 cells assessed as desensitization of 1 uM zaprinast-induced DMR after 1 hr by dynamic mass redistribution as...


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens)
BDBM50357198
PNG
(CHEMBL1914581)
Show SMILES CCCCc1ccc(cc1)C1(C)OC(=C(C#N)C#N)C(C#N)=C1C
Show InChI InChI=1S/C20H19N3O/c1-4-5-6-15-7-9-17(10-8-15)20(3)14(2)18(13-23)19(24-20)16(11-21)12-22/h7-10H,4-6H2,1-3H3
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n/an/a 6.40E+3n/an/an/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human HT-29 cells assessed as desensitization of 1 uM zaprinast-induced DMR after 1 hr by dynamic mass redistribution as...


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens)
BDBM50357199
PNG
(CHEMBL1914580)
Show SMILES CC1=C(C#N)C(OC1(C)c1ccc(Cl)c(Cl)c1Cl)=C(C#N)C#N
Show InChI InChI=1S/C16H8Cl3N3O/c1-8-10(7-22)15(9(5-20)6-21)23-16(8,2)11-3-4-12(17)14(19)13(11)18/h3-4H,1-2H3
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n/an/a 1.03E+4n/an/an/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human HT-29 cells assessed as desensitization of 1 uM zaprinast-induced DMR after 1 hr by dynamic mass redistribution as...


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens)
BDBM14363
PNG
(3-(2-propoxyphenyl)-2,4,7,8,9-pentazabicyclo[4.3.0...)
Show SMILES CCCOc1ccccc1-c1nc2nn[nH]c2c(=O)[nH]1
Show InChI InChI=1S/C13H13N5O2/c1-2-7-20-9-6-4-3-5-8(9)11-14-12-10(13(19)15-11)16-18-17-12/h3-6H,2,7H2,1H3,(H2,14,15,16,17,18,19)
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n/an/a 1.05E+4n/an/an/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at GPR35 in human HT-29 cells assessed as inhibition of zaprinast-induced DMR by dynamic mass redistribution assay


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens)
BDBM50357195
PNG
(CHEMBL1914584)
Show SMILES CC1=C(C#N)C(OC1(C)C)=C(C#N)C#N
Show InChI InChI=1S/C11H9N3O/c1-7-9(6-14)10(8(4-12)5-13)15-11(7,2)3/h1-3H3
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n/an/a 1.21E+4n/an/an/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human HT-29 cells assessed as desensitization of 1 uM zaprinast-induced DMR after 1 hr by dynamic mass redistribution as...


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens)
BDBM50357197
PNG
(CHEMBL1914582)
Show SMILES CC1=C(C#N)C(OC11CCCCC1)=C(C#N)C#N
Show InChI InChI=1S/C14H13N3O/c1-10-12(9-17)13(11(7-15)8-16)18-14(10)5-3-2-4-6-14/h2-6H2,1H3
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n/an/a 1.64E+4n/an/an/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human HT-29 cells assessed as desensitization of 1 uM zaprinast-induced DMR after 1 hr by dynamic mass redistribution as...


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens)
BDBM50357200
PNG
(CHEMBL1914579)
Show SMILES CC1=C(C#N)C(OC11c2ccccc2-c2ccccc12)=C(C#N)C#N
Show InChI InChI=1S/C21H11N3O/c1-13-17(12-24)20(14(10-22)11-23)25-21(13)18-8-4-2-6-15(18)16-7-3-5-9-19(16)21/h2-9H,1H3
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n/an/a 2.16E+4n/an/an/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human HT-29 cells assessed as desensitization of 1 uM zaprinast-induced DMR after 1 hr by dynamic mass redistribution as...


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens)
BDBM50357196
PNG
(CHEMBL1914583)
Show SMILES CC1=C(C#N)C(OC1(C)c1ccc(F)cc1F)=C(C#N)C#N
Show InChI InChI=1S/C16H9F2N3O/c1-9-12(8-21)15(10(6-19)7-20)22-16(9,2)13-4-3-11(17)5-14(13)18/h3-5H,1-2H3
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n/an/a 4.89E+4n/an/an/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human HT-29 cells assessed as desensitization of 1 uM zaprinast-induced DMR after 1 hr by dynamic mass redistribution as...


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens)
BDBM48329
PNG
(5-thieno[3,2-b]thiophenecarboxylic acid | MLS00003...)
Show SMILES OC(=O)c1cc2sccc2s1
Show InChI InChI=1S/C7H4O2S2/c8-7(9)6-3-5-4(11-6)1-2-10-5/h1-3H,(H,8,9)
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n/an/a 5.70E+4n/an/an/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human HT-29 cells assessed as desensitization of 1 uM zaprinast-induced DMR after 1 hr by dynamic mass redistribution as...


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens)
BDBM50357201
PNG
(CHEMBL1914578)
Show SMILES CC1=C(C#N)C(OC1(c1ccccc1)C(F)(F)F)=C(C#N)C#N
Show InChI InChI=1S/C16H8F3N3O/c1-10-13(9-22)14(11(7-20)8-21)23-15(10,16(17,18)19)12-5-3-2-4-6-12/h2-6H,1H3
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n/an/an/an/a>5.00E+4n/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human U20S cells expressing beta-lactamase and GPR35-GA14-VP16 transcription factor fusion protein assessed as transcrip...


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens)
BDBM50357190
PNG
(CHEMBL1914590)
Show SMILES CCCCCCCCCCCc1c(sc2c(Br)csc12)C(O)=O
Show InChI InChI=1S/C18H25BrO2S2/c1-2-3-4-5-6-7-8-9-10-11-13-15-17(14(19)12-22-15)23-16(13)18(20)21/h12H,2-11H2,1H3,(H,20,21)
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n/an/an/an/a 2.27E+4n/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human U20S cells expressing beta-lactamase and GPR35-GA14-VP16 transcription factor fusion protein assessed as transcrip...


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens)
BDBM50357191
PNG
(CHEMBL1914589)
Show SMILES CCCCCCCCc1c(sc2c(Br)csc12)C(O)=O
Show InChI InChI=1S/C15H19BrO2S2/c1-2-3-4-5-6-7-8-10-12-14(11(16)9-19-12)20-13(10)15(17)18/h9H,2-8H2,1H3,(H,17,18)
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n/an/an/an/a>5.00E+4n/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human U20S cells expressing beta-lactamase and GPR35-GA14-VP16 transcription factor fusion protein assessed as transcrip...


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens)
BDBM50357192
PNG
(CHEMBL1914588)
Show SMILES Cc1c(sc2c(Br)csc12)C(O)=O
Show InChI InChI=1S/C8H5BrO2S2/c1-3-5-7(4(9)2-12-5)13-6(3)8(10)11/h2H,1H3,(H,10,11)
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n/an/an/an/a 1.50E+4n/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human U20S cells expressing beta-lactamase and GPR35-GA14-VP16 transcription factor fusion protein assessed as transcrip...


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens)
BDBM50357193
PNG
(CHEMBL1914587)
Show SMILES Cc1csc2c1sc1cc(sc21)C(O)=O
Show InChI InChI=1S/C10H6O2S3/c1-4-3-13-9-7(4)14-5-2-6(10(11)12)15-8(5)9/h2-3H,1H3,(H,11,12)
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n/an/an/an/a>5.00E+4n/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human U20S cells expressing beta-lactamase and GPR35-GA14-VP16 transcription factor fusion protein assessed as transcrip...


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens)
BDBM50357194
PNG
(CHEMBL1914586)
Show SMILES CCCCCCc1csc2cc(sc12)C(O)=O
Show InChI InChI=1S/C13H16O2S2/c1-2-3-4-5-6-9-8-16-10-7-11(13(14)15)17-12(9)10/h7-8H,2-6H2,1H3,(H,14,15)
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n/an/an/an/a>5.00E+4n/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human U20S cells expressing beta-lactamase and GPR35-GA14-VP16 transcription factor fusion protein assessed as transcrip...


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens)
BDBM50357203
PNG
(CHEMBL1914585)
Show SMILES CCCCCCc1c(sc2ccsc12)C(O)=O
Show InChI InChI=1S/C13H16O2S2/c1-2-3-4-5-6-9-11-10(7-8-16-11)17-12(9)13(14)15/h7-8H,2-6H2,1H3,(H,14,15)
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n/an/an/an/a>5.00E+4n/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human U20S cells expressing beta-lactamase and GPR35-GA14-VP16 transcription factor fusion protein assessed as transcrip...


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens)
BDBM50357195
PNG
(CHEMBL1914584)
Show SMILES CC1=C(C#N)C(OC1(C)C)=C(C#N)C#N
Show InChI InChI=1S/C11H9N3O/c1-7-9(6-14)10(8(4-12)5-13)15-11(7,2)3/h1-3H3
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n/an/an/an/a>5.00E+4n/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human U20S cells expressing beta-lactamase and GPR35-GA14-VP16 transcription factor fusion protein assessed as transcrip...


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens)
BDBM50357197
PNG
(CHEMBL1914582)
Show SMILES CC1=C(C#N)C(OC11CCCCC1)=C(C#N)C#N
Show InChI InChI=1S/C14H13N3O/c1-10-12(9-17)13(11(7-15)8-16)18-14(10)5-3-2-4-6-14/h2-6H2,1H3
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n/an/an/an/a>5.00E+4n/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human U20S cells expressing beta-lactamase and GPR35-GA14-VP16 transcription factor fusion protein assessed as transcrip...


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens)
BDBM14363
PNG
(3-(2-propoxyphenyl)-2,4,7,8,9-pentazabicyclo[4.3.0...)
Show SMILES CCCOc1ccccc1-c1nc2nn[nH]c2c(=O)[nH]1
Show InChI InChI=1S/C13H13N5O2/c1-2-7-20-9-6-4-3-5-8(9)11-14-12-10(13(19)15-11)16-18-17-12/h3-6H,2,7H2,1H3,(H2,14,15,16,17,18,19)
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n/an/an/an/a 160n/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human HT-29 cells after 1 hr by dynamic mass redistribution assay


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens)
BDBM50357187
PNG
(CHEMBL1914576)
Show SMILES CC1=C(C#N)C(OC1(C)c1ccc(Cl)c(Cl)c1)=C(C#N)C#N
Show InChI InChI=1S/C16H9Cl2N3O/c1-9-12(8-21)15(10(6-19)7-20)22-16(9,2)11-3-4-13(17)14(18)5-11/h3-5H,1-2H3
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n/an/an/an/a 32n/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human HT-29 cells after 1 hr by dynamic mass redistribution assay


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens)
BDBM50357202
PNG
(CHEMBL1914577)
Show SMILES CC1=C(C#N)C(OC1(C)c1c(F)c(F)c(F)c(F)c1F)=C(C#N)C#N
Show InChI InChI=1S/C16H6F5N3O/c1-6-8(5-24)15(7(3-22)4-23)25-16(6,2)9-10(17)12(19)14(21)13(20)11(9)18/h1-2H3
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n/an/an/an/a 3.35E+3n/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human HT-29 cells after 1 hr by dynamic mass redistribution assay


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens)
BDBM50357201
PNG
(CHEMBL1914578)
Show SMILES CC1=C(C#N)C(OC1(c1ccccc1)C(F)(F)F)=C(C#N)C#N
Show InChI InChI=1S/C16H8F3N3O/c1-10-13(9-22)14(11(7-20)8-21)23-15(10,16(17,18)19)12-5-3-2-4-6-12/h2-6H,1H3
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n/an/an/an/a 3.50E+3n/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human HT-29 cells after 1 hr by dynamic mass redistribution assay


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens)
BDBM50357200
PNG
(CHEMBL1914579)
Show SMILES CC1=C(C#N)C(OC11c2ccccc2-c2ccccc12)=C(C#N)C#N
Show InChI InChI=1S/C21H11N3O/c1-13-17(12-24)20(14(10-22)11-23)25-21(13)18-8-4-2-6-15(18)16-7-3-5-9-19(16)21/h2-9H,1H3
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n/an/an/an/a 6.60E+3n/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human HT-29 cells after 1 hr by dynamic mass redistribution assay


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens)
BDBM50357199
PNG
(CHEMBL1914580)
Show SMILES CC1=C(C#N)C(OC1(C)c1ccc(Cl)c(Cl)c1Cl)=C(C#N)C#N
Show InChI InChI=1S/C16H8Cl3N3O/c1-8-10(7-22)15(9(5-20)6-21)23-16(8,2)11-3-4-12(17)14(19)13(11)18/h3-4H,1-2H3
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n/an/an/an/a 1.11E+4n/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human HT-29 cells after 1 hr by dynamic mass redistribution assay


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens)
BDBM50357198
PNG
(CHEMBL1914581)
Show SMILES CCCCc1ccc(cc1)C1(C)OC(=C(C#N)C#N)C(C#N)=C1C
Show InChI InChI=1S/C20H19N3O/c1-4-5-6-15-7-9-17(10-8-15)20(3)14(2)18(13-23)19(24-20)16(11-21)12-22/h7-10H,4-6H2,1-3H3
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n/an/an/an/a 1.53E+4n/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human HT-29 cells after 1 hr by dynamic mass redistribution assay


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens)
BDBM50357197
PNG
(CHEMBL1914582)
Show SMILES CC1=C(C#N)C(OC11CCCCC1)=C(C#N)C#N
Show InChI InChI=1S/C14H13N3O/c1-10-12(9-17)13(11(7-15)8-16)18-14(10)5-3-2-4-6-14/h2-6H2,1H3
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n/an/an/an/a 4.59E+4n/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human HT-29 cells after 1 hr by dynamic mass redistribution assay


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens)
BDBM50357196
PNG
(CHEMBL1914583)
Show SMILES CC1=C(C#N)C(OC1(C)c1ccc(F)cc1F)=C(C#N)C#N
Show InChI InChI=1S/C16H9F2N3O/c1-9-12(8-21)15(10(6-19)7-20)22-16(9,2)13-4-3-11(17)5-14(13)18/h3-5H,1-2H3
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n/an/an/an/a 5.39E+4n/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human HT-29 cells after 1 hr by dynamic mass redistribution assay


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens)
BDBM50357195
PNG
(CHEMBL1914584)
Show SMILES CC1=C(C#N)C(OC1(C)C)=C(C#N)C#N
Show InChI InChI=1S/C11H9N3O/c1-7-9(6-14)10(8(4-12)5-13)15-11(7,2)3/h1-3H3
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n/an/an/an/a 1.71E+4n/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human HT-29 cells after 1 hr by dynamic mass redistribution assay


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens)
BDBM50357203
PNG
(CHEMBL1914585)
Show SMILES CCCCCCc1c(sc2ccsc12)C(O)=O
Show InChI InChI=1S/C13H16O2S2/c1-2-3-4-5-6-9-11-10(7-8-16-11)17-12(9)13(14)15/h7-8H,2-6H2,1H3,(H,14,15)
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n/an/an/an/a 3.44E+3n/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human HT-29 cells after 1 hr by dynamic mass redistribution assay


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens)
BDBM50357194
PNG
(CHEMBL1914586)
Show SMILES CCCCCCc1csc2cc(sc12)C(O)=O
Show InChI InChI=1S/C13H16O2S2/c1-2-3-4-5-6-9-8-16-10-7-11(13(14)15)17-12(9)10/h7-8H,2-6H2,1H3,(H,14,15)
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n/an/an/an/a 9.40E+3n/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human HT-29 cells after 1 hr by dynamic mass redistribution assay


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens)
BDBM50357193
PNG
(CHEMBL1914587)
Show SMILES Cc1csc2c1sc1cc(sc21)C(O)=O
Show InChI InChI=1S/C10H6O2S3/c1-4-3-13-9-7(4)14-5-2-6(10(11)12)15-8(5)9/h2-3H,1H3,(H,11,12)
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n/an/an/an/a 6.00E+3n/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human HT-29 cells after 1 hr by dynamic mass redistribution assay


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens)
BDBM50357192
PNG
(CHEMBL1914588)
Show SMILES Cc1c(sc2c(Br)csc12)C(O)=O
Show InChI InChI=1S/C8H5BrO2S2/c1-3-5-7(4(9)2-12-5)13-6(3)8(10)11/h2H,1H3,(H,10,11)
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n/an/an/an/a 64n/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human HT-29 cells after 1 hr by dynamic mass redistribution assay


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens)
BDBM50357191
PNG
(CHEMBL1914589)
Show SMILES CCCCCCCCc1c(sc2c(Br)csc12)C(O)=O
Show InChI InChI=1S/C15H19BrO2S2/c1-2-3-4-5-6-7-8-10-12-14(11(16)9-19-12)20-13(10)15(17)18/h9H,2-8H2,1H3,(H,17,18)
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n/an/an/an/a 1.46E+3n/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human HT-29 cells after 1 hr by dynamic mass redistribution assay


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens)
BDBM50357190
PNG
(CHEMBL1914590)
Show SMILES CCCCCCCCCCCc1c(sc2c(Br)csc12)C(O)=O
Show InChI InChI=1S/C18H25BrO2S2/c1-2-3-4-5-6-7-8-9-10-11-13-15-17(14(19)12-22-15)23-16(13)18(20)21/h12H,2-11H2,1H3,(H,20,21)
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n/an/an/an/a 1.89E+3n/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human HT-29 cells after 1 hr by dynamic mass redistribution assay


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens)
BDBM50357189
PNG
(CHEMBL1914591)
Show SMILES CCCCCCCCCCCCCc1c(sc2c(Br)csc12)C(O)=O
Show InChI InChI=1S/C20H29BrO2S2/c1-2-3-4-5-6-7-8-9-10-11-12-13-15-17-19(16(21)14-24-17)25-18(15)20(22)23/h14H,2-13H2,1H3,(H,22,23)
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n/an/an/an/a 2.31E+3n/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human HT-29 cells after 1 hr by dynamic mass redistribution assay


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens)
BDBM50357188
PNG
(CHEMBL1914592)
Show SMILES CCCCCCCCCCCCCCCc1c(sc2c(Br)csc12)C(O)=O
Show InChI InChI=1S/C22H33BrO2S2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17-19-21(18(23)16-26-19)27-20(17)22(24)25/h16H,2-15H2,1H3,(H,24,25)
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n/an/an/an/a 4.56E+3n/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human HT-29 cells after 1 hr by dynamic mass redistribution assay


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens)
BDBM48329
PNG
(5-thieno[3,2-b]thiophenecarboxylic acid | MLS00003...)
Show SMILES OC(=O)c1cc2sccc2s1
Show InChI InChI=1S/C7H4O2S2/c8-7(9)6-3-5-4(11-6)1-2-10-5/h1-3H,(H,8,9)
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n/an/an/an/a 4.24E+4n/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human HT-29 cells after 1 hr by dynamic mass redistribution assay


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens)
BDBM50357187
PNG
(CHEMBL1914576)
Show SMILES CC1=C(C#N)C(OC1(C)c1ccc(Cl)c(Cl)c1)=C(C#N)C#N
Show InChI InChI=1S/C16H9Cl2N3O/c1-9-12(8-21)15(10(6-19)7-20)22-16(9,2)11-3-4-13(17)14(18)5-11/h3-5H,1-2H3
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n/an/an/an/a 1.02E+4n/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human U20S cells expressing beta-lactamase and GPR35-GA14-VP16 transcription factor fusion protein assessed as transcrip...


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens)
BDBM14363
PNG
(3-(2-propoxyphenyl)-2,4,7,8,9-pentazabicyclo[4.3.0...)
Show SMILES CCCOc1ccccc1-c1nc2nn[nH]c2c(=O)[nH]1
Show InChI InChI=1S/C13H13N5O2/c1-2-7-20-9-6-4-3-5-8(9)11-14-12-10(13(19)15-11)16-18-17-12/h3-6H,2,7H2,1H3,(H2,14,15,16,17,18,19)
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n/an/an/an/a 4.20E+3n/an/an/an/a



Corning Inc.

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human U20S cells expressing beta-lactamase and GPR35-GA14-VP16 transcription factor fusion protein assessed as transcrip...


J Med Chem 54: 7385-96 (2011)


Article DOI: 10.1021/jm200999f
BindingDB Entry DOI: 10.7270/Q2XG9RKZ
More data for this
Ligand-Target Pair