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PubMed code 18023181

Compile data set for download or QSAR
Found 46 hits of Enzyme Inhibition Constant Data   
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
Growth hormone secretagogue receptor type 1


(Homo sapiens (Human))		BDBM19331
PNG
(CHEMBL266063 | N-[(1R)-2-(1H-indol-3-yl)-1-{5-[2-(...)
Show SMILES COc1ccc(Cn2c(CCc3c[nH]c4ccccc34)nnc2[C@@H](Cc2c[nH]c3ccccc23)NC(=O)C2CCNCC2)cc1 |r|
Show InChI InChI=1S/C36H39N7O2/c1-45-28-13-10-24(11-14-28)23-43-34(15-12-26-21-38-31-8-4-2-6-29(26)31)41-42-35(43)33(40-36(44)25-16-18-37-19-17-25)20-27-22-39-32-9-5-3-7-30(27)32/h2-11,13-14,21-22,25,33,37-39H,12,15-20,23H2,1H3,(H,40,44)/t33-/m1/s1
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n/an/a 0.300n/an/an/an/an/an/a



CNRS-Université Montpellier I

Curated by ChEMBL


Assay Description
Antagonist activity at human GHSR1a receptor expressed in CHO cells assessed as reduction of ghrelin-induced intracellular calcium mobilization

Bioorg Med Chem Lett 18: 164-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.113
BindingDB Entry DOI: 10.7270/Q2HM586C
More data for this
Ligand-Target Pair
Growth hormone secretagogue receptor type 1


(Homo sapiens (Human))		BDBM19331
PNG
(CHEMBL266063 | N-[(1R)-2-(1H-indol-3-yl)-1-{5-[2-(...)
Show SMILES COc1ccc(Cn2c(CCc3c[nH]c4ccccc34)nnc2[C@@H](Cc2c[nH]c3ccccc23)NC(=O)C2CCNCC2)cc1 |r|
Show InChI InChI=1S/C36H39N7O2/c1-45-28-13-10-24(11-14-28)23-43-34(15-12-26-21-38-31-8-4-2-6-29(26)31)41-42-35(43)33(40-36(44)25-16-18-37-19-17-25)20-27-22-39-32-9-5-3-7-30(27)32/h2-11,13-14,21-22,25,33,37-39H,12,15-20,23H2,1H3,(H,40,44)/t33-/m1/s1
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n/an/a 0.300n/an/an/an/an/an/a



CNRS-Université Montpellier I

Curated by ChEMBL


Assay Description
Displacement of [125I]His9-ghrelin from human GHSR1a receptor expressed in LLC PK1 cells

Bioorg Med Chem Lett 18: 164-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.113
BindingDB Entry DOI: 10.7270/Q2HM586C
More data for this
Ligand-Target Pair
Growth hormone secretagogue receptor type 1


(Homo sapiens (Human))		BDBM50227177
PNG
((R)-pyridin-2-yl 1-(5-(2-(1H-indol-3-yl)ethyl)-4-(...)
Show SMILES COc1ccc(Cn2c(CCc3c[nH]c4ccccc34)nnc2[C@@H](Cc2c[nH]c3ccccc23)NC(=O)Oc2ccccn2)cc1
Show InChI InChI=1S/C36H33N7O3/c1-45-27-16-13-24(14-17-27)23-43-33(18-15-25-21-38-30-10-4-2-8-28(25)30)41-42-35(43)32(40-36(44)46-34-12-6-7-19-37-34)20-26-22-39-31-11-5-3-9-29(26)31/h2-14,16-17,19,21-22,32,38-39H,15,18,20,23H2,1H3,(H,40,44)/t32-/m1/s1
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n/an/a 1.90n/an/an/an/an/an/a



CNRS-Université Montpellier I

Curated by ChEMBL


Assay Description
Displacement of [125I]His9-ghrelin from human GHSR1a receptor expressed in LLC PK1 cells

Bioorg Med Chem Lett 18: 164-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.113
BindingDB Entry DOI: 10.7270/Q2HM586C
More data for this
Ligand-Target Pair
Growth hormone secretagogue receptor type 1


(Homo sapiens (Human))		BDBM19294
PNG
(2-amino-N-[(1R)-2-(1H-indol-3-yl)-1-{5-[2-(1H-indo...)
Show SMILES COc1ccc(Cn2c(CCc3c[nH]c4ccccc34)nnc2[C@@H](Cc2c[nH]c3ccccc23)NC(=O)C(C)(C)N)cc1 |r|
Show InChI InChI=1S/C34H37N7O2/c1-34(2,35)33(42)38-30(18-24-20-37-29-11-7-5-9-27(24)29)32-40-39-31(41(32)21-22-12-15-25(43-3)16-13-22)17-14-23-19-36-28-10-6-4-8-26(23)28/h4-13,15-16,19-20,30,36-37H,14,17-18,21,35H2,1-3H3,(H,38,42)/t30-/m1/s1
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n/an/a 6n/an/an/an/an/an/a



CNRS-Université Montpellier I

Curated by ChEMBL


Assay Description
Displacement of [125I]His9-ghrelin from human GHSR1a receptor expressed in LLC PK1 cells

Bioorg Med Chem Lett 18: 164-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.113
BindingDB Entry DOI: 10.7270/Q2HM586C
More data for this
Ligand-Target Pair
Growth hormone secretagogue receptor type 1


(Homo sapiens (Human))		BDBM50227171
PNG
((S)-N-(1-(5-(2-(1H-indol-3-yl)ethyl)-4-(4-methoxyb...)
Show SMILES COc1ccc(Cn2c(CCc3c[nH]c4ccccc34)nnc2[C@H](Cc2c[nH]c3ccccc23)NC(=O)C2CCNCC2)cc1
Show InChI InChI=1S/C36H39N7O2/c1-45-28-13-10-24(11-14-28)23-43-34(15-12-26-21-38-31-8-4-2-6-29(26)31)41-42-35(43)33(40-36(44)25-16-18-37-19-17-25)20-27-22-39-32-9-5-3-7-30(27)32/h2-11,13-14,21-22,25,33,37-39H,12,15-20,23H2,1H3,(H,40,44)/t33-/m0/s1
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n/an/a 7n/an/an/an/an/an/a



CNRS-Université Montpellier I

Curated by ChEMBL


Assay Description
Displacement of [125I]His9-ghrelin from human GHSR1a receptor expressed in LLC PK1 cells

Bioorg Med Chem Lett 18: 164-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.113
BindingDB Entry DOI: 10.7270/Q2HM586C
More data for this
Ligand-Target Pair
Growth hormone secretagogue receptor type 1


(Homo sapiens (Human))		BDBM50227180
PNG
((R)-N-(1-(5-(2-(1H-indol-3-yl)ethyl)-4-(4-methoxyb...)
Show SMILES COc1ccc(Cn2c(CCc3c[nH]c4ccccc34)nnc2[C@@H](Cc2c[nH]c3ccccc23)NC(=O)c2ccccn2)cc1
Show InChI InChI=1S/C36H33N7O2/c1-45-27-16-13-24(14-17-27)23-43-34(18-15-25-21-38-30-10-4-2-8-28(25)30)41-42-35(43)33(40-36(44)32-12-6-7-19-37-32)20-26-22-39-31-11-5-3-9-29(26)31/h2-14,16-17,19,21-22,33,38-39H,15,18,20,23H2,1H3,(H,40,44)/t33-/m1/s1
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n/an/a 8n/an/an/an/an/an/a



CNRS-Université Montpellier I

Curated by ChEMBL


Assay Description
Displacement of [125I]His9-ghrelin from human GHSR1a receptor expressed in LLC PK1 cells

Bioorg Med Chem Lett 18: 164-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.113
BindingDB Entry DOI: 10.7270/Q2HM586C
More data for this
Ligand-Target Pair
Growth hormone secretagogue receptor type 1


(Homo sapiens (Human))		BDBM50227167
PNG
((S)-N-((R)-1-(5-(2-(1H-indol-3-yl)ethyl)-4-(4-meth...)
Show SMILES COc1ccc(Cn2c(CCc3c[nH]c4ccccc34)nnc2[C@@H](Cc2c[nH]c3ccccc23)NC(=O)C2CCCN2)cc1 |w:37.41|
Show InChI InChI=1S/C35H37N7O2/c1-44-26-15-12-23(13-16-26)22-42-33(17-14-24-20-37-29-9-4-2-7-27(24)29)40-41-34(42)32(39-35(43)31-11-6-18-36-31)19-25-21-38-30-10-5-3-8-28(25)30/h2-5,7-10,12-13,15-16,20-21,31-32,36-38H,6,11,14,17-19,22H2,1H3,(H,39,43)/t31?,32-/m1/s1
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n/an/a 9n/an/an/an/an/an/a



CNRS-Université Montpellier I

Curated by ChEMBL


Assay Description
Displacement of [125I]His9-ghrelin from human GHSR1a receptor expressed in LLC PK1 cells

Bioorg Med Chem Lett 18: 164-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.113
BindingDB Entry DOI: 10.7270/Q2HM586C
More data for this
Ligand-Target Pair
Growth hormone secretagogue receptor type 1


(Homo sapiens (Human))		BDBM50208662
PNG
((R)-N-(1-(4-(4-methoxybenzyl)-5-phenethyl-4H-1,2,4...)
Show SMILES COc1ccc(Cn2c(CCc3ccccc3)nnc2[C@@H](Cc2c[nH]c3ccccc23)NC(=O)C(C)(C)N)cc1
Show InChI InChI=1S/C32H36N6O2/c1-32(2,33)31(39)35-28(19-24-20-34-27-12-8-7-11-26(24)27)30-37-36-29(18-15-22-9-5-4-6-10-22)38(30)21-23-13-16-25(40-3)17-14-23/h4-14,16-17,20,28,34H,15,18-19,21,33H2,1-3H3,(H,35,39)/t28-/m1/s1
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n/an/a 11n/an/an/an/an/an/a



CNRS-Université Montpellier I

Curated by ChEMBL


Assay Description
Displacement of [125I]His9-ghrelin from human GHSR1a receptor expressed in LLC PK1 cells

Bioorg Med Chem Lett 18: 164-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.113
BindingDB Entry DOI: 10.7270/Q2HM586C
More data for this
Ligand-Target Pair
Growth hormone secretagogue receptor type 1


(Homo sapiens (Human))		BDBM50208678
PNG
((R)-N-(1-(4-(4-methoxybenzyl)-5-(3-phenylpropyl)-4...)
Show SMILES COc1ccc(Cn2c(CCCc3ccccc3)nnc2[C@@H](Cc2c[nH]c3ccccc23)NC(=O)C(C)(C)N)cc1
Show InChI InChI=1S/C33H38N6O2/c1-33(2,34)32(40)36-29(20-25-21-35-28-14-8-7-13-27(25)28)31-38-37-30(15-9-12-23-10-5-4-6-11-23)39(31)22-24-16-18-26(41-3)19-17-24/h4-8,10-11,13-14,16-19,21,29,35H,9,12,15,20,22,34H2,1-3H3,(H,36,40)/t29-/m1/s1
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n/an/a 12n/an/an/an/an/an/a



CNRS-Université Montpellier I

Curated by ChEMBL


Assay Description
Displacement of [125I]His9-ghrelin from human GHSR1a receptor expressed in LLC PK1 cells

Bioorg Med Chem Lett 18: 164-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.113
BindingDB Entry DOI: 10.7270/Q2HM586C
More data for this
Ligand-Target Pair
Growth hormone secretagogue receptor type 1


(Homo sapiens (Human))		BDBM50227175
PNG
((R)-tetrahydro-2H-pyran-4-yl 1-(5-(2-(1H-indol-3-y...)
Show SMILES COc1ccc(Cn2c(CCc3c[nH]c4ccccc34)nnc2[C@@H](Cc2c[nH]c3ccccc23)NC(=O)OC2CCOCC2)cc1
Show InChI InChI=1S/C36H38N6O4/c1-44-27-13-10-24(11-14-27)23-42-34(15-12-25-21-37-31-8-4-2-6-29(25)31)40-41-35(42)33(39-36(43)46-28-16-18-45-19-17-28)20-26-22-38-32-9-5-3-7-30(26)32/h2-11,13-14,21-22,28,33,37-38H,12,15-20,23H2,1H3,(H,39,43)/t33-/m1/s1
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n/an/a 45n/an/an/an/an/an/a



CNRS-Université Montpellier I

Curated by ChEMBL


Assay Description
Displacement of [125I]His9-ghrelin from human GHSR1a receptor expressed in LLC PK1 cells

Bioorg Med Chem Lett 18: 164-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.113
BindingDB Entry DOI: 10.7270/Q2HM586C
More data for this
Ligand-Target Pair
Growth hormone secretagogue receptor type 1


(Homo sapiens (Human))		BDBM50208653
PNG
((R)-N-(1-(4-(2,4-dimethoxybenzyl)-5-phenethyl-4H-1...)
Show SMILES COc1ccc(Cn2c(CCc3ccccc3)nnc2[C@@H](Cc2c[nH]c3ccccc23)NC(=O)C(C)(C)N)c(OC)c1
Show InChI InChI=1S/C33H38N6O3/c1-33(2,34)32(40)36-28(18-24-20-35-27-13-9-8-12-26(24)27)31-38-37-30(17-14-22-10-6-5-7-11-22)39(31)21-23-15-16-25(41-3)19-29(23)42-4/h5-13,15-16,19-20,28,35H,14,17-18,21,34H2,1-4H3,(H,36,40)/t28-/m1/s1
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n/an/a 62n/an/an/an/an/an/a



CNRS-Université Montpellier I

Curated by ChEMBL


Assay Description
Displacement of [125I]His9-ghrelin from human GHSR1a receptor expressed in LLC PK1 cells

Bioorg Med Chem Lett 18: 164-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.113
BindingDB Entry DOI: 10.7270/Q2HM586C
More data for this
Ligand-Target Pair
Growth hormone secretagogue receptor type 1


(Homo sapiens (Human))		BDBM50227181
PNG
((S)-N-(1-(5-(2-(1H-indol-3-yl)ethyl)-4-(2,4-dimeth...)
Show SMILES COc1ccc(Cn2c(CCc3c[nH]c4ccccc34)nnc2[C@H](Cc2c[nH]c3ccccc23)NC(=O)C(C)(C)N)c(OC)c1
Show InChI InChI=1S/C35H39N7O3/c1-35(2,36)34(43)39-30(17-24-20-38-29-12-8-6-10-27(24)29)33-41-40-32(16-14-22-19-37-28-11-7-5-9-26(22)28)42(33)21-23-13-15-25(44-3)18-31(23)45-4/h5-13,15,18-20,30,37-38H,14,16-17,21,36H2,1-4H3,(H,39,43)/t30-/m0/s1
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n/an/a 83n/an/an/an/an/an/a



CNRS-Université Montpellier I

Curated by ChEMBL


Assay Description
Displacement of [125I]His9-ghrelin from human GHSR1a receptor expressed in LLC PK1 cells

Bioorg Med Chem Lett 18: 164-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.113
BindingDB Entry DOI: 10.7270/Q2HM586C
More data for this
Ligand-Target Pair
Growth hormone secretagogue receptor type 1


(Homo sapiens (Human))		BDBM50208688
PNG
((R)-N-(1-(5-(2-(1H-indol-3-yl)ethyl)-4-(2,4-dimeth...)
Show SMILES COc1ccc(Cn2c(CCc3c[nH]c4ccccc34)nnc2[C@@H](Cc2c[nH]c3ccccc23)NC(=O)C(C)(C)N)c(OC)c1
Show InChI InChI=1S/C35H39N7O3/c1-35(2,36)34(43)39-30(17-24-20-38-29-12-8-6-10-27(24)29)33-41-40-32(16-14-22-19-37-28-11-7-5-9-26(22)28)42(33)21-23-13-15-25(44-3)18-31(23)45-4/h5-13,15,18-20,30,37-38H,14,16-17,21,36H2,1-4H3,(H,39,43)/t30-/m1/s1
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n/an/a 108n/an/an/an/an/an/a



CNRS-Université Montpellier I

Curated by ChEMBL


Assay Description
Displacement of [125I]His9-ghrelin from human GHSR1a receptor expressed in LLC PK1 cells

Bioorg Med Chem Lett 18: 164-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.113
BindingDB Entry DOI: 10.7270/Q2HM586C
More data for this
Ligand-Target Pair
Growth hormone secretagogue receptor type 1


(Homo sapiens (Human))		BDBM50208665
PNG
((R)-N-(1-(4-(4-methoxybenzyl)-5-benzyl-4H-1,2,4-tr...)
Show SMILES COc1ccc(Cn2c(Cc3ccccc3)nnc2[C@@H](Cc2c[nH]c3ccccc23)NC(=O)C(C)(C)N)cc1
Show InChI InChI=1S/C31H34N6O2/c1-31(2,32)30(38)34-27(18-23-19-33-26-12-8-7-11-25(23)26)29-36-35-28(17-21-9-5-4-6-10-21)37(29)20-22-13-15-24(39-3)16-14-22/h4-16,19,27,33H,17-18,20,32H2,1-3H3,(H,34,38)/t27-/m1/s1
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n/an/a 120n/an/an/an/an/an/a



CNRS-Université Montpellier I

Curated by ChEMBL


Assay Description
Displacement of [125I]His9-ghrelin from human GHSR1a receptor expressed in LLC PK1 cells

Bioorg Med Chem Lett 18: 164-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.113
BindingDB Entry DOI: 10.7270/Q2HM586C
More data for this
Ligand-Target Pair
Growth hormone secretagogue receptor type 1


(Homo sapiens (Human))		BDBM50227183
PNG
((S)-N-(1-(5-(2-(1H-indol-3-yl)ethyl)-4-(4-methoxyb...)
Show SMILES COc1ccc(Cn2c(CCc3c[nH]c4ccccc34)nnc2[C@H](Cc2c[nH]c3ccccc23)NC(=O)C(C)(C)N)cc1
Show InChI InChI=1S/C34H37N7O2/c1-34(2,35)33(42)38-30(18-24-20-37-29-11-7-5-9-27(24)29)32-40-39-31(41(32)21-22-12-15-25(43-3)16-13-22)17-14-23-19-36-28-10-6-4-8-26(23)28/h4-13,15-16,19-20,30,36-37H,14,17-18,21,35H2,1-3H3,(H,38,42)/t30-/m0/s1
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n/an/a 140n/an/an/an/an/an/a



CNRS-Université Montpellier I

Curated by ChEMBL


Assay Description
Displacement of [125I]His9-ghrelin from human GHSR1a receptor expressed in LLC PK1 cells

Bioorg Med Chem Lett 18: 164-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.113
BindingDB Entry DOI: 10.7270/Q2HM586C
More data for this
Ligand-Target Pair
Growth hormone secretagogue receptor type 1


(Homo sapiens (Human))		BDBM50227166
PNG
((S)-pyridin-2-yl 1-(5-(2-(1H-indol-3-yl)ethyl)-4-(...)
Show SMILES COc1ccc(Cn2c(CCc3c[nH]c4ccccc34)nnc2[C@H](Cc2c[nH]c3ccccc23)NC(=O)Oc2ccccn2)cc1
Show InChI InChI=1S/C36H33N7O3/c1-45-27-16-13-24(14-17-27)23-43-33(18-15-25-21-38-30-10-4-2-8-28(25)30)41-42-35(43)32(40-36(44)46-34-12-6-7-19-37-34)20-26-22-39-31-11-5-3-9-29(26)31/h2-14,16-17,19,21-22,32,38-39H,15,18,20,23H2,1H3,(H,40,44)/t32-/m0/s1
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n/an/a 175n/an/an/an/an/an/a



CNRS-Université Montpellier I

Curated by ChEMBL


Assay Description
Displacement of [125I]His9-ghrelin from human GHSR1a receptor expressed in LLC PK1 cells

Bioorg Med Chem Lett 18: 164-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.113
BindingDB Entry DOI: 10.7270/Q2HM586C
More data for this
Ligand-Target Pair
Growth hormone secretagogue receptor type 1


(Homo sapiens (Human))		BDBM19294
PNG
(2-amino-N-[(1R)-2-(1H-indol-3-yl)-1-{5-[2-(1H-indo...)
Show SMILES COc1ccc(Cn2c(CCc3c[nH]c4ccccc34)nnc2[C@@H](Cc2c[nH]c3ccccc23)NC(=O)C(C)(C)N)cc1 |r|
Show InChI InChI=1S/C34H37N7O2/c1-34(2,35)33(42)38-30(18-24-20-37-29-11-7-5-9-27(24)29)32-40-39-31(41(32)21-22-12-15-25(43-3)16-13-22)17-14-23-19-36-28-10-6-4-8-26(23)28/h4-13,15-16,19-20,30,36-37H,14,17-18,21,35H2,1-3H3,(H,38,42)/t30-/m1/s1
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n/an/a 190n/an/an/an/an/an/a



CNRS-Université Montpellier I

Curated by ChEMBL


Assay Description
Antagonist activity at human GHSR1a receptor expressed in CHO cells assessed as reduction of ghrelin-induced intracellular calcium mobilization

Bioorg Med Chem Lett 18: 164-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.113
BindingDB Entry DOI: 10.7270/Q2HM586C
More data for this
Ligand-Target Pair
Growth hormone secretagogue receptor type 1


(Homo sapiens (Human))		BDBM50227173
PNG
((R)-N-(1-(5-(2-(1H-indol-3-yl)ethyl)-4-(4-methoxyb...)
Show SMILES COc1ccc(Cn2c(CCc3c[nH]c4ccccc34)nnc2[C@@H](Cc2ccccc2)NC(=O)C(C)(C)N)cc1
Show InChI InChI=1S/C32H36N6O2/c1-32(2,33)31(39)35-28(19-22-9-5-4-6-10-22)30-37-36-29(38(30)21-23-13-16-25(40-3)17-14-23)18-15-24-20-34-27-12-8-7-11-26(24)27/h4-14,16-17,20,28,34H,15,18-19,21,33H2,1-3H3,(H,35,39)/t28-/m1/s1
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n/an/a 200n/an/an/an/an/an/a



CNRS-Université Montpellier I

Curated by ChEMBL


Assay Description
Displacement of [125I]His9-ghrelin from human GHSR1a receptor expressed in LLC PK1 cells

Bioorg Med Chem Lett 18: 164-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.113
BindingDB Entry DOI: 10.7270/Q2HM586C
More data for this
Ligand-Target Pair
Growth hormone secretagogue receptor type 1


(Homo sapiens (Human))		BDBM50208662
PNG
((R)-N-(1-(4-(4-methoxybenzyl)-5-phenethyl-4H-1,2,4...)
Show SMILES COc1ccc(Cn2c(CCc3ccccc3)nnc2[C@@H](Cc2c[nH]c3ccccc23)NC(=O)C(C)(C)N)cc1
Show InChI InChI=1S/C32H36N6O2/c1-32(2,33)31(39)35-28(19-24-20-34-27-12-8-7-11-26(24)27)30-37-36-29(18-15-22-9-5-4-6-10-22)38(30)21-23-13-16-25(40-3)17-14-23/h4-14,16-17,20,28,34H,15,18-19,21,33H2,1-3H3,(H,35,39)/t28-/m1/s1
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n/an/a 275n/an/an/an/an/an/a



CNRS-Université Montpellier I

Curated by ChEMBL


Assay Description
Antagonist activity at human GHSR1a receptor expressed in CHO cells assessed as reduction of ghrelin-induced intracellular calcium mobilization

Bioorg Med Chem Lett 18: 164-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.113
BindingDB Entry DOI: 10.7270/Q2HM586C
More data for this
Ligand-Target Pair
Growth hormone secretagogue receptor type 1


(Homo sapiens (Human))		BDBM50227182
PNG
((R)-benzyl 3-(5-(2-(1H-indol-3-yl)ethyl)-4-(4-meth...)
Show SMILES COc1ccc(Cn2c(CCc3c[nH]c4ccccc34)nnc2[C@@H](CC(=O)OCc2ccccc2)NC(=O)C(C)(C)N)cc1
Show InChI InChI=1S/C34H38N6O4/c1-34(2,35)33(42)37-29(19-31(41)44-22-24-9-5-4-6-10-24)32-39-38-30(40(32)21-23-13-16-26(43-3)17-14-23)18-15-25-20-36-28-12-8-7-11-27(25)28/h4-14,16-17,20,29,36H,15,18-19,21-22,35H2,1-3H3,(H,37,42)/t29-/m1/s1
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n/an/a 450n/an/an/an/an/an/a



CNRS-Université Montpellier I

Curated by ChEMBL


Assay Description
Displacement of [125I]His9-ghrelin from human GHSR1a receptor expressed in LLC PK1 cells

Bioorg Med Chem Lett 18: 164-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.113
BindingDB Entry DOI: 10.7270/Q2HM586C
More data for this
Ligand-Target Pair
Growth hormone secretagogue receptor type 1


(Homo sapiens (Human))		BDBM50227178
PNG
((S)-N-(1-(4-(2,4-dimethoxybenzyl)-5-phenethyl-4H-1...)
Show SMILES COc1ccc(Cn2c(CCc3ccccc3)nnc2[C@H](Cc2c[nH]c3ccccc23)NC(=O)C(C)(C)N)c(OC)c1
Show InChI InChI=1S/C33H38N6O3/c1-33(2,34)32(40)36-28(18-24-20-35-27-13-9-8-12-26(24)27)31-38-37-30(17-14-22-10-6-5-7-11-22)39(31)21-23-15-16-25(41-3)19-29(23)42-4/h5-13,15-16,19-20,28,35H,14,17-18,21,34H2,1-4H3,(H,36,40)/t28-/m0/s1
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n/an/a 450n/an/an/an/an/an/a



CNRS-Université Montpellier I

Curated by ChEMBL


Assay Description
Displacement of [125I]His9-ghrelin from human GHSR1a receptor expressed in LLC PK1 cells

Bioorg Med Chem Lett 18: 164-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.113
BindingDB Entry DOI: 10.7270/Q2HM586C
More data for this
Ligand-Target Pair
Growth hormone secretagogue receptor type 1


(Homo sapiens (Human))		BDBM50208645
PNG
((R)-N-(1-(4-(2,4-dimethoxybenzyl)-5-benzyl-4H-1,2,...)
Show SMILES COc1ccc(Cn2c(Cc3ccccc3)nnc2[C@@H](Cc2c[nH]c3ccccc23)NC(=O)C(C)(C)N)c(OC)c1
Show InChI InChI=1S/C32H36N6O3/c1-32(2,33)31(39)35-27(17-23-19-34-26-13-9-8-12-25(23)26)30-37-36-29(16-21-10-6-5-7-11-21)38(30)20-22-14-15-24(40-3)18-28(22)41-4/h5-15,18-19,27,34H,16-17,20,33H2,1-4H3,(H,35,39)/t27-/m1/s1
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n/an/a 560n/an/an/an/an/an/a



CNRS-Université Montpellier I

Curated by ChEMBL


Assay Description
Displacement of [125I]His9-ghrelin from human GHSR1a receptor expressed in LLC PK1 cells

Bioorg Med Chem Lett 18: 164-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.113
BindingDB Entry DOI: 10.7270/Q2HM586C
More data for this
Ligand-Target Pair
Growth hormone secretagogue receptor type 1


(Homo sapiens (Human))		BDBM50208678
PNG
((R)-N-(1-(4-(4-methoxybenzyl)-5-(3-phenylpropyl)-4...)
Show SMILES COc1ccc(Cn2c(CCCc3ccccc3)nnc2[C@@H](Cc2c[nH]c3ccccc23)NC(=O)C(C)(C)N)cc1
Show InChI InChI=1S/C33H38N6O2/c1-33(2,34)32(40)36-29(20-25-21-35-28-14-8-7-13-27(25)28)31-38-37-30(15-9-12-23-10-5-4-6-11-23)39(31)22-24-16-18-26(41-3)19-17-24/h4-8,10-11,13-14,16-19,21,29,35H,9,12,15,20,22,34H2,1-3H3,(H,36,40)/t29-/m1/s1
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n/an/a 600n/an/an/an/an/an/a



CNRS-Université Montpellier I

Curated by ChEMBL


Assay Description
Antagonist activity at human GHSR1a receptor expressed in CHO cells assessed as reduction of ghrelin-induced intracellular calcium mobilization

Bioorg Med Chem Lett 18: 164-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.113
BindingDB Entry DOI: 10.7270/Q2HM586C
More data for this
Ligand-Target Pair
Growth hormone secretagogue receptor type 1


(Homo sapiens (Human))		BDBM50208688
PNG
((R)-N-(1-(5-(2-(1H-indol-3-yl)ethyl)-4-(2,4-dimeth...)
Show SMILES COc1ccc(Cn2c(CCc3c[nH]c4ccccc34)nnc2[C@@H](Cc2c[nH]c3ccccc23)NC(=O)C(C)(C)N)c(OC)c1
Show InChI InChI=1S/C35H39N7O3/c1-35(2,36)34(43)39-30(17-24-20-38-29-12-8-6-10-27(24)29)33-41-40-32(16-14-22-19-37-28-11-7-5-9-26(22)28)42(33)21-23-13-15-25(44-3)18-31(23)45-4/h5-13,15,18-20,30,37-38H,14,16-17,21,36H2,1-4H3,(H,39,43)/t30-/m1/s1
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n/an/a 620n/an/an/an/an/an/a



CNRS-Université Montpellier I

Curated by ChEMBL


Assay Description
Antagonist activity at human GHSR1a receptor expressed in CHO cells assessed as reduction of ghrelin-induced intracellular calcium mobilization

Bioorg Med Chem Lett 18: 164-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.113
BindingDB Entry DOI: 10.7270/Q2HM586C
More data for this
Ligand-Target Pair
Growth hormone secretagogue receptor type 1


(Homo sapiens (Human))		BDBM50227169
PNG
((S)-N-((S)-1-(5-(2-(1H-indol-3-yl)ethyl)-4-(4-meth...)
Show SMILES COc1ccc(Cn2c(CCc3c[nH]c4ccccc34)nnc2[C@H](Cc2c[nH]c3ccccc23)NC(=O)C2CCCN2)cc1 |w:37.41|
Show InChI InChI=1S/C35H37N7O2/c1-44-26-15-12-23(13-16-26)22-42-33(17-14-24-20-37-29-9-4-2-7-27(24)29)40-41-34(42)32(39-35(43)31-11-6-18-36-31)19-25-21-38-30-10-5-3-8-28(25)30/h2-5,7-10,12-13,15-16,20-21,31-32,36-38H,6,11,14,17-19,22H2,1H3,(H,39,43)/t31?,32-/m0/s1
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n/an/a 650n/an/an/an/an/an/a



CNRS-Université Montpellier I

Curated by ChEMBL


Assay Description
Displacement of [125I]His9-ghrelin from human GHSR1a receptor expressed in LLC PK1 cells

Bioorg Med Chem Lett 18: 164-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.113
BindingDB Entry DOI: 10.7270/Q2HM586C
More data for this
Ligand-Target Pair
Growth hormone secretagogue receptor type 1


(Homo sapiens (Human))		BDBM50208653
PNG
((R)-N-(1-(4-(2,4-dimethoxybenzyl)-5-phenethyl-4H-1...)
Show SMILES COc1ccc(Cn2c(CCc3ccccc3)nnc2[C@@H](Cc2c[nH]c3ccccc23)NC(=O)C(C)(C)N)c(OC)c1
Show InChI InChI=1S/C33H38N6O3/c1-33(2,34)32(40)36-28(18-24-20-35-27-13-9-8-12-26(24)27)31-38-37-30(17-14-22-10-6-5-7-11-22)39(31)21-23-15-16-25(41-3)19-29(23)42-4/h5-13,15-16,19-20,28,35H,14,17-18,21,34H2,1-4H3,(H,36,40)/t28-/m1/s1
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n/an/a 800n/an/an/an/an/an/a



CNRS-Université Montpellier I

Curated by ChEMBL


Assay Description
Antagonist activity at human GHSR1a receptor expressed in CHO cells assessed as reduction of ghrelin-induced intracellular calcium mobilization

Bioorg Med Chem Lett 18: 164-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.113
BindingDB Entry DOI: 10.7270/Q2HM586C
More data for this
Ligand-Target Pair
Growth hormone secretagogue receptor type 1


(Homo sapiens (Human))		BDBM50227179
PNG
((S)-N-(1-(5-(2-(1H-indol-3-yl)ethyl)-4-(4-methoxyb...)
Show SMILES COc1ccc(Cn2c(CCc3c[nH]c4ccccc34)nnc2[C@@H](COCc2ccccc2)NC(=O)C(C)(C)N)cc1
Show InChI InChI=1S/C33H38N6O3/c1-33(2,34)32(40)36-29(22-42-21-24-9-5-4-6-10-24)31-38-37-30(39(31)20-23-13-16-26(41-3)17-14-23)18-15-25-19-35-28-12-8-7-11-27(25)28/h4-14,16-17,19,29,35H,15,18,20-22,34H2,1-3H3,(H,36,40)/t29-/m1/s1
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n/an/a 800n/an/an/an/an/an/a



CNRS-Université Montpellier I

Curated by ChEMBL


Assay Description
Displacement of [125I]His9-ghrelin from human GHSR1a receptor expressed in LLC PK1 cells

Bioorg Med Chem Lett 18: 164-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.113
BindingDB Entry DOI: 10.7270/Q2HM586C
More data for this
Ligand-Target Pair
Growth hormone secretagogue receptor type 1


(Homo sapiens (Human))		BDBM50227172
PNG
((S)-N-(1-(5-(2-(1H-indol-3-yl)ethyl)-4-(4-methoxyb...)
Show SMILES COc1ccc(Cn2c(CCc3c[nH]c4ccccc34)nnc2[C@H](Cc2c[nH]c3ccccc23)NC(=O)c2ccccn2)cc1
Show InChI InChI=1S/C36H33N7O2/c1-45-27-16-13-24(14-17-27)23-43-34(18-15-25-21-38-30-10-4-2-8-28(25)30)41-42-35(43)33(40-36(44)32-12-6-7-19-37-32)20-26-22-39-31-11-5-3-9-29(26)31/h2-14,16-17,19,21-22,33,38-39H,15,18,20,23H2,1H3,(H,40,44)/t33-/m0/s1
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n/an/a 820n/an/an/an/an/an/a



CNRS-Université Montpellier I

Curated by ChEMBL


Assay Description
Displacement of [125I]His9-ghrelin from human GHSR1a receptor expressed in LLC PK1 cells

Bioorg Med Chem Lett 18: 164-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.113
BindingDB Entry DOI: 10.7270/Q2HM586C
More data for this
Ligand-Target Pair
Growth hormone secretagogue receptor type 1


(Homo sapiens (Human))		BDBM50208665
PNG
((R)-N-(1-(4-(4-methoxybenzyl)-5-benzyl-4H-1,2,4-tr...)
Show SMILES COc1ccc(Cn2c(Cc3ccccc3)nnc2[C@@H](Cc2c[nH]c3ccccc23)NC(=O)C(C)(C)N)cc1
Show InChI InChI=1S/C31H34N6O2/c1-31(2,32)30(38)34-27(18-23-19-33-26-12-8-7-11-25(23)26)29-36-35-28(17-21-9-5-4-6-10-21)37(29)20-22-13-15-24(39-3)16-14-22/h4-16,19,27,33H,17-18,20,32H2,1-3H3,(H,34,38)/t27-/m1/s1
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n/an/a 870n/an/an/an/an/an/a



CNRS-Université Montpellier I

Curated by ChEMBL


Assay Description
Antagonist activity at human GHSR1a receptor expressed in CHO cells assessed as reduction of ghrelin-induced intracellular calcium mobilization

Bioorg Med Chem Lett 18: 164-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.113
BindingDB Entry DOI: 10.7270/Q2HM586C
More data for this
Ligand-Target Pair
Growth hormone secretagogue receptor type 1


(Homo sapiens (Human))		BDBM50227170
PNG
((S)-N-(1-(4-(4-methoxybenzyl)-5-phenethyl-4H-1,2,4...)
Show SMILES COc1ccc(Cn2c(CCc3ccccc3)nnc2[C@H](Cc2c[nH]c3ccccc23)NC(=O)C(C)(C)N)cc1
Show InChI InChI=1S/C32H36N6O2/c1-32(2,33)31(39)35-28(19-24-20-34-27-12-8-7-11-26(24)27)30-37-36-29(18-15-22-9-5-4-6-10-22)38(30)21-23-13-16-25(40-3)17-14-23/h4-14,16-17,20,28,34H,15,18-19,21,33H2,1-3H3,(H,35,39)/t28-/m0/s1
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n/an/a>1.00E+3n/an/an/an/an/an/a



CNRS-Université Montpellier I

Curated by ChEMBL


Assay Description
Displacement of [125I]His9-ghrelin from human GHSR1a receptor expressed in LLC PK1 cells

Bioorg Med Chem Lett 18: 164-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.113
BindingDB Entry DOI: 10.7270/Q2HM586C
More data for this
Ligand-Target Pair
Growth hormone secretagogue receptor type 1


(Homo sapiens (Human))		BDBM50227176
PNG
((R)-N-(1-(4-(4-methoxybenzyl)-5-benzyl-4H-1,2,4-tr...)
Show SMILES COc1ccc(Cn2c(Cc3ccccc3)nnc2[C@@H](Cc2ccccc2)NC(=O)C(C)(C)N)cc1
Show InChI InChI=1S/C29H33N5O2/c1-29(2,30)28(35)31-25(18-21-10-6-4-7-11-21)27-33-32-26(19-22-12-8-5-9-13-22)34(27)20-23-14-16-24(36-3)17-15-23/h4-17,25H,18-20,30H2,1-3H3,(H,31,35)/t25-/m1/s1
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n/an/a>1.00E+3n/an/an/an/an/an/a



CNRS-Université Montpellier I

Curated by ChEMBL


Assay Description
Displacement of [125I]His9-ghrelin from human GHSR1a receptor expressed in LLC PK1 cells

Bioorg Med Chem Lett 18: 164-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.113
BindingDB Entry DOI: 10.7270/Q2HM586C
More data for this
Ligand-Target Pair
Growth hormone secretagogue receptor type 1


(Homo sapiens (Human))		BDBM50227165
PNG
((S)-N-(1-(4-(2,4-dimethoxybenzyl)-5-benzyl-4H-1,2,...)
Show SMILES COc1ccc(Cn2c(Cc3ccccc3)nnc2[C@H](Cc2c[nH]c3ccccc23)NC(=O)C(C)(C)N)c(OC)c1
Show InChI InChI=1S/C32H36N6O3/c1-32(2,33)31(39)35-27(17-23-19-34-26-13-9-8-12-25(23)26)30-37-36-29(16-21-10-6-5-7-11-21)38(30)20-22-14-15-24(40-3)18-28(22)41-4/h5-15,18-19,27,34H,16-17,20,33H2,1-4H3,(H,35,39)/t27-/m0/s1
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n/an/a>1.00E+3n/an/an/an/an/an/a



CNRS-Université Montpellier I

Curated by ChEMBL


Assay Description
Displacement of [125I]His9-ghrelin from human GHSR1a receptor expressed in LLC PK1 cells

Bioorg Med Chem Lett 18: 164-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.113
BindingDB Entry DOI: 10.7270/Q2HM586C
More data for this
Ligand-Target Pair
Growth hormone secretagogue receptor type 1


(Homo sapiens (Human))		BDBM50227164
PNG
((S)-N-(1-(4-(4-methoxybenzyl)-5-(3-phenylpropyl)-4...)
Show SMILES COc1ccc(Cn2c(CCCc3ccccc3)nnc2[C@H](Cc2c[nH]c3ccccc23)NC(=O)C(C)(C)N)cc1
Show InChI InChI=1S/C33H38N6O2/c1-33(2,34)32(40)36-29(20-25-21-35-28-14-8-7-13-27(25)28)31-38-37-30(15-9-12-23-10-5-4-6-11-23)39(31)22-24-16-18-26(41-3)19-17-24/h4-8,10-11,13-14,16-19,21,29,35H,9,12,15,20,22,34H2,1-3H3,(H,36,40)/t29-/m0/s1
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n/an/a>1.00E+3n/an/an/an/an/an/a



CNRS-Université Montpellier I

Curated by ChEMBL


Assay Description
Displacement of [125I]His9-ghrelin from human GHSR1a receptor expressed in LLC PK1 cells

Bioorg Med Chem Lett 18: 164-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.113
BindingDB Entry DOI: 10.7270/Q2HM586C
More data for this
Ligand-Target Pair
Growth hormone secretagogue receptor type 1


(Homo sapiens (Human))		BDBM50227168
PNG
((S)-N-(1-(4-(4-methoxybenzyl)-5-benzyl-4H-1,2,4-tr...)
Show SMILES COc1ccc(Cn2c(Cc3ccccc3)nnc2[C@H](Cc2c[nH]c3ccccc23)NC(=O)C(C)(C)N)cc1
Show InChI InChI=1S/C31H34N6O2/c1-31(2,32)30(38)34-27(18-23-19-33-26-12-8-7-11-25(23)26)29-36-35-28(17-21-9-5-4-6-10-21)37(29)20-22-13-15-24(39-3)16-14-22/h4-16,19,27,33H,17-18,20,32H2,1-3H3,(H,34,38)/t27-/m0/s1
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n/an/a>1.00E+3n/an/an/an/an/an/a



CNRS-Université Montpellier I

Curated by ChEMBL


Assay Description
Displacement of [125I]His9-ghrelin from human GHSR1a receptor expressed in LLC PK1 cells

Bioorg Med Chem Lett 18: 164-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.113
BindingDB Entry DOI: 10.7270/Q2HM586C
More data for this
Ligand-Target Pair
Growth hormone secretagogue receptor type 1


(Homo sapiens (Human))		BDBM50227174
PNG
((S)-tetrahydro-2H-pyran-4-yl 1-(5-(2-(1H-indol-3-y...)
Show SMILES COc1ccc(Cn2c(CCc3c[nH]c4ccccc34)nnc2[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC2CCOCC2)cc1
Show InChI InChI=1S/C36H38N6O4/c1-44-27-13-10-24(11-14-27)23-42-34(15-12-25-21-37-31-8-4-2-6-29(25)31)40-41-35(42)33(39-36(43)46-28-16-18-45-19-17-28)20-26-22-38-32-9-5-3-7-30(26)32/h2-11,13-14,21-22,28,33,37-38H,12,15-20,23H2,1H3,(H,39,43)/t33-/m0/s1
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n/an/a 1.30E+3n/an/an/an/an/an/a



CNRS-Université Montpellier I

Curated by ChEMBL


Assay Description
Displacement of [125I]His9-ghrelin from human GHSR1a receptor expressed in LLC PK1 cells

Bioorg Med Chem Lett 18: 164-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.113
BindingDB Entry DOI: 10.7270/Q2HM586C
More data for this
Ligand-Target Pair
Growth hormone secretagogue receptor type 1


(Homo sapiens (Human))		BDBM50227181
PNG
((S)-N-(1-(5-(2-(1H-indol-3-yl)ethyl)-4-(2,4-dimeth...)
Show SMILES COc1ccc(Cn2c(CCc3c[nH]c4ccccc34)nnc2[C@H](Cc2c[nH]c3ccccc23)NC(=O)C(C)(C)N)c(OC)c1
Show InChI InChI=1S/C35H39N7O3/c1-35(2,36)34(43)39-30(17-24-20-38-29-12-8-6-10-27(24)29)33-41-40-32(16-14-22-19-37-28-11-7-5-9-26(22)28)42(33)21-23-13-15-25(44-3)18-31(23)45-4/h5-13,15,18-20,30,37-38H,14,16-17,21,36H2,1-4H3,(H,39,43)/t30-/m0/s1
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n/an/a 3.20E+3n/an/an/an/an/an/a



CNRS-Université Montpellier I

Curated by ChEMBL


Assay Description
Antagonist activity at human GHSR1a receptor expressed in CHO cells assessed as reduction of ghrelin-induced intracellular calcium mobilization

Bioorg Med Chem Lett 18: 164-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.113
BindingDB Entry DOI: 10.7270/Q2HM586C
More data for this
Ligand-Target Pair
Growth hormone secretagogue receptor type 1


(Homo sapiens (Human))		BDBM50227166
PNG
((S)-pyridin-2-yl 1-(5-(2-(1H-indol-3-yl)ethyl)-4-(...)
Show SMILES COc1ccc(Cn2c(CCc3c[nH]c4ccccc34)nnc2[C@H](Cc2c[nH]c3ccccc23)NC(=O)Oc2ccccn2)cc1
Show InChI InChI=1S/C36H33N7O3/c1-45-27-16-13-24(14-17-27)23-43-33(18-15-25-21-38-30-10-4-2-8-28(25)30)41-42-35(43)32(40-36(44)46-34-12-6-7-19-37-34)20-26-22-39-31-11-5-3-9-29(26)31/h2-14,16-17,19,21-22,32,38-39H,15,18,20,23H2,1H3,(H,40,44)/t32-/m0/s1
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n/an/an/an/a 1.58E+3n/an/an/an/a



CNRS-Université Montpellier I

Curated by ChEMBL


Assay Description
Agonist activity at human GHSR1a receptor expressed in CHO cells assessed as intracellular calcium mobilization

Bioorg Med Chem Lett 18: 164-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.113
BindingDB Entry DOI: 10.7270/Q2HM586C
More data for this
Ligand-Target Pair
Growth hormone secretagogue receptor type 1


(Homo sapiens (Human))		BDBM19331
PNG
(CHEMBL266063 | N-[(1R)-2-(1H-indol-3-yl)-1-{5-[2-(...)
Show SMILES COc1ccc(Cn2c(CCc3c[nH]c4ccccc34)nnc2[C@@H](Cc2c[nH]c3ccccc23)NC(=O)C2CCNCC2)cc1 |r|
Show InChI InChI=1S/C36H39N7O2/c1-45-28-13-10-24(11-14-28)23-43-34(15-12-26-21-38-31-8-4-2-6-29(26)31)41-42-35(43)33(40-36(44)25-16-18-37-19-17-25)20-27-22-39-32-9-5-3-7-30(27)32/h2-11,13-14,21-22,25,33,37-39H,12,15-20,23H2,1H3,(H,40,44)/t33-/m1/s1
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n/an/an/an/a 3n/an/an/an/a



CNRS-Université Montpellier I

Curated by ChEMBL


Assay Description
Agonist activity at human GHSR1a receptor expressed in CHO cells assessed as intracellular calcium mobilization

Bioorg Med Chem Lett 18: 164-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.113
BindingDB Entry DOI: 10.7270/Q2HM586C
More data for this
Ligand-Target Pair
Growth hormone secretagogue receptor type 1


(Homo sapiens (Human))		BDBM50227180
PNG
((R)-N-(1-(5-(2-(1H-indol-3-yl)ethyl)-4-(4-methoxyb...)
Show SMILES COc1ccc(Cn2c(CCc3c[nH]c4ccccc34)nnc2[C@@H](Cc2c[nH]c3ccccc23)NC(=O)c2ccccn2)cc1
Show InChI InChI=1S/C36H33N7O2/c1-45-27-16-13-24(14-17-27)23-43-34(18-15-25-21-38-30-10-4-2-8-28(25)30)41-42-35(43)33(40-36(44)32-12-6-7-19-37-32)20-26-22-39-31-11-5-3-9-29(26)31/h2-14,16-17,19,21-22,33,38-39H,15,18,20,23H2,1H3,(H,40,44)/t33-/m1/s1
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n/an/an/an/a 12n/an/an/an/a



CNRS-Université Montpellier I

Curated by ChEMBL


Assay Description
Agonist activity at human GHSR1a receptor expressed in CHO cells assessed as intracellular calcium mobilization

Bioorg Med Chem Lett 18: 164-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.113
BindingDB Entry DOI: 10.7270/Q2HM586C
More data for this
Ligand-Target Pair
Growth hormone secretagogue receptor type 1


(Homo sapiens (Human))		BDBM50227167
PNG
((S)-N-((R)-1-(5-(2-(1H-indol-3-yl)ethyl)-4-(4-meth...)
Show SMILES COc1ccc(Cn2c(CCc3c[nH]c4ccccc34)nnc2[C@@H](Cc2c[nH]c3ccccc23)NC(=O)C2CCCN2)cc1 |w:37.41|
Show InChI InChI=1S/C35H37N7O2/c1-44-26-15-12-23(13-16-26)22-42-33(17-14-24-20-37-29-9-4-2-7-27(24)29)40-41-34(42)32(39-35(43)31-11-6-18-36-31)19-25-21-38-30-10-5-3-8-28(25)30/h2-5,7-10,12-13,15-16,20-21,31-32,36-38H,6,11,14,17-19,22H2,1H3,(H,39,43)/t31?,32-/m1/s1
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n/an/an/an/a 6n/an/an/an/a



CNRS-Université Montpellier I

Curated by ChEMBL


Assay Description
Agonist activity at human GHSR1a receptor expressed in CHO cells assessed as intracellular calcium mobilization

Bioorg Med Chem Lett 18: 164-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.113
BindingDB Entry DOI: 10.7270/Q2HM586C
More data for this
Ligand-Target Pair
Growth hormone secretagogue receptor type 1


(Homo sapiens (Human))		BDBM50227169
PNG
((S)-N-((S)-1-(5-(2-(1H-indol-3-yl)ethyl)-4-(4-meth...)
Show SMILES COc1ccc(Cn2c(CCc3c[nH]c4ccccc34)nnc2[C@H](Cc2c[nH]c3ccccc23)NC(=O)C2CCCN2)cc1 |w:37.41|
Show InChI InChI=1S/C35H37N7O2/c1-44-26-15-12-23(13-16-26)22-42-33(17-14-24-20-37-29-9-4-2-7-27(24)29)40-41-34(42)32(39-35(43)31-11-6-18-36-31)19-25-21-38-30-10-5-3-8-28(25)30/h2-5,7-10,12-13,15-16,20-21,31-32,36-38H,6,11,14,17-19,22H2,1H3,(H,39,43)/t31?,32-/m0/s1
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n/an/an/an/a 440n/an/an/an/a



CNRS-Université Montpellier I

Curated by ChEMBL


Assay Description
Agonist activity at human GHSR1a receptor expressed in CHO cells assessed as intracellular calcium mobilization

Bioorg Med Chem Lett 18: 164-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.113
BindingDB Entry DOI: 10.7270/Q2HM586C
More data for this
Ligand-Target Pair
Growth hormone secretagogue receptor type 1


(Homo sapiens (Human))		BDBM50227171
PNG
((S)-N-(1-(5-(2-(1H-indol-3-yl)ethyl)-4-(4-methoxyb...)
Show SMILES COc1ccc(Cn2c(CCc3c[nH]c4ccccc34)nnc2[C@H](Cc2c[nH]c3ccccc23)NC(=O)C2CCNCC2)cc1
Show InChI InChI=1S/C36H39N7O2/c1-45-28-13-10-24(11-14-28)23-43-34(15-12-26-21-38-31-8-4-2-6-29(26)31)41-42-35(43)33(40-36(44)25-16-18-37-19-17-25)20-27-22-39-32-9-5-3-7-30(27)32/h2-11,13-14,21-22,25,33,37-39H,12,15-20,23H2,1H3,(H,40,44)/t33-/m0/s1
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n/an/an/an/a 32n/an/an/an/a



CNRS-Université Montpellier I

Curated by ChEMBL


Assay Description
Agonist activity at human GHSR1a receptor expressed in CHO cells assessed as intracellular calcium mobilization

Bioorg Med Chem Lett 18: 164-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.113
BindingDB Entry DOI: 10.7270/Q2HM586C
More data for this
Ligand-Target Pair
Growth hormone secretagogue receptor type 1


(Homo sapiens (Human))		BDBM50227172
PNG
((S)-N-(1-(5-(2-(1H-indol-3-yl)ethyl)-4-(4-methoxyb...)
Show SMILES COc1ccc(Cn2c(CCc3c[nH]c4ccccc34)nnc2[C@H](Cc2c[nH]c3ccccc23)NC(=O)c2ccccn2)cc1
Show InChI InChI=1S/C36H33N7O2/c1-45-27-16-13-24(14-17-27)23-43-34(18-15-25-21-38-30-10-4-2-8-28(25)30)41-42-35(43)33(40-36(44)32-12-6-7-19-37-32)20-26-22-39-31-11-5-3-9-29(26)31/h2-14,16-17,19,21-22,33,38-39H,15,18,20,23H2,1H3,(H,40,44)/t33-/m0/s1
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n/an/an/an/a 88n/an/an/an/a



CNRS-Université Montpellier I

Curated by ChEMBL


Assay Description
Agonist activity at human GHSR1a receptor expressed in CHO cells assessed as intracellular calcium mobilization

Bioorg Med Chem Lett 18: 164-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.113
BindingDB Entry DOI: 10.7270/Q2HM586C
More data for this
Ligand-Target Pair
Growth hormone secretagogue receptor type 1


(Homo sapiens (Human))		BDBM50227174
PNG
((S)-tetrahydro-2H-pyran-4-yl 1-(5-(2-(1H-indol-3-y...)
Show SMILES COc1ccc(Cn2c(CCc3c[nH]c4ccccc34)nnc2[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC2CCOCC2)cc1
Show InChI InChI=1S/C36H38N6O4/c1-44-27-13-10-24(11-14-27)23-42-34(15-12-25-21-37-31-8-4-2-6-29(25)31)40-41-35(42)33(39-36(43)46-28-16-18-45-19-17-28)20-26-22-38-32-9-5-3-7-30(26)32/h2-11,13-14,21-22,28,33,37-38H,12,15-20,23H2,1H3,(H,39,43)/t33-/m0/s1
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n/an/an/an/a 24n/an/an/an/a



CNRS-Université Montpellier I

Curated by ChEMBL


Assay Description
Agonist activity at human GHSR1a receptor expressed in CHO cells assessed as intracellular calcium mobilization

Bioorg Med Chem Lett 18: 164-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.113
BindingDB Entry DOI: 10.7270/Q2HM586C
More data for this
Ligand-Target Pair
Growth hormone secretagogue receptor type 1


(Homo sapiens (Human))		BDBM50227177
PNG
((R)-pyridin-2-yl 1-(5-(2-(1H-indol-3-yl)ethyl)-4-(...)
Show SMILES COc1ccc(Cn2c(CCc3c[nH]c4ccccc34)nnc2[C@@H](Cc2c[nH]c3ccccc23)NC(=O)Oc2ccccn2)cc1
Show InChI InChI=1S/C36H33N7O3/c1-45-27-16-13-24(14-17-27)23-43-33(18-15-25-21-38-30-10-4-2-8-28(25)30)41-42-35(43)32(40-36(44)46-34-12-6-7-19-37-34)20-26-22-39-31-11-5-3-9-29(26)31/h2-14,16-17,19,21-22,32,38-39H,15,18,20,23H2,1H3,(H,40,44)/t32-/m1/s1
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n/an/an/an/a 75n/an/an/an/a



CNRS-Université Montpellier I

Curated by ChEMBL


Assay Description
Agonist activity at human GHSR1a receptor expressed in CHO cells assessed as intracellular calcium mobilization

Bioorg Med Chem Lett 18: 164-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.113
BindingDB Entry DOI: 10.7270/Q2HM586C
More data for this
Ligand-Target Pair
Growth hormone secretagogue receptor type 1


(Homo sapiens (Human))		BDBM50227175
PNG
((R)-tetrahydro-2H-pyran-4-yl 1-(5-(2-(1H-indol-3-y...)
Show SMILES COc1ccc(Cn2c(CCc3c[nH]c4ccccc34)nnc2[C@@H](Cc2c[nH]c3ccccc23)NC(=O)OC2CCOCC2)cc1
Show InChI InChI=1S/C36H38N6O4/c1-44-27-13-10-24(11-14-27)23-42-34(15-12-25-21-37-31-8-4-2-6-29(25)31)40-41-35(42)33(39-36(43)46-28-16-18-45-19-17-28)20-26-22-38-32-9-5-3-7-30(26)32/h2-11,13-14,21-22,28,33,37-38H,12,15-20,23H2,1H3,(H,39,43)/t33-/m1/s1
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n/an/an/an/a 24n/an/an/an/a



CNRS-Université Montpellier I

Curated by ChEMBL


Assay Description
Agonist activity at human GHSR1a receptor expressed in CHO cells assessed as intracellular calcium mobilization

Bioorg Med Chem Lett 18: 164-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.113
BindingDB Entry DOI: 10.7270/Q2HM586C
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%