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Compile Data Set for Download or QSAR

Found 92 hits Enz. Inhib. hit(s) with all data for entry = 50049318   
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
Probable G-protein coupled receptor 34


(Mus musculus)		BDBM50177117
PNG
(CHEMBL3814092)
Show SMILES N[C@@H](COP(O)(=O)O[C@@H]1CCCO[C@@H]1COC(=O)CCc1ccccc1OCc1cccc(Oc2ccccc2)c1)C(O)=O |r|
Show InChI InChI=1S/C31H36NO11P/c32-26(31(34)35)20-41-44(36,37)43-28-14-7-17-38-29(28)21-40-30(33)16-15-23-9-4-5-13-27(23)39-19-22-8-6-12-25(18-22)42-24-10-2-1-3-11-24/h1-6,8-13,18,26,28-29H,7,14-17,19-21,32H2,(H,34,35)(H,36,37)/t26-,28+,29+/m0/s1
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n/an/an/an/a 180n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Mu2 opioid receptor affinity against the receptor site model site 2 (mu2) by using the curve-fitting program LIGAND

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 34


(Mus musculus)		BDBM50238929
PNG
(CHEMBL4067351)
Show SMILES COc1ccc(Oc2cccc(COc3ccccc3CCC(=O)OCCCOP(O)(=O)OC[C@H](N)C(O)=O)c2)cc1 |r|
Show InChI InChI=1S/C29H34NO11P/c1-36-23-11-13-24(14-12-23)41-25-8-4-6-21(18-25)19-38-27-9-3-2-7-22(27)10-15-28(31)37-16-5-17-39-42(34,35)40-20-26(30)29(32)33/h2-4,6-9,11-14,18,26H,5,10,15-17,19-20,30H2,1H3,(H,32,33)(H,34,35)/t26-/m0/s1
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n/an/an/an/a 260n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at mouse GPR34 expressed in HEK293 cells co-transfected with AP-TGFalpha/chimeric Galphaq/i1 assessed as induction of ectodomain she...

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 34


(Mus musculus)		BDBM50238929
PNG
(CHEMBL4067351)
Show SMILES COc1ccc(Oc2cccc(COc3ccccc3CCC(=O)OCCCOP(O)(=O)OC[C@H](N)C(O)=O)c2)cc1 |r|
Show InChI InChI=1S/C29H34NO11P/c1-36-23-11-13-24(14-12-23)41-25-8-4-6-21(18-25)19-38-27-9-3-2-7-22(27)10-15-28(31)37-16-5-17-39-42(34,35)40-20-26(30)29(32)33/h2-4,6-9,11-14,18,26H,5,10,15-17,19-20,30H2,1H3,(H,32,33)(H,34,35)/t26-/m0/s1
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n/an/an/an/a 257n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at mouse GPR34 expressed in HEK293 cells co-transfected with AP-TGFalpha/chimeric Galphaq/i1 assessed as induction of ectodomain she...

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 34


(Mus musculus)		BDBM50238930
PNG
(CHEMBL4094801)
Show SMILES N[C@@H](COP(O)(=O)OCCCOC(=O)CCc1ccccc1OCc1cccc(Oc2ccc(cc2)C#N)c1)C(O)=O |r|
Show InChI InChI=1S/C29H31N2O10P/c30-18-21-9-12-24(13-10-21)41-25-7-3-5-22(17-25)19-38-27-8-2-1-6-23(27)11-14-28(32)37-15-4-16-39-42(35,36)40-20-26(31)29(33)34/h1-3,5-10,12-13,17,26H,4,11,14-16,19-20,31H2,(H,33,34)(H,35,36)/t26-/m0/s1
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n/an/an/an/a 2.00E+3n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Opioid receptor affinity against Opioid receptor kappa 1 by using the curve-fitting program LIGAND

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 34


(Mus musculus)		BDBM50238931
PNG
(CHEMBL4060207)
Show SMILES N[C@@H](COP(O)(=O)OCCCOC(=O)CCc1ccccc1OCc1cccc(Oc2ccc(N)cc2)c1)C(O)=O |r|
Show InChI InChI=1S/C28H33N2O10P/c29-22-10-12-23(13-11-22)40-24-7-3-5-20(17-24)18-37-26-8-2-1-6-21(26)9-14-27(31)36-15-4-16-38-41(34,35)39-19-25(30)28(32)33/h1-3,5-8,10-13,17,25H,4,9,14-16,18-19,29-30H2,(H,32,33)(H,34,35)/t25-/m0/s1
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n/an/an/an/a 2.70E+3n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at mouse GPR34 expressed in HEK293 cells co-transfected with AP-TGFalpha/chimeric Galphaq/i1 assessed as induction of ectodomain she...

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 34


(Mus musculus)		BDBM50238931
PNG
(CHEMBL4060207)
Show SMILES N[C@@H](COP(O)(=O)OCCCOC(=O)CCc1ccccc1OCc1cccc(Oc2ccc(N)cc2)c1)C(O)=O |r|
Show InChI InChI=1S/C28H33N2O10P/c29-22-10-12-23(13-11-22)40-24-7-3-5-20(17-24)18-37-26-8-2-1-6-21(26)9-14-27(31)36-15-4-16-38-41(34,35)39-19-25(30)28(32)33/h1-3,5-8,10-13,17,25H,4,9,14-16,18-19,29-30H2,(H,32,33)(H,34,35)/t25-/m0/s1
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n/an/an/an/a 2.69E+3n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at mouse GPR34 expressed in HEK293 cells co-transfected with AP-TGFalpha/chimeric Galphaq/i1 assessed as induction of ectodomain she...

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 34


(Mus musculus)		BDBM50238932
PNG
(CHEMBL4082094)
Show SMILES CC(C)(C)c1ccccc1Oc1cccc(COc2ccccc2CCC(=O)OCCCOP(O)(=O)OC[C@H](N)C(O)=O)c1 |r|
Show InChI InChI=1S/C32H40NO10P/c1-32(2,3)26-13-5-7-15-29(26)43-25-12-8-10-23(20-25)21-40-28-14-6-4-11-24(28)16-17-30(34)39-18-9-19-41-44(37,38)42-22-27(33)31(35)36/h4-8,10-15,20,27H,9,16-19,21-22,33H2,1-3H3,(H,35,36)(H,37,38)/t27-/m0/s1
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n/an/an/an/a>3.00E+3n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at mouse GPR34 expressed in HEK293 cells co-transfected with AP-TGFalpha/chimeric Galphaq/i1 assessed as induction of ectodomain she...

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 34


(Mus musculus)		BDBM50238932
PNG
(CHEMBL4082094)
Show SMILES CC(C)(C)c1ccccc1Oc1cccc(COc2ccccc2CCC(=O)OCCCOP(O)(=O)OC[C@H](N)C(O)=O)c1 |r|
Show InChI InChI=1S/C32H40NO10P/c1-32(2,3)26-13-5-7-15-29(26)43-25-12-8-10-23(20-25)21-40-28-14-6-4-11-24(28)16-17-30(34)39-18-9-19-41-44(37,38)42-22-27(33)31(35)36/h4-8,10-15,20,27H,9,16-19,21-22,33H2,1-3H3,(H,35,36)(H,37,38)/t27-/m0/s1
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n/an/an/an/a>3.16E+3n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at mouse GPR34 expressed in HEK293 cells co-transfected with AP-TGFalpha/chimeric Galphaq/i1 assessed as induction of ectodomain she...

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 34


(Mus musculus)		BDBM50238933
PNG
(CHEMBL4089962)
Show SMILES CC(C)(C)c1ccc(Oc2cccc(COc3ccccc3CCC(=O)OCCCOP(O)(=O)OC[C@H](N)C(O)=O)c2)cc1 |r|
Show InChI InChI=1S/C32H40NO10P/c1-32(2,3)25-13-15-26(16-14-25)43-27-10-6-8-23(20-27)21-40-29-11-5-4-9-24(29)12-17-30(34)39-18-7-19-41-44(37,38)42-22-28(33)31(35)36/h4-6,8-11,13-16,20,28H,7,12,17-19,21-22,33H2,1-3H3,(H,35,36)(H,37,38)/t28-/m0/s1
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n/an/an/an/a 900n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Opioid receptor mu 1 affinity against the receptor site model site 1 (mu1) by using the curve-fitting program LIGAND

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 34


(Mus musculus)		BDBM50238933
PNG
(CHEMBL4089962)
Show SMILES CC(C)(C)c1ccc(Oc2cccc(COc3ccccc3CCC(=O)OCCCOP(O)(=O)OC[C@H](N)C(O)=O)c2)cc1 |r|
Show InChI InChI=1S/C32H40NO10P/c1-32(2,3)25-13-15-26(16-14-25)43-27-10-6-8-23(20-27)21-40-29-11-5-4-9-24(29)12-17-30(34)39-18-7-19-41-44(37,38)42-22-28(33)31(35)36/h4-6,8-11,13-16,20,28H,7,12,17-19,21-22,33H2,1-3H3,(H,35,36)(H,37,38)/t28-/m0/s1
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n/an/an/an/a 912n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at mouse GPR34 expressed in HEK293 cells co-transfected with AP-TGFalpha/chimeric Galphaq/i1 assessed as induction of ectodomain she...

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 34


(Mus musculus)		BDBM50238934
PNG
(CHEMBL4090880)
Show SMILES N[C@@H](COP(O)(=O)OCCCOC(=O)CCc1ccccc1OCc1cccc(Oc2ccc(cc2)-c2ccccc2)c1)C(O)=O |r|
Show InChI InChI=1S/C34H36NO10P/c35-31(34(37)38)24-44-46(39,40)43-21-7-20-41-33(36)19-16-28-11-4-5-13-32(28)42-23-25-8-6-12-30(22-25)45-29-17-14-27(15-18-29)26-9-2-1-3-10-26/h1-6,8-15,17-18,22,31H,7,16,19-21,23-24,35H2,(H,37,38)(H,39,40)/t31-/m0/s1
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n/an/an/an/a 46n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at mouse GPR34 expressed in HEK293 cells co-transfected with AP-TGFalpha/chimeric Galphaq/i1 assessed as induction of ectodomain she...

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 34


(Mus musculus)		BDBM50238935
PNG
(CHEMBL4062945)
Show SMILES CC(C)(C)c1ccc(cc1)-c1ccc(Oc2cccc(COc3ccccc3CCC(=O)OCCCOP(O)(=O)OC[C@H](N)C(O)=O)c2)cc1 |r|
Show InChI InChI=1S/C38H44NO10P/c1-38(2,3)31-17-12-28(13-18-31)29-14-19-32(20-15-29)49-33-10-6-8-27(24-33)25-46-35-11-5-4-9-30(35)16-21-36(40)45-22-7-23-47-50(43,44)48-26-34(39)37(41)42/h4-6,8-15,17-20,24,34H,7,16,21-23,25-26,39H2,1-3H3,(H,41,42)(H,43,44)/t34-/m0/s1
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n/an/an/an/a 7.90n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at mouse GPR34 expressed in HEK293 cells co-transfected with AP-TGFalpha/chimeric Galphaq/i1 assessed as induction of ectodomain she...

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 34


(Mus musculus)		BDBM50238935
PNG
(CHEMBL4062945)
Show SMILES CC(C)(C)c1ccc(cc1)-c1ccc(Oc2cccc(COc3ccccc3CCC(=O)OCCCOP(O)(=O)OC[C@H](N)C(O)=O)c2)cc1 |r|
Show InChI InChI=1S/C38H44NO10P/c1-38(2,3)31-17-12-28(13-18-31)29-14-19-32(20-15-29)49-33-10-6-8-27(24-33)25-46-35-11-5-4-9-30(35)16-21-36(40)45-22-7-23-47-50(43,44)48-26-34(39)37(41)42/h4-6,8-15,17-20,24,34H,7,16,21-23,25-26,39H2,1-3H3,(H,41,42)(H,43,44)/t34-/m0/s1
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n/an/an/an/a 7.90n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at mouse GPR34 expressed in HEK293 cells co-transfected with AP-TGFalpha/chimeric Galphaq/i1 assessed as induction of ectodomain she...

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 34


(Mus musculus)		BDBM50238936
PNG
(CHEMBL4098603)
Show SMILES N[C@@H](COP(O)(=O)OCCCOC(=O)CCc1ccccc1OCc1cccc(Oc2ccc(cc2)-c2ccc(cc2)-c2ccccc2)c1)C(O)=O |r|
Show InChI InChI=1S/C40H40NO10P/c41-37(40(43)44)28-50-52(45,46)49-25-7-24-47-39(42)23-20-34-11-4-5-13-38(34)48-27-29-8-6-12-36(26-29)51-35-21-18-33(19-22-35)32-16-14-31(15-17-32)30-9-2-1-3-10-30/h1-6,8-19,21-22,26,37H,7,20,23-25,27-28,41H2,(H,43,44)(H,45,46)/t37-/m0/s1
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n/an/an/an/a 18n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at mouse GPR34 expressed in HEK293 cells co-transfected with AP-TGFalpha/chimeric Galphaq/i1 assessed as induction of ectodomain she...

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 34


(Mus musculus)		BDBM50238937
PNG
(CHEMBL4071570)
Show SMILES CCCCCCOc1ccc(cc1)-c1ccc(Oc2cccc(COc3ccccc3CCC(=O)OCCCOP(O)(=O)OC[C@H](N)C(O)=O)c2)cc1 |r|
Show InChI InChI=1S/C40H48NO11P/c1-2-3-4-7-24-47-34-19-14-31(15-20-34)32-16-21-35(22-17-32)52-36-12-8-10-30(27-36)28-49-38-13-6-5-11-33(38)18-23-39(42)48-25-9-26-50-53(45,46)51-29-37(41)40(43)44/h5-6,8,10-17,19-22,27,37H,2-4,7,9,18,23-26,28-29,41H2,1H3,(H,43,44)(H,45,46)/t37-/m0/s1
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n/an/an/an/a 49n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at mouse GPR34 expressed in HEK293 cells co-transfected with AP-TGFalpha/chimeric Galphaq/i1 assessed as induction of ectodomain she...

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 34


(Mus musculus)		BDBM50238937
PNG
(CHEMBL4071570)
Show SMILES CCCCCCOc1ccc(cc1)-c1ccc(Oc2cccc(COc3ccccc3CCC(=O)OCCCOP(O)(=O)OC[C@H](N)C(O)=O)c2)cc1 |r|
Show InChI InChI=1S/C40H48NO11P/c1-2-3-4-7-24-47-34-19-14-31(15-20-34)32-16-21-35(22-17-32)52-36-12-8-10-30(27-36)28-49-38-13-6-5-11-33(38)18-23-39(42)48-25-9-26-50-53(45,46)51-29-37(41)40(43)44/h5-6,8,10-17,19-22,27,37H,2-4,7,9,18,23-26,28-29,41H2,1H3,(H,43,44)(H,45,46)/t37-/m0/s1
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n/an/an/an/a 49n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at mouse GPR34 expressed in HEK293 cells co-transfected with AP-TGFalpha/chimeric Galphaq/i1 assessed as induction of ectodomain she...

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 34


(Mus musculus)		BDBM50238938
PNG
(CHEMBL4095241)
Show SMILES CC(C)(C)c1cccc(c1)-c1ccc(Oc2cccc(COc3ccccc3CCC(=O)OCCCOP(O)(=O)OC[C@H](N)C(O)=O)c2)cc1 |r|
Show InChI InChI=1S/C38H44NO10P/c1-38(2,3)31-12-7-11-30(24-31)28-15-18-32(19-16-28)49-33-13-6-9-27(23-33)25-46-35-14-5-4-10-29(35)17-20-36(40)45-21-8-22-47-50(43,44)48-26-34(39)37(41)42/h4-7,9-16,18-19,23-24,34H,8,17,20-22,25-26,39H2,1-3H3,(H,41,42)(H,43,44)/t34-/m0/s1
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n/an/an/an/a 14n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at mouse GPR34 expressed in HEK293 cells co-transfected with AP-TGFalpha/chimeric Galphaq/i1 assessed as induction of ectodomain she...

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 34


(Mus musculus)		BDBM50238939
PNG
(CHEMBL4067822)
Show SMILES Cc1ccccc1-c1ccc(Oc2cccc(COc3ccccc3CCC(=O)OCCCOP(O)(=O)OC[C@H](N)C(O)=O)c2)cc1 |r|
Show InChI InChI=1S/C35H38NO10P/c1-25-8-2-4-12-31(25)27-14-17-29(18-15-27)46-30-11-6-9-26(22-30)23-43-33-13-5-3-10-28(33)16-19-34(37)42-20-7-21-44-47(40,41)45-24-32(36)35(38)39/h2-6,8-15,17-18,22,32H,7,16,19-21,23-24,36H2,1H3,(H,38,39)(H,40,41)/t32-/m0/s1
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n/an/an/an/a 78n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at mouse GPR34 expressed in HEK293 cells co-transfected with AP-TGFalpha/chimeric Galphaq/i1 assessed as induction of ectodomain she...

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 34


(Mus musculus)		BDBM50096349
PNG
(CHEBI:52649 | CHEMBL1742484)
Show SMILES CCCCCCCC\C=C/CCCCCCCC(=O)OC[C@@H](O)COP(O)(=O)OC[C@H](N)C(O)=O |r|
Show InChI InChI=1S/C22H16FN3O/c1-15-6-2-3-8-20(15)26-21(12-10-17-7-4-5-13-24-17)25-19-11-9-16(23)14-18(19)22(26)27/h2-14H,1H3/b12-10+
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n/an/an/an/a 417n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at mouse GPR34 expressed in HEK293 cells co-transfected with AP-TGFalpha/chimeric Galphaq/i1 assessed as induction of ectodomain she...

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 34


(Mus musculus)		BDBM50238940
PNG
(CHEMBL4096239)
Show SMILES Cc1ccc(Oc2cccc(COc3ccccc3CCC(=O)OCCCOP(O)(=O)OC[C@H](N)C(O)=O)c2)cc1 |r|
Show InChI InChI=1S/C29H34NO10P/c1-21-10-13-24(14-11-21)40-25-8-4-6-22(18-25)19-37-27-9-3-2-7-23(27)12-15-28(31)36-16-5-17-38-41(34,35)39-20-26(30)29(32)33/h2-4,6-11,13-14,18,26H,5,12,15-17,19-20,30H2,1H3,(H,32,33)(H,34,35)/t26-/m0/s1
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n/an/an/an/a 39n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at mouse GPR34 expressed in HEK293 cells co-transfected with AP-TGFalpha/chimeric Galphaq/i1 assessed as induction of ectodomain she...

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 34


(Mus musculus)		BDBM50238940
PNG
(CHEMBL4096239)
Show SMILES Cc1ccc(Oc2cccc(COc3ccccc3CCC(=O)OCCCOP(O)(=O)OC[C@H](N)C(O)=O)c2)cc1 |r|
Show InChI InChI=1S/C29H34NO10P/c1-21-10-13-24(14-11-21)40-25-8-4-6-22(18-25)19-37-27-9-3-2-7-23(27)12-15-28(31)36-16-5-17-38-41(34,35)39-20-26(30)29(32)33/h2-4,6-11,13-14,18,26H,5,12,15-17,19-20,30H2,1H3,(H,32,33)(H,34,35)/t26-/m0/s1
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n/an/an/an/a 39n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at mouse GPR34 expressed in HEK293 cells co-transfected with AP-TGFalpha/chimeric Galphaq/i1 assessed as induction of ectodomain she...

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 34


(Mus musculus)		BDBM50238941
PNG
(CHEMBL4068969)
Show SMILES Cc1cccc(Oc2cccc(COc3ccccc3CCC(=O)OCCCOP(O)(=O)OC[C@H](N)C(O)=O)c2)c1 |r|
Show InChI InChI=1S/C29H34NO10P/c1-21-7-4-10-24(17-21)40-25-11-5-8-22(18-25)19-37-27-12-3-2-9-23(27)13-14-28(31)36-15-6-16-38-41(34,35)39-20-26(30)29(32)33/h2-5,7-12,17-18,26H,6,13-16,19-20,30H2,1H3,(H,32,33)(H,34,35)/t26-/m0/s1
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n/an/an/an/a 550n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at mouse GPR34 expressed in HEK293 cells co-transfected with AP-TGFalpha/chimeric Galphaq/i1 assessed as induction of ectodomain she...

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 34


(Mus musculus)		BDBM50238942
PNG
(CHEMBL4084094)
Show SMILES Cc1ccccc1Oc1cccc(COc2ccccc2CCC(=O)OCCCOP(O)(=O)OC[C@H](N)C(O)=O)c1 |r|
Show InChI InChI=1S/C29H34NO10P/c1-21-8-2-4-12-26(21)40-24-11-6-9-22(18-24)19-37-27-13-5-3-10-23(27)14-15-28(31)36-16-7-17-38-41(34,35)39-20-25(30)29(32)33/h2-6,8-13,18,25H,7,14-17,19-20,30H2,1H3,(H,32,33)(H,34,35)/t25-/m0/s1
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n/an/an/an/a 646n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at mouse GPR34 expressed in HEK293 cells co-transfected with AP-TGFalpha/chimeric Galphaq/i1 assessed as induction of ectodomain she...

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 34


(Mus musculus)		BDBM50238942
PNG
(CHEMBL4084094)
Show SMILES Cc1ccccc1Oc1cccc(COc2ccccc2CCC(=O)OCCCOP(O)(=O)OC[C@H](N)C(O)=O)c1 |r|
Show InChI InChI=1S/C29H34NO10P/c1-21-8-2-4-12-26(21)40-24-11-6-9-22(18-24)19-37-27-13-5-3-10-23(27)14-15-28(31)36-16-7-17-38-41(34,35)39-20-25(30)29(32)33/h2-6,8-13,18,25H,7,14-17,19-20,30H2,1H3,(H,32,33)(H,34,35)/t25-/m0/s1
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n/an/an/an/a 650n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at mouse GPR34 expressed in HEK293 cells co-transfected with AP-TGFalpha/chimeric Galphaq/i1 assessed as induction of ectodomain she...

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 34


(Mus musculus)		BDBM50238943
PNG
(CHEMBL4102082)
Show SMILES N[C@@H](COP(O)(=O)OCCCOC(=O)CCc1ccccc1OCc1cccc(OC2CCCCC2)c1)C(O)=O |r|
Show InChI InChI=1S/C28H38NO10P/c29-25(28(31)32)20-38-40(33,34)37-17-7-16-35-27(30)15-14-22-9-4-5-13-26(22)36-19-21-8-6-12-24(18-21)39-23-10-2-1-3-11-23/h4-6,8-9,12-13,18,23,25H,1-3,7,10-11,14-17,19-20,29H2,(H,31,32)(H,33,34)/t25-/m0/s1
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n/an/an/an/a 794n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at mouse GPR34 expressed in HEK293 cells co-transfected with AP-TGFalpha/chimeric Galphaq/i1 assessed as induction of ectodomain she...

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 34


(Mus musculus)		BDBM50238944
PNG
(CHEMBL4091854)
Show SMILES N[C@@H](COP(O)(=O)OCCCOC(=O)CCc1ccccc1OCc1cccc(Cc2ccccc2)c1)C(O)=O |r|
Show InChI InChI=1S/C29H34NO9P/c30-26(29(32)33)21-39-40(34,35)38-17-7-16-36-28(31)15-14-25-12-4-5-13-27(25)37-20-24-11-6-10-23(19-24)18-22-8-2-1-3-9-22/h1-6,8-13,19,26H,7,14-18,20-21,30H2,(H,32,33)(H,34,35)/t26-/m0/s1
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n/an/an/an/a 1.29E+3n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at mouse GPR34 expressed in HEK293 cells co-transfected with AP-TGFalpha/chimeric Galphaq/i1 assessed as induction of ectodomain she...

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 34


(Mus musculus)		BDBM50238944
PNG
(CHEMBL4091854)
Show SMILES N[C@@H](COP(O)(=O)OCCCOC(=O)CCc1ccccc1OCc1cccc(Cc2ccccc2)c1)C(O)=O |r|
Show InChI InChI=1S/C29H34NO9P/c30-26(29(32)33)21-39-40(34,35)38-17-7-16-36-28(31)15-14-25-12-4-5-13-27(25)37-20-24-11-6-10-23(19-24)18-22-8-2-1-3-9-22/h1-6,8-13,19,26H,7,14-18,20-21,30H2,(H,32,33)(H,34,35)/t26-/m0/s1
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n/an/an/an/a 1.30E+3n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at mouse GPR34 expressed in HEK293 cells co-transfected with AP-TGFalpha/chimeric Galphaq/i1 assessed as induction of ectodomain she...

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 34


(Mus musculus)		BDBM50238945
PNG
(CHEMBL4064102)
Show SMILES N[C@@H](COP(O)(=O)OCCCOC(=O)CCc1ccccc1OCc1cccc(OCc2ccccc2)c1)C(O)=O |r|
Show InChI InChI=1S/C29H34NO10P/c30-26(29(32)33)21-40-41(34,35)39-17-7-16-36-28(31)15-14-24-11-4-5-13-27(24)38-20-23-10-6-12-25(18-23)37-19-22-8-2-1-3-9-22/h1-6,8-13,18,26H,7,14-17,19-21,30H2,(H,32,33)(H,34,35)/t26-/m0/s1
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n/an/an/an/a>3.00E+3n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Alpha-D-glucosidase inhibitory activity and enzyme inhibition in vitro against porcine sucrase

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 34


(Mus musculus)		BDBM50238946
PNG
(CHEMBL4099594)
Show SMILES N[C@@H](COP(O)(=O)OCCCOC(=O)CCc1ccccc1OCc1cccc(c1)-c1ccccc1)C(O)=O |r|
Show InChI InChI=1S/C28H32NO9P/c29-25(28(31)32)20-38-39(33,34)37-17-7-16-35-27(30)15-14-23-11-4-5-13-26(23)36-19-21-8-6-12-24(18-21)22-9-2-1-3-10-22/h1-6,8-13,18,25H,7,14-17,19-20,29H2,(H,31,32)(H,33,34)/t25-/m0/s1
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n/an/an/an/a>3.16E+3n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at mouse GPR34 expressed in HEK293 cells co-transfected with AP-TGFalpha/chimeric Galphaq/i1 assessed as induction of ectodomain she...

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 34


(Mus musculus)		BDBM50238946
PNG
(CHEMBL4099594)
Show SMILES N[C@@H](COP(O)(=O)OCCCOC(=O)CCc1ccccc1OCc1cccc(c1)-c1ccccc1)C(O)=O |r|
Show InChI InChI=1S/C28H32NO9P/c29-25(28(31)32)20-38-39(33,34)37-17-7-16-35-27(30)15-14-23-11-4-5-13-26(23)36-19-21-8-6-12-24(18-21)22-9-2-1-3-10-22/h1-6,8-13,18,25H,7,14-17,19-20,29H2,(H,31,32)(H,33,34)/t25-/m0/s1
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n/an/an/an/a>3.00E+3n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at mouse GPR34 expressed in HEK293 cells co-transfected with AP-TGFalpha/chimeric Galphaq/i1 assessed as induction of ectodomain she...

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 34


(Mus musculus)		BDBM50238947
PNG
(CHEMBL4072692)
Show SMILES N[C@@H](COP(O)(=O)OCCCOC(=O)CCc1ccccc1OCc1cccc(Oc2ccccc2)c1)C(O)=O |r|
Show InChI InChI=1S/C28H32NO10P/c29-25(28(31)32)20-38-40(33,34)37-17-7-16-35-27(30)15-14-22-9-4-5-13-26(22)36-19-21-8-6-12-24(18-21)39-23-10-2-1-3-11-23/h1-6,8-13,18,25H,7,14-17,19-20,29H2,(H,31,32)(H,33,34)/t25-/m0/s1
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n/an/an/an/a 220n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at mouse GPR34 expressed in HEK293 cells co-transfected with AP-TGFalpha/chimeric Galphaq/i1 assessed as induction of ectodomain she...

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 34


(Mus musculus)		BDBM50238948
PNG
(CHEMBL4061305)
Show SMILES N[C@@H](COP(O)(=O)OCCCOC(=O)CCc1ccccc1OCCCCCCOc1ccccc1)C(O)=O |r|
Show InChI InChI=1S/C27H38NO10P/c28-24(27(30)31)21-38-39(32,33)37-20-10-19-36-26(29)16-15-22-11-6-7-14-25(22)35-18-9-2-1-8-17-34-23-12-4-3-5-13-23/h3-7,11-14,24H,1-2,8-10,15-21,28H2,(H,30,31)(H,32,33)/t24-/m0/s1
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n/an/an/an/a 1.23E+3n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at mouse GPR34 expressed in HEK293 cells co-transfected with AP-TGFalpha/chimeric Galphaq/i1 assessed as induction of ectodomain she...

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 34


(Mus musculus)		BDBM50238948
PNG
(CHEMBL4061305)
Show SMILES N[C@@H](COP(O)(=O)OCCCOC(=O)CCc1ccccc1OCCCCCCOc1ccccc1)C(O)=O |r|
Show InChI InChI=1S/C27H38NO10P/c28-24(27(30)31)21-38-39(32,33)37-20-10-19-36-26(29)16-15-22-11-6-7-14-25(22)35-18-9-2-1-8-17-34-23-12-4-3-5-13-23/h3-7,11-14,24H,1-2,8-10,15-21,28H2,(H,30,31)(H,32,33)/t24-/m0/s1
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n/an/an/an/a 1.20E+3n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at mouse GPR34 expressed in HEK293 cells co-transfected with AP-TGFalpha/chimeric Galphaq/i1 assessed as induction of ectodomain she...

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 34


(Mus musculus)		BDBM50238949
PNG
(CHEMBL4083168)
Show SMILES N[C@@H](COP(O)(=O)OCCCOC(=O)CCc1ccccc1OCCCCOc1ccccc1)C(O)=O |r|
Show InChI InChI=1S/C25H34NO10P/c26-22(25(28)29)19-36-37(30,31)35-18-8-17-34-24(27)14-13-20-9-4-5-12-23(20)33-16-7-6-15-32-21-10-2-1-3-11-21/h1-5,9-12,22H,6-8,13-19,26H2,(H,28,29)(H,30,31)/t22-/m0/s1
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n/an/an/an/a 1.74E+3n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at mouse GPR34 expressed in HEK293 cells co-transfected with AP-TGFalpha/chimeric Galphaq/i1 assessed as induction of ectodomain she...

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 34


(Mus musculus)		BDBM50238950
PNG
(CHEMBL4093569)
Show SMILES CCCCCCOc1cccc(COc2ccccc2CCC(=O)OCCCOP(O)(=O)OC[C@H](N)C(O)=O)c1 |r|
Show InChI InChI=1S/C28H40NO10P/c1-2-3-4-7-16-35-24-12-8-10-22(19-24)20-37-26-13-6-5-11-23(26)14-15-27(30)36-17-9-18-38-40(33,34)39-21-25(29)28(31)32/h5-6,8,10-13,19,25H,2-4,7,9,14-18,20-21,29H2,1H3,(H,31,32)(H,33,34)/t25-/m0/s1
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n/an/an/an/a>3.16E+3n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at mouse GPR34 expressed in HEK293 cells co-transfected with AP-TGFalpha/chimeric Galphaq/i1 assessed as induction of ectodomain she...

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 34


(Mus musculus)		BDBM50238950
PNG
(CHEMBL4093569)
Show SMILES CCCCCCOc1cccc(COc2ccccc2CCC(=O)OCCCOP(O)(=O)OC[C@H](N)C(O)=O)c1 |r|
Show InChI InChI=1S/C28H40NO10P/c1-2-3-4-7-16-35-24-12-8-10-22(19-24)20-37-26-13-6-5-11-23(26)14-15-27(30)36-17-9-18-38-40(33,34)39-21-25(29)28(31)32/h5-6,8,10-13,19,25H,2-4,7,9,14-18,20-21,29H2,1H3,(H,31,32)(H,33,34)/t25-/m0/s1
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n/an/an/an/a>3.00E+3n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at mouse GPR34 expressed in HEK293 cells co-transfected with AP-TGFalpha/chimeric Galphaq/i1 assessed as induction of ectodomain she...

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 34


(Mus musculus)		BDBM50238951
PNG
(CHEMBL4082629)
Show SMILES CCc1ccc(Oc2cccc(COc3ccccc3CCC(=O)OCCCOP(O)(=O)OC[C@H](N)C(O)=O)c2)cc1 |r|
Show InChI InChI=1S/C30H36NO10P/c1-2-22-11-14-25(15-12-22)41-26-9-5-7-23(19-26)20-38-28-10-4-3-8-24(28)13-16-29(32)37-17-6-18-39-42(35,36)40-21-27(31)30(33)34/h3-5,7-12,14-15,19,27H,2,6,13,16-18,20-21,31H2,1H3,(H,33,34)(H,35,36)/t27-/m0/s1
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n/an/an/an/a 180n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at mouse GPR34 expressed in HEK293 cells co-transfected with AP-TGFalpha/chimeric Galphaq/i1 assessed as induction of ectodomain she...

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 34


(Mus musculus)		BDBM50238952
PNG
(CHEMBL4068868)
Show SMILES CC(C)(C)c1cccc(Oc2cccc(COc3ccccc3CCC(=O)OCCCOP(O)(=O)OC[C@H](N)C(O)=O)c2)c1 |r|
Show InChI InChI=1S/C32H40NO10P/c1-32(2,3)25-11-7-13-27(20-25)43-26-12-6-9-23(19-26)21-40-29-14-5-4-10-24(29)15-16-30(34)39-17-8-18-41-44(37,38)42-22-28(33)31(35)36/h4-7,9-14,19-20,28H,8,15-18,21-22,33H2,1-3H3,(H,35,36)(H,37,38)/t28-/m0/s1
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n/an/an/an/a 214n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at mouse GPR34 expressed in HEK293 cells co-transfected with AP-TGFalpha/chimeric Galphaq/i1 assessed as induction of ectodomain she...

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 34


(Mus musculus)		BDBM50238939
PNG
(CHEMBL4067822)
Show SMILES Cc1ccccc1-c1ccc(Oc2cccc(COc3ccccc3CCC(=O)OCCCOP(O)(=O)OC[C@H](N)C(O)=O)c2)cc1 |r|
Show InChI InChI=1S/C35H38NO10P/c1-25-8-2-4-12-31(25)27-14-17-29(18-15-27)46-30-11-6-9-26(22-30)23-43-33-13-5-3-10-28(33)16-19-34(37)42-20-7-21-44-47(40,41)45-24-32(36)35(38)39/h2-6,8-15,17-18,22,32H,7,16,19-21,23-24,36H2,1H3,(H,38,39)(H,40,41)/t32-/m0/s1
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n/an/an/an/a 78n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at mouse GPR34 expressed in HEK293 cells co-transfected with AP-TGFalpha/chimeric Galphaq/i1 assessed as induction of ectodomain she...

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 34


(Mus musculus)		BDBM50238953
PNG
(CHEMBL4081667)
Show SMILES N[C@@H](COP(O)(=O)OCCCOC(=O)CCc1ccccc1OCc1cccc(Oc2ccccc2Cl)c1)C(O)=O |r|
Show InChI InChI=1S/C28H31ClNO10P/c29-23-10-2-4-12-26(23)40-22-9-5-7-20(17-22)18-37-25-11-3-1-8-21(25)13-14-27(31)36-15-6-16-38-41(34,35)39-19-24(30)28(32)33/h1-5,7-12,17,24H,6,13-16,18-19,30H2,(H,32,33)(H,34,35)/t24-/m0/s1
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n/an/an/an/a 1.20E+3n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at mouse GPR34 expressed in HEK293 cells co-transfected with AP-TGFalpha/chimeric Galphaq/i1 assessed as induction of ectodomain she...

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 34


(Mus musculus)		BDBM50096458
PNG
(CHEMBL3577179)
Show SMILES CCCCCCCCCCCOc1ccccc1CCC(=O)OCCCOP(O)(=O)OC[C@H](N)C(O)=O |r|
Show InChI InChI=1S/C26H44NO9P/c1-2-3-4-5-6-7-8-9-12-18-33-24-15-11-10-14-22(24)16-17-25(28)34-19-13-20-35-37(31,32)36-21-23(27)26(29)30/h10-11,14-15,23H,2-9,12-13,16-21,27H2,1H3,(H,29,30)(H,31,32)/t23-/m0/s1
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n/an/an/an/a 1.62E+3n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Inhibitory activity against porcine maltase

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 34


(Mus musculus)		BDBM50096458
PNG
(CHEMBL3577179)
Show SMILES CCCCCCCCCCCOc1ccccc1CCC(=O)OCCCOP(O)(=O)OC[C@H](N)C(O)=O |r|
Show InChI InChI=1S/C26H44NO9P/c1-2-3-4-5-6-7-8-9-12-18-33-24-15-11-10-14-22(24)16-17-25(28)34-19-13-20-35-37(31,32)36-21-23(27)26(29)30/h10-11,14-15,23H,2-9,12-13,16-21,27H2,1H3,(H,29,30)(H,31,32)/t23-/m0/s1
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n/an/an/an/a 1.60E+3n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at mouse GPR34 expressed in HEK293 cells co-transfected with AP-TGFalpha/chimeric Galphaq/i1 assessed as induction of ectodomain she...

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 34


(Mus musculus)		BDBM50096422
PNG
(CHEMBL3577137)
Show SMILES CCCCCCCC\C=C/CCCCCCCC(=O)OCCCOP(O)(=O)OC[C@H](N)C(O)=O |r|
Show InChI InChI=1S/C24H46NO8P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-23(26)31-19-17-20-32-34(29,30)33-21-22(25)24(27)28/h9-10,22H,2-8,11-21,25H2,1H3,(H,27,28)(H,29,30)/b10-9-/t22-/m0/s1
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n/an/an/an/a>3.16E+3n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at mouse GPR34 expressed in HEK293 cells co-transfected with AP-TGFalpha/chimeric Galphaq/i1 assessed as induction of ectodomain she...

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 34


(Mus musculus)		BDBM50177117
PNG
(CHEMBL3814092)
Show SMILES N[C@@H](COP(O)(=O)O[C@@H]1CCCO[C@@H]1COC(=O)CCc1ccccc1OCc1cccc(Oc2ccccc2)c1)C(O)=O |r|
Show InChI InChI=1S/C31H36NO11P/c32-26(31(34)35)20-41-44(36,37)43-28-14-7-17-38-29(28)21-40-30(33)16-15-23-9-4-5-13-27(23)39-19-22-8-6-12-25(18-22)42-24-10-2-1-3-11-24/h1-6,8-13,18,26,28-29H,7,14-17,19-21,32H2,(H,34,35)(H,36,37)/t26-,28+,29+/m0/s1
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n/an/an/an/a 182n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at mouse GPR34 expressed in HEK293 cells co-transfected with AP-TGFalpha/chimeric Galphaq/i1 assessed as induction of ectodomain she...

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 34


(Homo sapiens (Human))		BDBM50177117
PNG
(CHEMBL3814092)
Show SMILES N[C@@H](COP(O)(=O)O[C@@H]1CCCO[C@@H]1COC(=O)CCc1ccccc1OCc1cccc(Oc2ccccc2)c1)C(O)=O |r|
Show InChI InChI=1S/C31H36NO11P/c32-26(31(34)35)20-41-44(36,37)43-28-14-7-17-38-29(28)21-40-30(33)16-15-23-9-4-5-13-27(23)39-19-22-8-6-12-25(18-22)42-24-10-2-1-3-11-24/h1-6,8-13,18,26,28-29H,7,14-17,19-21,32H2,(H,34,35)(H,36,37)/t26-,28+,29+/m0/s1
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n/an/an/an/a 150n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at human GPR34 expressed in HEK293 cells co-transfected with AP-TGFalpha/chimeric Galphaq/i1 assessed as induction of AP-TGFalpha re...

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 34


(Homo sapiens (Human))		BDBM50177117
PNG
(CHEMBL3814092)
Show SMILES N[C@@H](COP(O)(=O)O[C@@H]1CCCO[C@@H]1COC(=O)CCc1ccccc1OCc1cccc(Oc2ccccc2)c1)C(O)=O |r|
Show InChI InChI=1S/C31H36NO11P/c32-26(31(34)35)20-41-44(36,37)43-28-14-7-17-38-29(28)21-40-30(33)16-15-23-9-4-5-13-27(23)39-19-22-8-6-12-25(18-22)42-24-10-2-1-3-11-24/h1-6,8-13,18,26,28-29H,7,14-17,19-21,32H2,(H,34,35)(H,36,37)/t26-,28+,29+/m0/s1
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n/an/an/an/a 151n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at human GPR34 expressed in HEK293 cells co-transfected with AP-TGFalpha/chimeric Galphaq/i1 assessed as induction of AP-TGFalpha re...

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 34


(Homo sapiens (Human))		BDBM50238947
PNG
(CHEMBL4072692)
Show SMILES N[C@@H](COP(O)(=O)OCCCOC(=O)CCc1ccccc1OCc1cccc(Oc2ccccc2)c1)C(O)=O |r|
Show InChI InChI=1S/C28H32NO10P/c29-25(28(31)32)20-38-40(33,34)37-17-7-16-35-27(30)15-14-22-9-4-5-13-26(22)36-19-21-8-6-12-24(18-21)39-23-10-2-1-3-11-23/h1-6,8-13,18,25H,7,14-17,19-20,29H2,(H,31,32)(H,33,34)/t25-/m0/s1
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n/an/an/an/a 90n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at human GPR34 expressed in HEK293 cells co-transfected with AP-TGFalpha/chimeric Galphaq/i1 assessed as induction of AP-TGFalpha re...

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 34


(Homo sapiens (Human))		BDBM50238942
PNG
(CHEMBL4084094)
Show SMILES Cc1ccccc1Oc1cccc(COc2ccccc2CCC(=O)OCCCOP(O)(=O)OC[C@H](N)C(O)=O)c1 |r|
Show InChI InChI=1S/C29H34NO10P/c1-21-8-2-4-12-26(21)40-24-11-6-9-22(18-24)19-37-27-13-5-3-10-23(27)14-15-28(31)36-16-7-17-38-41(34,35)39-20-25(30)29(32)33/h2-6,8-13,18,25H,7,14-17,19-20,30H2,1H3,(H,32,33)(H,34,35)/t25-/m0/s1
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n/an/an/an/a 180n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at human GPR34 expressed in HEK293 cells co-transfected with AP-TGFalpha/chimeric Galphaq/i1 assessed as induction of AP-TGFalpha re...

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 34


(Homo sapiens (Human))		BDBM50238942
PNG
(CHEMBL4084094)
Show SMILES Cc1ccccc1Oc1cccc(COc2ccccc2CCC(=O)OCCCOP(O)(=O)OC[C@H](N)C(O)=O)c1 |r|
Show InChI InChI=1S/C29H34NO10P/c1-21-8-2-4-12-26(21)40-24-11-6-9-22(18-24)19-37-27-13-5-3-10-23(27)14-15-28(31)36-16-7-17-38-41(34,35)39-20-25(30)29(32)33/h2-6,8-13,18,25H,7,14-17,19-20,30H2,1H3,(H,32,33)(H,34,35)/t25-/m0/s1
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n/an/an/an/a 182n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at human GPR34 expressed in HEK293 cells co-transfected with AP-TGFalpha/chimeric Galphaq/i1 assessed as induction of AP-TGFalpha re...

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
Probable G-protein coupled receptor 34


(Homo sapiens (Human))		BDBM50238941
PNG
(CHEMBL4068969)
Show SMILES Cc1cccc(Oc2cccc(COc3ccccc3CCC(=O)OCCCOP(O)(=O)OC[C@H](N)C(O)=O)c2)c1 |r|
Show InChI InChI=1S/C29H34NO10P/c1-21-7-4-10-24(17-21)40-25-11-5-8-22(18-25)19-37-27-12-3-2-9-23(27)13-14-28(31)36-15-6-16-38-41(34,35)39-20-26(30)29(32)33/h2-5,7-12,17-18,26H,6,13-16,19-20,30H2,1H3,(H,32,33)(H,34,35)/t26-/m0/s1
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n/an/an/an/a 230n/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Agonist activity at human GPR34 expressed in HEK293 cells co-transfected with AP-TGFalpha/chimeric Galphaq/i1 assessed as induction of AP-TGFalpha re...

J Med Chem 60: 6384-6399 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00693
BindingDB Entry DOI: 10.7270/Q2FX7CR1
More data for this
Ligand-Target Pair
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