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Compile Data Set for Download or QSAR

Found 80 hits with Last Name = 'sakairi' and Initial = 'm'   
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
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50359369
PNG
(CHEMBL1929390)
Show SMILES Cc1cc2ncc(C(=O)NCC(C)(C)NCC(=O)N3CCC[C@H]3C#N)c(=O)n2[nH]1
Show InChI InChI=1S/C19H25N7O3/c1-12-7-15-21-9-14(18(29)26(15)24-12)17(28)22-11-19(2,3)23-10-16(27)25-6-4-5-13(25)8-20/h7,9,13,23-24H,4-6,10-11H2,1-3H3,(H,22,28)/t13-/m0/s1
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n/an/a 1.80n/an/an/an/an/an/a



Sanwa Kagaku Kenkyusho Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP-4 using H-Gly-Pro-AMC as substrate preincubated for 30 mins before substrate addition measured after 20 mins by f...


Bioorg Med Chem 19: 7221-7 (2011)


Article DOI: 10.1016/j.bmc.2011.09.043
BindingDB Entry DOI: 10.7270/Q2862GVX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50359366
PNG
(CHEMBL1929387 | CHEMBL1929396)
Show SMILES Cc1cc2ncc(cn2n1)C(=O)NCC(C)(C)NCC(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C19H25N7O2/c1-13-7-16-21-9-14(11-26(16)24-13)18(28)22-12-19(2,3)23-10-17(27)25-6-4-5-15(25)8-20/h7,9,11,15,23H,4-6,10,12H2,1-3H3,(H,22,28)/t15-/m0/s1
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n/an/a 3.80n/an/an/an/an/an/a



Sanwa Kagaku Kenkyusho Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP-4 using H-Gly-Pro-AMC as substrate preincubated for 30 mins before substrate addition measured after 20 mins by f...


Bioorg Med Chem 19: 7221-7 (2011)


Article DOI: 10.1016/j.bmc.2011.09.043
BindingDB Entry DOI: 10.7270/Q2862GVX
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50359371
PNG
(CHEMBL1929392)
Show SMILES Cc1c(cnc2cc(nn12)-c1ccccc1)C(=O)NCC(C)(C)NCC(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C25H29N7O2/c1-17-20(14-27-22-12-21(30-32(17)22)18-8-5-4-6-9-18)24(34)28-16-25(2,3)29-15-23(33)31-11-7-10-19(31)13-26/h4-6,8-9,12,14,19,29H,7,10-11,15-16H2,1-3H3,(H,28,34)/t19-/m0/s1
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n/an/a 11n/an/an/an/an/an/a



Sanwa Kagaku Kenkyusho Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP-4 using H-Gly-Pro-AMC as substrate preincubated for 30 mins before substrate addition measured after 20 mins by f...


Bioorg Med Chem 19: 7221-7 (2011)


Article DOI: 10.1016/j.bmc.2011.09.043
BindingDB Entry DOI: 10.7270/Q2862GVX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM50359373
PNG
(CHEMBL1929394)
Show SMILES Cc1nc2cc(nn2c(C)c1C(=O)NCC(C)(C)NCC(=O)N1CCC[C@H]1C#N)-c1ccccc1
Show InChI InChI=1S/C26H31N7O2/c1-17-24(18(2)33-22(30-17)13-21(31-33)19-9-6-5-7-10-19)25(35)28-16-26(3,4)29-15-23(34)32-12-8-11-20(32)14-27/h5-7,9-10,13,20,29H,8,11-12,15-16H2,1-4H3,(H,28,35)/t20-/m0/s1
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n/an/a 12n/an/an/an/an/an/a



Sanwa Kagaku Kenkyusho Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP-8 expressed in Sf9 cells using H-Gly-Pro-AMC as substrate preincubated for 30 mins before substrate addition meas...


Bioorg Med Chem 19: 7221-7 (2011)


Article DOI: 10.1016/j.bmc.2011.09.043
BindingDB Entry DOI: 10.7270/Q2862GVX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50359367
PNG
(CHEMBL1929388)
Show SMILES Cc1cc2ncc(C(=O)NCC(C)(C)NCC(=O)N3CCC[C@H]3C#N)c(C)n2n1
Show InChI InChI=1S/C20H27N7O2/c1-13-8-17-22-10-16(14(2)27(17)25-13)19(29)23-12-20(3,4)24-11-18(28)26-7-5-6-15(26)9-21/h8,10,15,24H,5-7,11-12H2,1-4H3,(H,23,29)/t15-/m0/s1
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n/an/a 13n/an/an/an/an/an/a



Sanwa Kagaku Kenkyusho Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP-4 using H-Gly-Pro-AMC as substrate preincubated for 30 mins before substrate addition measured after 20 mins by f...


Bioorg Med Chem 19: 7221-7 (2011)


Article DOI: 10.1016/j.bmc.2011.09.043
BindingDB Entry DOI: 10.7270/Q2862GVX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50359370
PNG
(CHEMBL1929391)
Show SMILES Cc1c(cnc2cc(nn12)C(C)(C)C)C(=O)NCC(C)(C)NCC(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C23H33N7O2/c1-15-17(12-25-19-10-18(22(2,3)4)28-30(15)19)21(32)26-14-23(5,6)27-13-20(31)29-9-7-8-16(29)11-24/h10,12,16,27H,7-9,13-14H2,1-6H3,(H,26,32)/t16-/m0/s1
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n/an/a 15n/an/an/an/an/an/a



Sanwa Kagaku Kenkyusho Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP-4 using H-Gly-Pro-AMC as substrate preincubated for 30 mins before substrate addition measured after 20 mins by f...


Bioorg Med Chem 19: 7221-7 (2011)


Article DOI: 10.1016/j.bmc.2011.09.043
BindingDB Entry DOI: 10.7270/Q2862GVX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM50359373
PNG
(CHEMBL1929394)
Show SMILES Cc1nc2cc(nn2c(C)c1C(=O)NCC(C)(C)NCC(=O)N1CCC[C@H]1C#N)-c1ccccc1
Show InChI InChI=1S/C26H31N7O2/c1-17-24(18(2)33-22(30-17)13-21(31-33)19-9-6-5-7-10-19)25(35)28-16-26(3,4)29-15-23(34)32-12-8-11-20(32)14-27/h5-7,9-10,13,20,29H,8,11-12,15-16H2,1-4H3,(H,28,35)/t20-/m0/s1
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n/an/a 21n/an/an/an/an/an/a



Sanwa Kagaku Kenkyusho Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP-9 expressed in Sf9 cells using H-Gly-Pro-AMC as substrate preincubated for 30 mins before substrate addition meas...


Bioorg Med Chem 19: 7221-7 (2011)


Article DOI: 10.1016/j.bmc.2011.09.043
BindingDB Entry DOI: 10.7270/Q2862GVX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM50359374
PNG
(CHEMBL1929395)
Show SMILES Cc1cc2nc(C)c(C(=O)NCC(C)(C)NCC(=O)N3CCC[C@H]3C#N)c(C)n2n1
Show InChI InChI=1S/C21H29N7O2/c1-13-9-17-25-14(2)19(15(3)28(17)26-13)20(30)23-12-21(4,5)24-11-18(29)27-8-6-7-16(27)10-22/h9,16,24H,6-8,11-12H2,1-5H3,(H,23,30)/t16-/m0/s1
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n/an/a 28n/an/an/an/an/an/a



Sanwa Kagaku Kenkyusho Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP-9 expressed in Sf9 cells using H-Gly-Pro-AMC as substrate preincubated for 30 mins before substrate addition meas...


Bioorg Med Chem 19: 7221-7 (2011)


Article DOI: 10.1016/j.bmc.2011.09.043
BindingDB Entry DOI: 10.7270/Q2862GVX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50359373
PNG
(CHEMBL1929394)
Show SMILES Cc1nc2cc(nn2c(C)c1C(=O)NCC(C)(C)NCC(=O)N1CCC[C@H]1C#N)-c1ccccc1
Show InChI InChI=1S/C26H31N7O2/c1-17-24(18(2)33-22(30-17)13-21(31-33)19-9-6-5-7-10-19)25(35)28-16-26(3,4)29-15-23(34)32-12-8-11-20(32)14-27/h5-7,9-10,13,20,29H,8,11-12,15-16H2,1-4H3,(H,28,35)/t20-/m0/s1
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n/an/a 28n/an/an/an/an/an/a



Sanwa Kagaku Kenkyusho Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP-4 using H-Gly-Pro-AMC as substrate preincubated for 30 mins before substrate addition measured after 20 mins by f...


Bioorg Med Chem 19: 7221-7 (2011)


Article DOI: 10.1016/j.bmc.2011.09.043
BindingDB Entry DOI: 10.7270/Q2862GVX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM50359371
PNG
(CHEMBL1929392)
Show SMILES Cc1c(cnc2cc(nn12)-c1ccccc1)C(=O)NCC(C)(C)NCC(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C25H29N7O2/c1-17-20(14-27-22-12-21(30-32(17)22)18-8-5-4-6-9-18)24(34)28-16-25(2,3)29-15-23(33)31-11-7-10-19(31)13-26/h4-6,8-9,12,14,19,29H,7,10-11,15-16H2,1-3H3,(H,28,34)/t19-/m0/s1
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n/an/a 30n/an/an/an/an/an/a



Sanwa Kagaku Kenkyusho Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP-9 expressed in Sf9 cells using H-Gly-Pro-AMC as substrate preincubated for 30 mins before substrate addition meas...


Bioorg Med Chem 19: 7221-7 (2011)


Article DOI: 10.1016/j.bmc.2011.09.043
BindingDB Entry DOI: 10.7270/Q2862GVX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50359368
PNG
(CHEMBL1929389)
Show SMILES Cc1cc2ncc(C(=O)NCC(C)(C)NCC(=O)N3CCC[C@H]3C#N)c(n2n1)C(F)(F)F
Show InChI InChI=1S/C20H24F3N7O2/c1-12-7-15-25-9-14(17(20(21,22)23)30(15)28-12)18(32)26-11-19(2,3)27-10-16(31)29-6-4-5-13(29)8-24/h7,9,13,27H,4-6,10-11H2,1-3H3,(H,26,32)/t13-/m0/s1
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n/an/a 32n/an/an/an/an/an/a



Sanwa Kagaku Kenkyusho Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP-4 using H-Gly-Pro-AMC as substrate preincubated for 30 mins before substrate addition measured after 20 mins by f...


Bioorg Med Chem 19: 7221-7 (2011)


Article DOI: 10.1016/j.bmc.2011.09.043
BindingDB Entry DOI: 10.7270/Q2862GVX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM50359371
PNG
(CHEMBL1929392)
Show SMILES Cc1c(cnc2cc(nn12)-c1ccccc1)C(=O)NCC(C)(C)NCC(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C25H29N7O2/c1-17-20(14-27-22-12-21(30-32(17)22)18-8-5-4-6-9-18)24(34)28-16-25(2,3)29-15-23(33)31-11-7-10-19(31)13-26/h4-6,8-9,12,14,19,29H,7,10-11,15-16H2,1-3H3,(H,28,34)/t19-/m0/s1
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n/an/a 43n/an/an/an/an/an/a



Sanwa Kagaku Kenkyusho Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP-8 expressed in Sf9 cells using H-Gly-Pro-AMC as substrate preincubated for 30 mins before substrate addition meas...


Bioorg Med Chem 19: 7221-7 (2011)


Article DOI: 10.1016/j.bmc.2011.09.043
BindingDB Entry DOI: 10.7270/Q2862GVX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM50359369
PNG
(CHEMBL1929390)
Show SMILES Cc1cc2ncc(C(=O)NCC(C)(C)NCC(=O)N3CCC[C@H]3C#N)c(=O)n2[nH]1
Show InChI InChI=1S/C19H25N7O3/c1-12-7-15-21-9-14(18(29)26(15)24-12)17(28)22-11-19(2,3)23-10-16(27)25-6-4-5-13(25)8-20/h7,9,13,23-24H,4-6,10-11H2,1-3H3,(H,22,28)/t13-/m0/s1
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n/an/a 45n/an/an/an/an/an/a



Sanwa Kagaku Kenkyusho Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP-9 expressed in Sf9 cells using H-Gly-Pro-AMC as substrate preincubated for 30 mins before substrate addition meas...


Bioorg Med Chem 19: 7221-7 (2011)


Article DOI: 10.1016/j.bmc.2011.09.043
BindingDB Entry DOI: 10.7270/Q2862GVX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM50359374
PNG
(CHEMBL1929395)
Show SMILES Cc1cc2nc(C)c(C(=O)NCC(C)(C)NCC(=O)N3CCC[C@H]3C#N)c(C)n2n1
Show InChI InChI=1S/C21H29N7O2/c1-13-9-17-25-14(2)19(15(3)28(17)26-13)20(30)23-12-21(4,5)24-11-18(29)27-8-6-7-16(27)10-22/h9,16,24H,6-8,11-12H2,1-5H3,(H,23,30)/t16-/m0/s1
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n/an/a 45n/an/an/an/an/an/a



Sanwa Kagaku Kenkyusho Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP-8 expressed in Sf9 cells using H-Gly-Pro-AMC as substrate preincubated for 30 mins before substrate addition meas...


Bioorg Med Chem 19: 7221-7 (2011)


Article DOI: 10.1016/j.bmc.2011.09.043
BindingDB Entry DOI: 10.7270/Q2862GVX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM50359372
PNG
(CHEMBL1929393)
Show SMILES Cc1nc2cc(nn2c(C)c1C(=O)NCC(C)(C)NCC(=O)N1CCC[C@H]1C#N)C(C)(C)C
Show InChI InChI=1S/C24H35N7O2/c1-15-21(16(2)31-19(28-15)11-18(29-31)23(3,4)5)22(33)26-14-24(6,7)27-13-20(32)30-10-8-9-17(30)12-25/h11,17,27H,8-10,13-14H2,1-7H3,(H,26,33)/t17-/m0/s1
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n/an/a 53n/an/an/an/an/an/a



Sanwa Kagaku Kenkyusho Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP-9 expressed in Sf9 cells using H-Gly-Pro-AMC as substrate preincubated for 30 mins before substrate addition meas...


Bioorg Med Chem 19: 7221-7 (2011)


Article DOI: 10.1016/j.bmc.2011.09.043
BindingDB Entry DOI: 10.7270/Q2862GVX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM50359369
PNG
(CHEMBL1929390)
Show SMILES Cc1cc2ncc(C(=O)NCC(C)(C)NCC(=O)N3CCC[C@H]3C#N)c(=O)n2[nH]1
Show InChI InChI=1S/C19H25N7O3/c1-12-7-15-21-9-14(18(29)26(15)24-12)17(28)22-11-19(2,3)23-10-16(27)25-6-4-5-13(25)8-20/h7,9,13,23-24H,4-6,10-11H2,1-3H3,(H,22,28)/t13-/m0/s1
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n/an/a 58n/an/an/an/an/an/a



Sanwa Kagaku Kenkyusho Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP-8 expressed in Sf9 cells using H-Gly-Pro-AMC as substrate preincubated for 30 mins before substrate addition meas...


Bioorg Med Chem 19: 7221-7 (2011)


Article DOI: 10.1016/j.bmc.2011.09.043
BindingDB Entry DOI: 10.7270/Q2862GVX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM50359366
PNG
(CHEMBL1929387 | CHEMBL1929396)
Show SMILES Cc1cc2ncc(cn2n1)C(=O)NCC(C)(C)NCC(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C19H25N7O2/c1-13-7-16-21-9-14(11-26(16)24-13)18(28)22-12-19(2,3)23-10-17(27)25-6-4-5-15(25)8-20/h7,9,11,15,23H,4-6,10,12H2,1-3H3,(H,22,28)/t15-/m0/s1
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n/an/a 60n/an/an/an/an/an/a



Sanwa Kagaku Kenkyusho Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP-9 expressed in Sf9 cells using H-Gly-Pro-AMC as substrate preincubated for 30 mins before substrate addition meas...


Bioorg Med Chem 19: 7221-7 (2011)


Article DOI: 10.1016/j.bmc.2011.09.043
BindingDB Entry DOI: 10.7270/Q2862GVX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM50359367
PNG
(CHEMBL1929388)
Show SMILES Cc1cc2ncc(C(=O)NCC(C)(C)NCC(=O)N3CCC[C@H]3C#N)c(C)n2n1
Show InChI InChI=1S/C20H27N7O2/c1-13-8-17-22-10-16(14(2)27(17)25-13)19(29)23-12-20(3,4)24-11-18(28)26-7-5-6-15(26)9-21/h8,10,15,24H,5-7,11-12H2,1-4H3,(H,23,29)/t15-/m0/s1
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n/an/a 64n/an/an/an/an/an/a



Sanwa Kagaku Kenkyusho Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP-9 expressed in Sf9 cells using H-Gly-Pro-AMC as substrate preincubated for 30 mins before substrate addition meas...


Bioorg Med Chem 19: 7221-7 (2011)


Article DOI: 10.1016/j.bmc.2011.09.043
BindingDB Entry DOI: 10.7270/Q2862GVX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM50359370
PNG
(CHEMBL1929391)
Show SMILES Cc1c(cnc2cc(nn12)C(C)(C)C)C(=O)NCC(C)(C)NCC(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C23H33N7O2/c1-15-17(12-25-19-10-18(22(2,3)4)28-30(15)19)21(32)26-14-23(5,6)27-13-20(31)29-9-7-8-16(29)11-24/h10,12,16,27H,7-9,13-14H2,1-6H3,(H,26,32)/t16-/m0/s1
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n/an/a 66n/an/an/an/an/an/a



Sanwa Kagaku Kenkyusho Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP-9 expressed in Sf9 cells using H-Gly-Pro-AMC as substrate preincubated for 30 mins before substrate addition meas...


Bioorg Med Chem 19: 7221-7 (2011)


Article DOI: 10.1016/j.bmc.2011.09.043
BindingDB Entry DOI: 10.7270/Q2862GVX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM50359366
PNG
(CHEMBL1929387 | CHEMBL1929396)
Show SMILES Cc1cc2ncc(cn2n1)C(=O)NCC(C)(C)NCC(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C19H25N7O2/c1-13-7-16-21-9-14(11-26(16)24-13)18(28)22-12-19(2,3)23-10-17(27)25-6-4-5-15(25)8-20/h7,9,11,15,23H,4-6,10,12H2,1-3H3,(H,22,28)/t15-/m0/s1
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n/an/a 68n/an/an/an/an/an/a



Sanwa Kagaku Kenkyusho Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP-8 expressed in Sf9 cells using H-Gly-Pro-AMC as substrate preincubated for 30 mins before substrate addition meas...


Bioorg Med Chem 19: 7221-7 (2011)


Article DOI: 10.1016/j.bmc.2011.09.043
BindingDB Entry DOI: 10.7270/Q2862GVX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM50359367
PNG
(CHEMBL1929388)
Show SMILES Cc1cc2ncc(C(=O)NCC(C)(C)NCC(=O)N3CCC[C@H]3C#N)c(C)n2n1
Show InChI InChI=1S/C20H27N7O2/c1-13-8-17-22-10-16(14(2)27(17)25-13)19(29)23-12-20(3,4)24-11-18(28)26-7-5-6-15(26)9-21/h8,10,15,24H,5-7,11-12H2,1-4H3,(H,23,29)/t15-/m0/s1
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n/an/a 76n/an/an/an/an/an/a



Sanwa Kagaku Kenkyusho Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP-8 expressed in Sf9 cells using H-Gly-Pro-AMC as substrate preincubated for 30 mins before substrate addition meas...


Bioorg Med Chem 19: 7221-7 (2011)


Article DOI: 10.1016/j.bmc.2011.09.043
BindingDB Entry DOI: 10.7270/Q2862GVX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50359372
PNG
(CHEMBL1929393)
Show SMILES Cc1nc2cc(nn2c(C)c1C(=O)NCC(C)(C)NCC(=O)N1CCC[C@H]1C#N)C(C)(C)C
Show InChI InChI=1S/C24H35N7O2/c1-15-21(16(2)31-19(28-15)11-18(29-31)23(3,4)5)22(33)26-14-24(6,7)27-13-20(32)30-10-8-9-17(30)12-25/h11,17,27H,8-10,13-14H2,1-7H3,(H,26,33)/t17-/m0/s1
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n/an/a 80n/an/an/an/an/an/a



Sanwa Kagaku Kenkyusho Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP-4 using H-Gly-Pro-AMC as substrate preincubated for 30 mins before substrate addition measured after 20 mins by f...


Bioorg Med Chem 19: 7221-7 (2011)


Article DOI: 10.1016/j.bmc.2011.09.043
BindingDB Entry DOI: 10.7270/Q2862GVX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM50359368
PNG
(CHEMBL1929389)
Show SMILES Cc1cc2ncc(C(=O)NCC(C)(C)NCC(=O)N3CCC[C@H]3C#N)c(n2n1)C(F)(F)F
Show InChI InChI=1S/C20H24F3N7O2/c1-12-7-15-25-9-14(17(20(21,22)23)30(15)28-12)18(32)26-11-19(2,3)27-10-16(31)29-6-4-5-13(29)8-24/h7,9,13,27H,4-6,10-11H2,1-3H3,(H,26,32)/t13-/m0/s1
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n/an/a 81n/an/an/an/an/an/a



Sanwa Kagaku Kenkyusho Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP-9 expressed in Sf9 cells using H-Gly-Pro-AMC as substrate preincubated for 30 mins before substrate addition meas...


Bioorg Med Chem 19: 7221-7 (2011)


Article DOI: 10.1016/j.bmc.2011.09.043
BindingDB Entry DOI: 10.7270/Q2862GVX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM50359368
PNG
(CHEMBL1929389)
Show SMILES Cc1cc2ncc(C(=O)NCC(C)(C)NCC(=O)N3CCC[C@H]3C#N)c(n2n1)C(F)(F)F
Show InChI InChI=1S/C20H24F3N7O2/c1-12-7-15-25-9-14(17(20(21,22)23)30(15)28-12)18(32)26-11-19(2,3)27-10-16(31)29-6-4-5-13(29)8-24/h7,9,13,27H,4-6,10-11H2,1-3H3,(H,26,32)/t13-/m0/s1
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Sanwa Kagaku Kenkyusho Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP-8 expressed in Sf9 cells using H-Gly-Pro-AMC as substrate preincubated for 30 mins before substrate addition meas...


Bioorg Med Chem 19: 7221-7 (2011)


Article DOI: 10.1016/j.bmc.2011.09.043
BindingDB Entry DOI: 10.7270/Q2862GVX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM50359370
PNG
(CHEMBL1929391)
Show SMILES Cc1c(cnc2cc(nn12)C(C)(C)C)C(=O)NCC(C)(C)NCC(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C23H33N7O2/c1-15-17(12-25-19-10-18(22(2,3)4)28-30(15)19)21(32)26-14-23(5,6)27-13-20(31)29-9-7-8-16(29)11-24/h10,12,16,27H,7-9,13-14H2,1-6H3,(H,26,32)/t16-/m0/s1
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Sanwa Kagaku Kenkyusho Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP-8 expressed in Sf9 cells using H-Gly-Pro-AMC as substrate preincubated for 30 mins before substrate addition meas...


Bioorg Med Chem 19: 7221-7 (2011)


Article DOI: 10.1016/j.bmc.2011.09.043
BindingDB Entry DOI: 10.7270/Q2862GVX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM50359372
PNG
(CHEMBL1929393)
Show SMILES Cc1nc2cc(nn2c(C)c1C(=O)NCC(C)(C)NCC(=O)N1CCC[C@H]1C#N)C(C)(C)C
Show InChI InChI=1S/C24H35N7O2/c1-15-21(16(2)31-19(28-15)11-18(29-31)23(3,4)5)22(33)26-14-24(6,7)27-13-20(32)30-10-8-9-17(30)12-25/h11,17,27H,8-10,13-14H2,1-7H3,(H,26,33)/t17-/m0/s1
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Sanwa Kagaku Kenkyusho Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP-8 expressed in Sf9 cells using H-Gly-Pro-AMC as substrate preincubated for 30 mins before substrate addition meas...


Bioorg Med Chem 19: 7221-7 (2011)


Article DOI: 10.1016/j.bmc.2011.09.043
BindingDB Entry DOI: 10.7270/Q2862GVX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50359374
PNG
(CHEMBL1929395)
Show SMILES Cc1cc2nc(C)c(C(=O)NCC(C)(C)NCC(=O)N3CCC[C@H]3C#N)c(C)n2n1
Show InChI InChI=1S/C21H29N7O2/c1-13-9-17-25-14(2)19(15(3)28(17)26-13)20(30)23-12-21(4,5)24-11-18(29)27-8-6-7-16(27)10-22/h9,16,24H,6-8,11-12H2,1-5H3,(H,23,30)/t16-/m0/s1
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n/an/a 110n/an/an/an/an/an/a



Sanwa Kagaku Kenkyusho Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP-4 using H-Gly-Pro-AMC as substrate preincubated for 30 mins before substrate addition measured after 20 mins by f...


Bioorg Med Chem 19: 7221-7 (2011)


Article DOI: 10.1016/j.bmc.2011.09.043
BindingDB Entry DOI: 10.7270/Q2862GVX
More data for this
Ligand-Target Pair
1,3-beta-glucan synthase component GLS2


(Saccharomyces cerevisiae)
BDBM50468576
PNG
(CHEMBL4281494)
Show SMILES Cl.CN(C)CC(=O)N1CCC[C@H]1c1cc(C(=O)Nc2ncc(Cl)s2)c(C)s1
Show InChI InChI=1S/C17H21ClN4O2S2.ClH/c1-10-11(16(24)20-17-19-8-14(18)26-17)7-13(25-10)12-5-4-6-22(12)15(23)9-21(2)3;/h7-8,12H,4-6,9H2,1-3H3,(H,19,20,24);1H/t12-;/m0./s1
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n/an/a<300n/an/an/an/an/an/a



Sanwa Kagaku Kenkyusho Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibition of [3H]-dofetilide binding to human ERG expressed in HEK293 cell membranes after 1 hr by scintillation proximity assay


Eur J Med Chem 156: 269-294 (2018)

More data for this
Ligand-Target Pair
Cytochrome P450 3A


(Homo sapiens (Human))
BDBM50359366
PNG
(CHEMBL1929387 | CHEMBL1929396)
Show SMILES Cc1cc2ncc(cn2n1)C(=O)NCC(C)(C)NCC(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C19H25N7O2/c1-13-7-16-21-9-14(11-26(16)24-13)18(28)22-12-19(2,3)23-10-17(27)25-6-4-5-15(25)8-20/h7,9,11,15,23H,4-6,10,12H2,1-3H3,(H,22,28)/t15-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Sanwa Kagaku Kenkyusho Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of CYP3A4


Bioorg Med Chem 19: 7221-7 (2011)


Article DOI: 10.1016/j.bmc.2011.09.043
BindingDB Entry DOI: 10.7270/Q2862GVX
More data for this
Ligand-Target Pair
Cytochrome P450 2C19


(Homo sapiens (Human))
BDBM50359366
PNG
(CHEMBL1929387 | CHEMBL1929396)
Show SMILES Cc1cc2ncc(cn2n1)C(=O)NCC(C)(C)NCC(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C19H25N7O2/c1-13-7-16-21-9-14(11-26(16)24-13)18(28)22-12-19(2,3)23-10-17(27)25-6-4-5-15(25)8-20/h7,9,11,15,23H,4-6,10,12H2,1-3H3,(H,22,28)/t15-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Sanwa Kagaku Kenkyusho Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of CYP2C19


Bioorg Med Chem 19: 7221-7 (2011)


Article DOI: 10.1016/j.bmc.2011.09.043
BindingDB Entry DOI: 10.7270/Q2862GVX
More data for this
Ligand-Target Pair
Cytochrome P450 2C9


(Homo sapiens (Human))
BDBM50359366
PNG
(CHEMBL1929387 | CHEMBL1929396)
Show SMILES Cc1cc2ncc(cn2n1)C(=O)NCC(C)(C)NCC(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C19H25N7O2/c1-13-7-16-21-9-14(11-26(16)24-13)18(28)22-12-19(2,3)23-10-17(27)25-6-4-5-15(25)8-20/h7,9,11,15,23H,4-6,10,12H2,1-3H3,(H,22,28)/t15-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Sanwa Kagaku Kenkyusho Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of CYP2C9


Bioorg Med Chem 19: 7221-7 (2011)


Article DOI: 10.1016/j.bmc.2011.09.043
BindingDB Entry DOI: 10.7270/Q2862GVX
More data for this
Ligand-Target Pair
Cytochrome P450 1A


(Homo sapiens (Human))
BDBM50359366
PNG
(CHEMBL1929387 | CHEMBL1929396)
Show SMILES Cc1cc2ncc(cn2n1)C(=O)NCC(C)(C)NCC(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C19H25N7O2/c1-13-7-16-21-9-14(11-26(16)24-13)18(28)22-12-19(2,3)23-10-17(27)25-6-4-5-15(25)8-20/h7,9,11,15,23H,4-6,10,12H2,1-3H3,(H,22,28)/t15-/m0/s1
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Sanwa Kagaku Kenkyusho Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of CYP1A2


Bioorg Med Chem 19: 7221-7 (2011)


Article DOI: 10.1016/j.bmc.2011.09.043
BindingDB Entry DOI: 10.7270/Q2862GVX
More data for this
Ligand-Target Pair
Cytochrome P450 2D6 (2D6)


(Homo sapiens (Human))
BDBM50359366
PNG
(CHEMBL1929387 | CHEMBL1929396)
Show SMILES Cc1cc2ncc(cn2n1)C(=O)NCC(C)(C)NCC(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C19H25N7O2/c1-13-7-16-21-9-14(11-26(16)24-13)18(28)22-12-19(2,3)23-10-17(27)25-6-4-5-15(25)8-20/h7,9,11,15,23H,4-6,10,12H2,1-3H3,(H,22,28)/t15-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Sanwa Kagaku Kenkyusho Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of CYP2D6


Bioorg Med Chem 19: 7221-7 (2011)


Article DOI: 10.1016/j.bmc.2011.09.043
BindingDB Entry DOI: 10.7270/Q2862GVX
More data for this
Ligand-Target Pair
Fibroblast activation protein alpha


(Homo sapiens (Human))
BDBM50359366
PNG
(CHEMBL1929387 | CHEMBL1929396)
Show SMILES Cc1cc2ncc(cn2n1)C(=O)NCC(C)(C)NCC(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C19H25N7O2/c1-13-7-16-21-9-14(11-26(16)24-13)18(28)22-12-19(2,3)23-10-17(27)25-6-4-5-15(25)8-20/h7,9,11,15,23H,4-6,10,12H2,1-3H3,(H,22,28)/t15-/m0/s1
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n/an/a 7.27E+4n/an/an/an/an/an/a



Sanwa Kagaku Kenkyusho Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of human recombinant FAP expressed in baculovirus-infected Sf9 insect cells using H-Ala-Pro-AFC as substrate after 60 mins by fluorescence...


Bioorg Med Chem 19: 7221-7 (2011)


Article DOI: 10.1016/j.bmc.2011.09.043
BindingDB Entry DOI: 10.7270/Q2862GVX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM50359366
PNG
(CHEMBL1929387 | CHEMBL1929396)
Show SMILES Cc1cc2ncc(cn2n1)C(=O)NCC(C)(C)NCC(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C19H25N7O2/c1-13-7-16-21-9-14(11-26(16)24-13)18(28)22-12-19(2,3)23-10-17(27)25-6-4-5-15(25)8-20/h7,9,11,15,23H,4-6,10,12H2,1-3H3,(H,22,28)/t15-/m0/s1
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n/an/a 1.77E+5n/an/an/an/an/an/a



Sanwa Kagaku Kenkyusho Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of DPP-2 expressed in human Caco-2 cells using H-Lys-Ala-AMC as substrate preincubated for 30 mins before substrate addition measured afte...


Bioorg Med Chem 19: 7221-7 (2011)


Article DOI: 10.1016/j.bmc.2011.09.043
BindingDB Entry DOI: 10.7270/Q2862GVX
More data for this
Ligand-Target Pair
1,3-beta-glucan synthase component GLS2


(Saccharomyces cerevisiae)
BDBM50468577
PNG
(CHEMBL4283796)
Show SMILES CCN(CC(O)=O)CC(=O)N1CCC[C@H]1c1cc(C(=O)Nc2ncc(F)s2)c(C)s1
Show InChI InChI=1S/C19H23FN4O4S2/c1-3-23(10-17(26)27)9-16(25)24-6-4-5-13(24)14-7-12(11(2)29-14)18(28)22-19-21-8-15(20)30-19/h7-8,13H,3-6,9-10H2,1-2H3,(H,26,27)(H,21,22,28)/t13-/m0/s1
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n/an/a>3.00E+5n/an/an/an/an/an/a



Sanwa Kagaku Kenkyusho Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibition of human ERG expressed in HEK293 cells at -80 holding potential by whole patch clamp assay


Eur J Med Chem 156: 269-294 (2018)

More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50359366
PNG
(CHEMBL1929387 | CHEMBL1929396)
Show SMILES Cc1cc2ncc(cn2n1)C(=O)NCC(C)(C)NCC(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C19H25N7O2/c1-13-7-16-21-9-14(11-26(16)24-13)18(28)22-12-19(2,3)23-10-17(27)25-6-4-5-15(25)8-20/h7,9,11,15,23H,4-6,10,12H2,1-3H3,(H,22,28)/t15-/m0/s1
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n/an/a>5.00E+5n/an/an/an/an/an/a



Sanwa Kagaku Kenkyusho Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of human ERG expressed in HEK293 cells by patch clamp assay


Bioorg Med Chem 19: 7221-7 (2011)


Article DOI: 10.1016/j.bmc.2011.09.043
BindingDB Entry DOI: 10.7270/Q2862GVX
More data for this
Ligand-Target Pair
Glucose-dependent insulinotropic receptor


(Mus musculus)
BDBM50387889
PNG
(CHEMBL2058666)
Show SMILES CCc1cnc(nc1)N1CCC(CCCNc2ccc3c(O)coc3c2)CC1
Show InChI InChI=1S/C22H28N4O2/c1-2-16-13-24-22(25-14-16)26-10-7-17(8-11-26)4-3-9-23-18-5-6-19-20(27)15-28-21(19)12-18/h5-6,12-15,17,23,27H,2-4,7-11H2,1H3
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n/an/an/an/a 159n/an/an/an/a



Sanwa Kagaku Kenkyusho Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at mouse GPR119 receptor expressed in CHO-K1 cells assessed as cAMP accumulation after 30 mins by HTRF assay


Bioorg Med Chem Lett 22: 5123-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.05.117
BindingDB Entry DOI: 10.7270/Q2TD9ZC4
More data for this
Ligand-Target Pair
G-protein coupled receptor 119 (GPR119)


(Homo sapiens (Human))
BDBM50387890
PNG
(CHEMBL2058388)
Show SMILES CC(C)(C)OC(=O)N1CCC(CCCC(=O)Nc2ccc3c(CCS3(=O)=O)c2)CC1
Show InChI InChI=1S/C22H32N2O5S/c1-22(2,3)29-21(26)24-12-9-16(10-13-24)5-4-6-20(25)23-18-7-8-19-17(15-18)11-14-30(19,27)28/h7-8,15-16H,4-6,9-14H2,1-3H3,(H,23,25)
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n/an/an/an/a 2.61E+3n/an/an/an/a



Sanwa Kagaku Kenkyusho Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR119 receptor expressed in CHO-K1 cells assessed as cAMP accumulation after 30 mins by HTRF assay


Bioorg Med Chem Lett 22: 5123-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.05.117
BindingDB Entry DOI: 10.7270/Q2TD9ZC4
More data for this
Ligand-Target Pair
G-protein coupled receptor 119 (GPR119)


(Homo sapiens (Human))
BDBM50387891
PNG
(CHEMBL2058389)
Show SMILES CC(C)(C)OC(=O)N1CCC(CCCCNc2ccc3c(CCS3(=O)=O)c2)CC1
Show InChI InChI=1S/C22H34N2O4S/c1-22(2,3)28-21(25)24-13-9-17(10-14-24)6-4-5-12-23-19-7-8-20-18(16-19)11-15-29(20,26)27/h7-8,16-17,23H,4-6,9-15H2,1-3H3
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n/an/an/an/a 210n/an/an/an/a



Sanwa Kagaku Kenkyusho Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR119 receptor expressed in CHO-K1 cells assessed as cAMP accumulation after 30 mins by HTRF assay


Bioorg Med Chem Lett 22: 5123-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.05.117
BindingDB Entry DOI: 10.7270/Q2TD9ZC4
More data for this
Ligand-Target Pair
G-protein coupled receptor 119 (GPR119)


(Homo sapiens (Human))
BDBM50387892
PNG
(CHEMBL2058390)
Show SMILES CC(C)(C)OC(=O)N1CCC(CCCCCNc2ccc3c(CCS3(=O)=O)c2)CC1
Show InChI InChI=1S/C23H36N2O4S/c1-23(2,3)29-22(26)25-14-10-18(11-15-25)7-5-4-6-13-24-20-8-9-21-19(17-20)12-16-30(21,27)28/h8-9,17-18,24H,4-7,10-16H2,1-3H3
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n/an/an/an/a 145n/an/an/an/a



Sanwa Kagaku Kenkyusho Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR119 receptor expressed in CHO-K1 cells assessed as cAMP accumulation after 30 mins by HTRF assay


Bioorg Med Chem Lett 22: 5123-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.05.117
BindingDB Entry DOI: 10.7270/Q2TD9ZC4
More data for this
Ligand-Target Pair
G-protein coupled receptor 119 (GPR119)


(Homo sapiens (Human))
BDBM50387893
PNG
(CHEMBL2058391)
Show SMILES CC(C)(C)OC(=O)N1CCC(CCCNc2ccc3c(CCS3(=O)=O)c2)CC1
Show InChI InChI=1S/C21H32N2O4S/c1-21(2,3)27-20(24)23-12-8-16(9-13-23)5-4-11-22-18-6-7-19-17(15-18)10-14-28(19,25)26/h6-7,15-16,22H,4-5,8-14H2,1-3H3
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n/an/an/an/a 270n/an/an/an/a



Sanwa Kagaku Kenkyusho Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR119 receptor expressed in CHO-K1 cells assessed as cAMP accumulation after 30 mins by HTRF assay


Bioorg Med Chem Lett 22: 5123-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.05.117
BindingDB Entry DOI: 10.7270/Q2TD9ZC4
More data for this
Ligand-Target Pair
G-protein coupled receptor 119 (GPR119)


(Homo sapiens (Human))
BDBM50387894
PNG
(CHEMBL2058394)
Show SMILES CC(C)(C)OC(=O)N1CCC(CCCOc2ccc3c(CCS3(=O)=O)c2)CC1
Show InChI InChI=1S/C21H31NO5S/c1-21(2,3)27-20(23)22-11-8-16(9-12-22)5-4-13-26-18-6-7-19-17(15-18)10-14-28(19,24)25/h6-7,15-16H,4-5,8-14H2,1-3H3
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n/an/an/an/a 736n/an/an/an/a



Sanwa Kagaku Kenkyusho Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR119 receptor expressed in CHO-K1 cells assessed as cAMP accumulation after 30 mins by HTRF assay


Bioorg Med Chem Lett 22: 5123-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.05.117
BindingDB Entry DOI: 10.7270/Q2TD9ZC4
More data for this
Ligand-Target Pair
G-protein coupled receptor 119 (GPR119)


(Homo sapiens (Human))
BDBM50387895
PNG
(CHEMBL2058395)
Show SMILES CC(C)(C)OC(=O)N1CCC(CCCNc2ccc3c(OCS3(=O)=O)c2)CC1
Show InChI InChI=1S/C20H30N2O5S/c1-20(2,3)27-19(23)22-11-8-15(9-12-22)5-4-10-21-16-6-7-18-17(13-16)26-14-28(18,24)25/h6-7,13,15,21H,4-5,8-12,14H2,1-3H3
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n/an/an/an/a 254n/an/an/an/a



Sanwa Kagaku Kenkyusho Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR119 receptor expressed in CHO-K1 cells assessed as cAMP accumulation after 30 mins by HTRF assay


Bioorg Med Chem Lett 22: 5123-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.05.117
BindingDB Entry DOI: 10.7270/Q2TD9ZC4
More data for this
Ligand-Target Pair
G-protein coupled receptor 119 (GPR119)


(Homo sapiens (Human))
BDBM50387896
PNG
(CHEMBL2058396)
Show SMILES CC(C)(C)OC(=O)N1CCC(CCCNc2ccc3c(OCCS3(=O)=O)c2)CC1
Show InChI InChI=1S/C21H32N2O5S/c1-21(2,3)28-20(24)23-11-8-16(9-12-23)5-4-10-22-17-6-7-19-18(15-17)27-13-14-29(19,25)26/h6-7,15-16,22H,4-5,8-14H2,1-3H3
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n/an/an/an/a 511n/an/an/an/a



Sanwa Kagaku Kenkyusho Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR119 receptor expressed in CHO-K1 cells assessed as cAMP accumulation after 30 mins by HTRF assay


Bioorg Med Chem Lett 22: 5123-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.05.117
BindingDB Entry DOI: 10.7270/Q2TD9ZC4
More data for this
Ligand-Target Pair
G-protein coupled receptor 119 (GPR119)


(Homo sapiens (Human))
BDBM50387897
PNG
(CHEMBL2058397)
Show SMILES CC(C)(C)OC(=O)N1CCC(CCCNc2ccc3c(NNS3(=O)=O)c2)CC1
Show InChI InChI=1S/C19H30N4O4S/c1-19(2,3)27-18(24)23-11-8-14(9-12-23)5-4-10-20-15-6-7-17-16(13-15)21-22-28(17,25)26/h6-7,13-14,20-22H,4-5,8-12H2,1-3H3
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n/an/an/an/a 268n/an/an/an/a



Sanwa Kagaku Kenkyusho Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR119 receptor expressed in CHO-K1 cells assessed as cAMP accumulation after 30 mins by HTRF assay


Bioorg Med Chem Lett 22: 5123-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.05.117
BindingDB Entry DOI: 10.7270/Q2TD9ZC4
More data for this
Ligand-Target Pair
G-protein coupled receptor 119 (GPR119)


(Homo sapiens (Human))
BDBM50387898
PNG
(CHEMBL2058399)
Show SMILES CC(C)(C)OC(=O)N1CCC(CCCNc2ccc3c(CCCCC3=O)c2)CC1
Show InChI InChI=1S/C24H36N2O3/c1-24(2,3)29-23(28)26-15-12-18(13-16-26)7-6-14-25-20-10-11-21-19(17-20)8-4-5-9-22(21)27/h10-11,17-18,25H,4-9,12-16H2,1-3H3
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n/an/an/an/a 770n/an/an/an/a



Sanwa Kagaku Kenkyusho Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR119 receptor expressed in CHO-K1 cells assessed as cAMP accumulation after 30 mins by HTRF assay


Bioorg Med Chem Lett 22: 5123-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.05.117
BindingDB Entry DOI: 10.7270/Q2TD9ZC4
More data for this
Ligand-Target Pair
G-protein coupled receptor 119 (GPR119)


(Homo sapiens (Human))
BDBM50387899
PNG
(CHEMBL2058400)
Show SMILES CC(C)(C)OC(=O)N1CCC(CCCNc2ccc3c(O)coc3c2)CC1
Show InChI InChI=1S/C21H30N2O4/c1-21(2,3)27-20(25)23-11-8-15(9-12-23)5-4-10-22-16-6-7-17-18(24)14-26-19(17)13-16/h6-7,13-15,22,24H,4-5,8-12H2,1-3H3
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n/an/an/an/a 52n/an/an/an/a



Sanwa Kagaku Kenkyusho Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR119 receptor expressed in CHO-K1 cells assessed as cAMP accumulation after 30 mins by HTRF assay


Bioorg Med Chem Lett 22: 5123-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.05.117
BindingDB Entry DOI: 10.7270/Q2TD9ZC4
More data for this
Ligand-Target Pair
G-protein coupled receptor 119 (GPR119)


(Homo sapiens (Human))
BDBM50387902
PNG
(CHEMBL2058403)
Show SMILES CC(C)(C)OC(=O)N1CCC(CCCNc2ccc3CCC(=O)c3c2)CC1
Show InChI InChI=1S/C22H32N2O3/c1-22(2,3)27-21(26)24-13-10-16(11-14-24)5-4-12-23-18-8-6-17-7-9-20(25)19(17)15-18/h6,8,15-16,23H,4-5,7,9-14H2,1-3H3
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n/an/an/an/a 46n/an/an/an/a



Sanwa Kagaku Kenkyusho Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR119 receptor expressed in CHO-K1 cells assessed as cAMP accumulation after 30 mins by HTRF assay


Bioorg Med Chem Lett 22: 5123-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.05.117
BindingDB Entry DOI: 10.7270/Q2TD9ZC4
More data for this
Ligand-Target Pair
G-protein coupled receptor 119 (GPR119)


(Homo sapiens (Human))
BDBM50387903
PNG
(CHEMBL2058404)
Show SMILES CC(C)(C)OC(=O)N1CCC(CCCNc2ccc3occ(O)c3c2)CC1
Show InChI InChI=1S/C21H30N2O4/c1-21(2,3)27-20(25)23-11-8-15(9-12-23)5-4-10-22-16-6-7-19-17(13-16)18(24)14-26-19/h6-7,13-15,22,24H,4-5,8-12H2,1-3H3
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n/an/an/an/a 88n/an/an/an/a



Sanwa Kagaku Kenkyusho Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR119 receptor expressed in CHO-K1 cells assessed as cAMP accumulation after 30 mins by HTRF assay


Bioorg Med Chem Lett 22: 5123-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.05.117
BindingDB Entry DOI: 10.7270/Q2TD9ZC4
More data for this
Ligand-Target Pair
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