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PubMed code 20598533

Compile data set for download or QSAR
Found 71 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
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50323150
PNG
(CHEMBL1209253 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)N(CC(C1CCCCC1)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C)S(C)(=O)=O |r|
Show InChI InChI=1S/C31H50F2N4O3S/c1-22(2)37(41(6,39)40)21-29(23-10-8-7-9-11-23)34-14-16-35(17-15-34)30(38)27-20-36(31(3,4)5)19-26(27)25-13-12-24(32)18-28(25)33/h12-13,18,22-23,26-27,29H,7-11,14-17,19-21H2,1-6H3/t26-,27+,29?/m0/s1
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n/an/a 13n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human MC4 receptor expressed in CHO cells assessed as increase of alpha-MSH-induced cAMP accumulation

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50323150
PNG
(CHEMBL1209253 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)N(CC(C1CCCCC1)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C)S(C)(=O)=O |r|
Show InChI InChI=1S/C31H50F2N4O3S/c1-22(2)37(41(6,39)40)21-29(23-10-8-7-9-11-23)34-14-16-35(17-15-34)30(38)27-20-36(31(3,4)5)19-26(27)25-13-12-24(32)18-28(25)33/h12-13,18,22-23,26-27,29H,7-11,14-17,19-21H2,1-6H3/t26-,27+,29?/m0/s1
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n/an/a 13n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from human MC4 receptor expressed in CHO cells

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50323159
PNG
(CHEMBL1209321 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)CC(CN(C(C)C)C(C)=O)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C |r|
Show InChI InChI=1S/C30H48F2N4O2/c1-20(2)15-24(17-36(21(3)4)22(5)37)33-11-13-34(14-12-33)29(38)27-19-35(30(6,7)8)18-26(27)25-10-9-23(31)16-28(25)32/h9-10,16,20-21,24,26-27H,11-15,17-19H2,1-8H3/t24?,26-,27+/m0/s1
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n/an/a 23n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from human MC4 receptor expressed in CHO cells

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50323159
PNG
(CHEMBL1209321 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)CC(CN(C(C)C)C(C)=O)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C |r|
Show InChI InChI=1S/C30H48F2N4O2/c1-20(2)15-24(17-36(21(3)4)22(5)37)33-11-13-34(14-12-33)29(38)27-19-35(30(6,7)8)18-26(27)25-10-9-23(31)16-28(25)32/h9-10,16,20-21,24,26-27H,11-15,17-19H2,1-8H3/t24?,26-,27+/m0/s1
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n/an/a 23n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human MC4 receptor expressed in CHO cells assessed as increase of alpha-MSH-induced cAMP accumulation

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50323158
PNG
(CHEMBL1209382 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)CC(CN(C(C)C)S(C)(=O)=O)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C |r|
Show InChI InChI=1S/C29H48F2N4O3S/c1-20(2)15-23(17-35(21(3)4)39(8,37)38)32-11-13-33(14-12-32)28(36)26-19-34(29(5,6)7)18-25(26)24-10-9-22(30)16-27(24)31/h9-10,16,20-21,23,25-26H,11-15,17-19H2,1-8H3/t23?,25-,26+/m0/s1
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n/an/a 27n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human MC4 receptor expressed in CHO cells assessed as increase of alpha-MSH-induced cAMP accumulation

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50323158
PNG
(CHEMBL1209382 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)CC(CN(C(C)C)S(C)(=O)=O)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C |r|
Show InChI InChI=1S/C29H48F2N4O3S/c1-20(2)15-23(17-35(21(3)4)39(8,37)38)32-11-13-33(14-12-32)28(36)26-19-34(29(5,6)7)18-25(26)24-10-9-22(30)16-27(24)31/h9-10,16,20-21,23,25-26H,11-15,17-19H2,1-8H3/t23?,25-,26+/m0/s1
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n/an/a 27n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from human MC4 receptor expressed in CHO cells

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50323151
PNG
(CHEMBL1209252 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)N(CC(C1CCCCC1)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C)C(C)=O |r|
Show InChI InChI=1S/C32H50F2N4O2/c1-22(2)38(23(3)39)21-30(24-10-8-7-9-11-24)35-14-16-36(17-15-35)31(40)28-20-37(32(4,5)6)19-27(28)26-13-12-25(33)18-29(26)34/h12-13,18,22,24,27-28,30H,7-11,14-17,19-21H2,1-6H3/t27-,28+,30?/m0/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human MC4 receptor expressed in CHO cells assessed as increase of alpha-MSH-induced cAMP accumulation

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50323151
PNG
(CHEMBL1209252 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)N(CC(C1CCCCC1)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C)C(C)=O |r|
Show InChI InChI=1S/C32H50F2N4O2/c1-22(2)38(23(3)39)21-30(24-10-8-7-9-11-24)35-14-16-36(17-15-35)31(40)28-20-37(32(4,5)6)19-27(28)26-13-12-25(33)18-29(26)34/h12-13,18,22,24,27-28,30H,7-11,14-17,19-21H2,1-6H3/t27-,28+,30?/m0/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from human MC4 receptor expressed in CHO cells

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50323156
PNG
(CHEMBL1209458 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)N(CC(N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C)C(C)(C)C)S(C)(=O)=O |r|
Show InChI InChI=1S/C29H48F2N4O3S/c1-20(2)35(39(9,37)38)19-26(28(3,4)5)32-12-14-33(15-13-32)27(36)24-18-34(29(6,7)8)17-23(24)22-11-10-21(30)16-25(22)31/h10-11,16,20,23-24,26H,12-15,17-19H2,1-9H3/t23-,24+,26?/m0/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from human MC4 receptor expressed in CHO cells

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50323156
PNG
(CHEMBL1209458 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)N(CC(N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C)C(C)(C)C)S(C)(=O)=O |r|
Show InChI InChI=1S/C29H48F2N4O3S/c1-20(2)35(39(9,37)38)19-26(28(3,4)5)32-12-14-33(15-13-32)27(36)24-18-34(29(6,7)8)17-23(24)22-11-10-21(30)16-25(22)31/h10-11,16,20,23-24,26H,12-15,17-19H2,1-9H3/t23-,24+,26?/m0/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human MC4 receptor expressed in CHO cells assessed as increase of alpha-MSH-induced cAMP accumulation

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50323160
PNG
(CHEMBL1209320 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)N(CC(C1CCCCC1)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C)C(=O)c1cnn(c1)C(C)C |r|
Show InChI InChI=1S/C37H56F2N6O2/c1-25(2)44(35(46)28-20-40-45(21-28)26(3)4)24-34(27-11-9-8-10-12-27)41-15-17-42(18-16-41)36(47)32-23-43(37(5,6)7)22-31(32)30-14-13-29(38)19-33(30)39/h13-14,19-21,25-27,31-32,34H,8-12,15-18,22-24H2,1-7H3/t31-,32+,34?/m0/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from human MC4 receptor expressed in CHO cells

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50323160
PNG
(CHEMBL1209320 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)N(CC(C1CCCCC1)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C)C(=O)c1cnn(c1)C(C)C |r|
Show InChI InChI=1S/C37H56F2N6O2/c1-25(2)44(35(46)28-20-40-45(21-28)26(3)4)24-34(27-11-9-8-10-12-27)41-15-17-42(18-16-41)36(47)32-23-43(37(5,6)7)22-31(32)30-14-13-29(38)19-33(30)39/h13-14,19-21,25-27,31-32,34H,8-12,15-18,22-24H2,1-7H3/t31-,32+,34?/m0/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human MC4 receptor expressed in CHO cells assessed as increase of alpha-MSH-induced cAMP accumulation

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50323149
PNG
(CHEMBL1209318 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)N(CC(C1CCCCC1)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C)C(=O)c1cccnn1 |r|
Show InChI InChI=1S/C35H50F2N6O2/c1-24(2)43(34(45)31-12-9-15-38-39-31)23-32(25-10-7-6-8-11-25)40-16-18-41(19-17-40)33(44)29-22-42(35(3,4)5)21-28(29)27-14-13-26(36)20-30(27)37/h9,12-15,20,24-25,28-29,32H,6-8,10-11,16-19,21-23H2,1-5H3/t28-,29+,32?/m0/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human MC4 receptor expressed in CHO cells assessed as increase of alpha-MSH-induced cAMP accumulation

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50323149
PNG
(CHEMBL1209318 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)N(CC(C1CCCCC1)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C)C(=O)c1cccnn1 |r|
Show InChI InChI=1S/C35H50F2N6O2/c1-24(2)43(34(45)31-12-9-15-38-39-31)23-32(25-10-7-6-8-11-25)40-16-18-41(19-17-40)33(44)29-22-42(35(3,4)5)21-28(29)27-14-13-26(36)20-30(27)37/h9,12-15,20,24-25,28-29,32H,6-8,10-11,16-19,21-23H2,1-5H3/t28-,29+,32?/m0/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from human MC4 receptor expressed in CHO cells

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 5


(Homo sapiens (Human))		BDBM50323149
PNG
(CHEMBL1209318 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)N(CC(C1CCCCC1)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C)C(=O)c1cccnn1 |r|
Show InChI InChI=1S/C35H50F2N6O2/c1-24(2)43(34(45)31-12-9-15-38-39-31)23-32(25-10-7-6-8-11-25)40-16-18-41(19-17-40)33(44)29-22-42(35(3,4)5)21-28(29)27-14-13-26(36)20-30(27)37/h9,12-15,20,24-25,28-29,32H,6-8,10-11,16-19,21-23H2,1-5H3/t28-,29+,32?/m0/s1
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n/an/a 130n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from human MC5 receptor expressed in CHO cells

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50323148
PNG
(CHEMBL1209319 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)N(CC(C1CCCCC1)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C)C(=O)c1ncccn1 |r|
Show InChI InChI=1S/C35H50F2N6O2/c1-24(2)43(34(45)32-38-14-9-15-39-32)23-31(25-10-7-6-8-11-25)40-16-18-41(19-17-40)33(44)29-22-42(35(3,4)5)21-28(29)27-13-12-26(36)20-30(27)37/h9,12-15,20,24-25,28-29,31H,6-8,10-11,16-19,21-23H2,1-5H3/t28-,29+,31?/m0/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from human MC4 receptor expressed in CHO cells

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50323157
PNG
(CHEMBL1209383 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)N(CC(N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C)C(C)(C)C)C(C)=O |r|
Show InChI InChI=1S/C30H48F2N4O2/c1-20(2)36(21(3)37)19-27(29(4,5)6)33-12-14-34(15-13-33)28(38)25-18-35(30(7,8)9)17-24(25)23-11-10-22(31)16-26(23)32/h10-11,16,20,24-25,27H,12-15,17-19H2,1-9H3/t24-,25+,27?/m0/s1
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n/an/a 150n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from human MC4 receptor expressed in CHO cells

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50323157
PNG
(CHEMBL1209383 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)N(CC(N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C)C(C)(C)C)C(C)=O |r|
Show InChI InChI=1S/C30H48F2N4O2/c1-20(2)36(21(3)37)19-27(29(4,5)6)33-12-14-34(15-13-33)28(38)25-18-35(30(7,8)9)17-24(25)23-11-10-22(31)16-26(23)32/h10-11,16,20,24-25,27H,12-15,17-19H2,1-9H3/t24-,25+,27?/m0/s1
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n/an/a 150n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human MC4 receptor expressed in CHO cells assessed as increase of alpha-MSH-induced cAMP accumulation

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50323153
PNG
(((3S,4R)-1-tert-butyl-4-(2,4-difluorophenyl)pyrrol...)
Show SMILES CCCN(CCC)CC(C1CCCCC1)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C |r|
Show InChI InChI=1S/C33H54F2N4O/c1-6-15-36(16-7-2)24-31(25-11-9-8-10-12-25)37-17-19-38(20-18-37)32(40)29-23-39(33(3,4)5)22-28(29)27-14-13-26(34)21-30(27)35/h13-14,21,25,28-29,31H,6-12,15-20,22-24H2,1-5H3/t28-,29+,31?/m0/s1
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n/an/a 200n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from human MC4 receptor expressed in CHO cells

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 5


(Homo sapiens (Human))		BDBM50323150
PNG
(CHEMBL1209253 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)N(CC(C1CCCCC1)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C)S(C)(=O)=O |r|
Show InChI InChI=1S/C31H50F2N4O3S/c1-22(2)37(41(6,39)40)21-29(23-10-8-7-9-11-23)34-14-16-35(17-15-34)30(38)27-20-36(31(3,4)5)19-26(27)25-13-12-24(32)18-28(25)33/h12-13,18,22-23,26-27,29H,7-11,14-17,19-21H2,1-6H3/t26-,27+,29?/m0/s1
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n/an/a 250n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from human MC5 receptor expressed in CHO cells

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50323152
PNG
(((3S,4R)-1-tert-butyl-4-(2,4-difluorophenyl)pyrrol...)
Show SMILES CCN(CC)CC(C1CCCCC1)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C |r|
Show InChI InChI=1S/C31H50F2N4O/c1-6-34(7-2)22-29(23-11-9-8-10-12-23)35-15-17-36(18-16-35)30(38)27-21-37(31(3,4)5)20-26(27)25-14-13-24(32)19-28(25)33/h13-14,19,23,26-27,29H,6-12,15-18,20-22H2,1-5H3/t26-,27+,29?/m0/s1
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n/an/a 260n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human MC4 receptor expressed in CHO cells assessed as increase of alpha-MSH-induced cAMP accumulation

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50323155
PNG
(((3S,4R)-1-tert-butyl-4-(2,4-difluorophenyl)pyrrol...)
Show SMILES CC(C)NCC(C1CCCCC1)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C |r|
Show InChI InChI=1S/C30H48F2N4O/c1-21(2)33-18-28(22-9-7-6-8-10-22)34-13-15-35(16-14-34)29(37)26-20-36(30(3,4)5)19-25(26)24-12-11-23(31)17-27(24)32/h11-12,17,21-22,25-26,28,33H,6-10,13-16,18-20H2,1-5H3/t25-,26+,28?/m0/s1
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n/an/a 310n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human MC4 receptor expressed in CHO cells assessed as increase of alpha-MSH-induced cAMP accumulation

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 5


(Homo sapiens (Human))		BDBM50323160
PNG
(CHEMBL1209320 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)N(CC(C1CCCCC1)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C)C(=O)c1cnn(c1)C(C)C |r|
Show InChI InChI=1S/C37H56F2N6O2/c1-25(2)44(35(46)28-20-40-45(21-28)26(3)4)24-34(27-11-9-8-10-12-27)41-15-17-42(18-16-41)36(47)32-23-43(37(5,6)7)22-31(32)30-14-13-29(38)19-33(30)39/h13-14,19-21,25-27,31-32,34H,8-12,15-18,22-24H2,1-7H3/t31-,32+,34?/m0/s1
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n/an/a 620n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from human MC5 receptor expressed in CHO cells

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 5


(Homo sapiens (Human))		BDBM50323151
PNG
(CHEMBL1209252 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)N(CC(C1CCCCC1)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C)C(C)=O |r|
Show InChI InChI=1S/C32H50F2N4O2/c1-22(2)38(23(3)39)21-30(24-10-8-7-9-11-24)35-14-16-36(17-15-35)31(40)28-20-37(32(4,5)6)19-27(28)26-13-12-25(33)18-29(26)34/h12-13,18,22,24,27-28,30H,7-11,14-17,19-21H2,1-6H3/t27-,28+,30?/m0/s1
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n/an/a 660n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from human MC5 receptor expressed in CHO cells

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocyte-stimulating hormone receptor


(Homo sapiens (Human))		BDBM50323160
PNG
(CHEMBL1209320 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)N(CC(C1CCCCC1)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C)C(=O)c1cnn(c1)C(C)C |r|
Show InChI InChI=1S/C37H56F2N6O2/c1-25(2)44(35(46)28-20-40-45(21-28)26(3)4)24-34(27-11-9-8-10-12-27)41-15-17-42(18-16-41)36(47)32-23-43(37(5,6)7)22-31(32)30-14-13-29(38)19-33(30)39/h13-14,19-21,25-27,31-32,34H,8-12,15-18,22-24H2,1-7H3/t31-,32+,34?/m0/s1
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n/an/a 730n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from human MC1 receptor expressed in CHO cells

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Homo sapiens (Human))		BDBM50323149
PNG
(CHEMBL1209318 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)N(CC(C1CCCCC1)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C)C(=O)c1cccnn1 |r|
Show InChI InChI=1S/C35H50F2N6O2/c1-24(2)43(34(45)31-12-9-15-38-39-31)23-32(25-10-7-6-8-11-25)40-16-18-41(19-17-40)33(44)29-22-42(35(3,4)5)21-28(29)27-14-13-26(36)20-30(27)37/h9,12-15,20,24-25,28-29,32H,6-8,10-11,16-19,21-23H2,1-5H3/t28-,29+,32?/m0/s1
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n/an/a 770n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from human MC3 receptor expressed in CHO cells

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Homo sapiens (Human))		BDBM50323160
PNG
(CHEMBL1209320 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)N(CC(C1CCCCC1)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C)C(=O)c1cnn(c1)C(C)C |r|
Show InChI InChI=1S/C37H56F2N6O2/c1-25(2)44(35(46)28-20-40-45(21-28)26(3)4)24-34(27-11-9-8-10-12-27)41-15-17-42(18-16-41)36(47)32-23-43(37(5,6)7)22-31(32)30-14-13-29(38)19-33(30)39/h13-14,19-21,25-27,31-32,34H,8-12,15-18,22-24H2,1-7H3/t31-,32+,34?/m0/s1
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n/an/a 870n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from human MC3 receptor expressed in CHO cells

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocyte-stimulating hormone receptor


(Homo sapiens (Human))		BDBM50323150
PNG
(CHEMBL1209253 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)N(CC(C1CCCCC1)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C)S(C)(=O)=O |r|
Show InChI InChI=1S/C31H50F2N4O3S/c1-22(2)37(41(6,39)40)21-29(23-10-8-7-9-11-23)34-14-16-35(17-15-34)30(38)27-20-36(31(3,4)5)19-26(27)25-13-12-24(32)18-28(25)33/h12-13,18,22-23,26-27,29H,7-11,14-17,19-21H2,1-6H3/t26-,27+,29?/m0/s1
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n/an/a 1.00E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from human MC1 receptor expressed in CHO cells

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 5


(Homo sapiens (Human))		BDBM50323159
PNG
(CHEMBL1209321 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)CC(CN(C(C)C)C(C)=O)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C |r|
Show InChI InChI=1S/C30H48F2N4O2/c1-20(2)15-24(17-36(21(3)4)22(5)37)33-11-13-34(14-12-33)29(38)27-19-35(30(6,7)8)18-26(27)25-10-9-23(31)16-28(25)32/h9-10,16,20-21,24,26-27H,11-15,17-19H2,1-8H3/t24?,26-,27+/m0/s1
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n/an/a 1.10E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from human MC5 receptor expressed in CHO cells

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocyte-stimulating hormone receptor


(Homo sapiens (Human))		BDBM50323151
PNG
(CHEMBL1209252 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)N(CC(C1CCCCC1)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C)C(C)=O |r|
Show InChI InChI=1S/C32H50F2N4O2/c1-22(2)38(23(3)39)21-30(24-10-8-7-9-11-24)35-14-16-36(17-15-35)31(40)28-20-37(32(4,5)6)19-27(28)26-13-12-25(33)18-29(26)34/h12-13,18,22,24,27-28,30H,7-11,14-17,19-21H2,1-6H3/t27-,28+,30?/m0/s1
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n/an/a 1.80E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from human MC1 receptor expressed in CHO cells

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocyte-stimulating hormone receptor


(Homo sapiens (Human))		BDBM50323149
PNG
(CHEMBL1209318 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)N(CC(C1CCCCC1)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C)C(=O)c1cccnn1 |r|
Show InChI InChI=1S/C35H50F2N6O2/c1-24(2)43(34(45)31-12-9-15-38-39-31)23-32(25-10-7-6-8-11-25)40-16-18-41(19-17-40)33(44)29-22-42(35(3,4)5)21-28(29)27-14-13-26(36)20-30(27)37/h9,12-15,20,24-25,28-29,32H,6-8,10-11,16-19,21-23H2,1-5H3/t28-,29+,32?/m0/s1
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n/an/a 1.90E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from human MC1 receptor expressed in CHO cells

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50323154
PNG
(((3S,4R)-1-tert-butyl-4-(2,4-difluorophenyl)pyrrol...)
Show SMILES CC(C)CN(CC(C)C)CC(C1CCCCC1)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C |r|
Show InChI InChI=1S/C35H58F2N4O/c1-25(2)20-38(21-26(3)4)24-33(27-11-9-8-10-12-27)39-15-17-40(18-16-39)34(42)31-23-41(35(5,6)7)22-30(31)29-14-13-28(36)19-32(29)37/h13-14,19,25-27,30-31,33H,8-12,15-18,20-24H2,1-7H3/t30-,31+,33?/m0/s1
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n/an/a 1.90E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human MC4 receptor expressed in CHO cells assessed as increase of alpha-MSH-induced cAMP accumulation

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 5


(Homo sapiens (Human))		BDBM50323158
PNG
(CHEMBL1209382 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)CC(CN(C(C)C)S(C)(=O)=O)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C |r|
Show InChI InChI=1S/C29H48F2N4O3S/c1-20(2)15-23(17-35(21(3)4)39(8,37)38)32-11-13-33(14-12-32)28(36)26-19-34(29(5,6)7)18-25(26)24-10-9-22(30)16-27(24)31/h9-10,16,20-21,23,25-26H,11-15,17-19H2,1-8H3/t23?,25-,26+/m0/s1
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n/an/a 2.80E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from human MC5 receptor expressed in CHO cells

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocyte-stimulating hormone receptor


(Homo sapiens (Human))		BDBM50323159
PNG
(CHEMBL1209321 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)CC(CN(C(C)C)C(C)=O)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C |r|
Show InChI InChI=1S/C30H48F2N4O2/c1-20(2)15-24(17-36(21(3)4)22(5)37)33-11-13-34(14-12-33)29(38)27-19-35(30(6,7)8)18-26(27)25-10-9-23(31)16-28(25)32/h9-10,16,20-21,24,26-27H,11-15,17-19H2,1-8H3/t24?,26-,27+/m0/s1
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n/an/a 3.60E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from human MC1 receptor expressed in CHO cells

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Homo sapiens (Human))		BDBM50323150
PNG
(CHEMBL1209253 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)N(CC(C1CCCCC1)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C)S(C)(=O)=O |r|
Show InChI InChI=1S/C31H50F2N4O3S/c1-22(2)37(41(6,39)40)21-29(23-10-8-7-9-11-23)34-14-16-35(17-15-34)30(38)27-20-36(31(3,4)5)19-26(27)25-13-12-24(32)18-28(25)33/h12-13,18,22-23,26-27,29H,7-11,14-17,19-21H2,1-6H3/t26-,27+,29?/m0/s1
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n/an/a 3.60E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from human MC3 receptor expressed in CHO cells

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Homo sapiens (Human))		BDBM50323159
PNG
(CHEMBL1209321 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)CC(CN(C(C)C)C(C)=O)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C |r|
Show InChI InChI=1S/C30H48F2N4O2/c1-20(2)15-24(17-36(21(3)4)22(5)37)33-11-13-34(14-12-33)29(38)27-19-35(30(6,7)8)18-26(27)25-10-9-23(31)16-28(25)32/h9-10,16,20-21,24,26-27H,11-15,17-19H2,1-8H3/t24?,26-,27+/m0/s1
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n/an/a 4.70E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from human MC3 receptor expressed in CHO cells

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Homo sapiens (Human))		BDBM50323158
PNG
(CHEMBL1209382 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)CC(CN(C(C)C)S(C)(=O)=O)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C |r|
Show InChI InChI=1S/C29H48F2N4O3S/c1-20(2)15-23(17-35(21(3)4)39(8,37)38)32-11-13-33(14-12-32)28(36)26-19-34(29(5,6)7)18-25(26)24-10-9-22(30)16-27(24)31/h9-10,16,20-21,23,25-26H,11-15,17-19H2,1-8H3/t23?,25-,26+/m0/s1
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n/an/a 4.90E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from human MC3 receptor expressed in CHO cells

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocyte-stimulating hormone receptor


(Homo sapiens (Human))		BDBM50323158
PNG
(CHEMBL1209382 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)CC(CN(C(C)C)S(C)(=O)=O)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C |r|
Show InChI InChI=1S/C29H48F2N4O3S/c1-20(2)15-23(17-35(21(3)4)39(8,37)38)32-11-13-33(14-12-32)28(36)26-19-34(29(5,6)7)18-25(26)24-10-9-22(30)16-27(24)31/h9-10,16,20-21,23,25-26H,11-15,17-19H2,1-8H3/t23?,25-,26+/m0/s1
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n/an/a 5.00E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human MC1 receptor expressed in CHO cells assessed as increase of alpha-MSH-induced cAMP accumulation

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Homo sapiens (Human))		BDBM50323151
PNG
(CHEMBL1209252 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)N(CC(C1CCCCC1)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C)C(C)=O |r|
Show InChI InChI=1S/C32H50F2N4O2/c1-22(2)38(23(3)39)21-30(24-10-8-7-9-11-24)35-14-16-36(17-15-35)31(40)28-20-37(32(4,5)6)19-27(28)26-13-12-25(33)18-29(26)34/h12-13,18,22,24,27-28,30H,7-11,14-17,19-21H2,1-6H3/t27-,28+,30?/m0/s1
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n/an/a 6.50E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from human MC3 receptor expressed in CHO cells

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocyte-stimulating hormone receptor


(Homo sapiens (Human))		BDBM50323149
PNG
(CHEMBL1209318 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)N(CC(C1CCCCC1)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C)C(=O)c1cccnn1 |r|
Show InChI InChI=1S/C35H50F2N6O2/c1-24(2)43(34(45)31-12-9-15-38-39-31)23-32(25-10-7-6-8-11-25)40-16-18-41(19-17-40)33(44)29-22-42(35(3,4)5)21-28(29)27-14-13-26(36)20-30(27)37/h9,12-15,20,24-25,28-29,32H,6-8,10-11,16-19,21-23H2,1-5H3/t28-,29+,32?/m0/s1
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n/an/an/an/a 1.20E+3n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human MC1 receptor expressed in CHO cells assessed as increase of alpha-MSH-induced cAMP accumulation

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocyte-stimulating hormone receptor


(Homo sapiens (Human))		BDBM50323151
PNG
(CHEMBL1209252 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)N(CC(C1CCCCC1)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C)C(C)=O |r|
Show InChI InChI=1S/C32H50F2N4O2/c1-22(2)38(23(3)39)21-30(24-10-8-7-9-11-24)35-14-16-36(17-15-35)31(40)28-20-37(32(4,5)6)19-27(28)26-13-12-25(33)18-29(26)34/h12-13,18,22,24,27-28,30H,7-11,14-17,19-21H2,1-6H3/t27-,28+,30?/m0/s1
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n/an/an/an/a 890n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human MC1 receptor expressed in CHO cells assessed as increase of alpha-MSH-induced cAMP accumulation

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50323159
PNG
(CHEMBL1209321 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)CC(CN(C(C)C)C(C)=O)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C |r|
Show InChI InChI=1S/C30H48F2N4O2/c1-20(2)15-24(17-36(21(3)4)22(5)37)33-11-13-34(14-12-33)29(38)27-19-35(30(6,7)8)18-26(27)25-10-9-23(31)16-28(25)32/h9-10,16,20-21,24,26-27H,11-15,17-19H2,1-8H3/t24?,26-,27+/m0/s1
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n/an/an/an/a 9.70n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human MC4 receptor expressed in CHO cells assessed as increase of alpha-MSH-induced cAMP accumulation

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50323154
PNG
(((3S,4R)-1-tert-butyl-4-(2,4-difluorophenyl)pyrrol...)
Show SMILES CC(C)CN(CC(C)C)CC(C1CCCCC1)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C |r|
Show InChI InChI=1S/C35H58F2N4O/c1-25(2)20-38(21-26(3)4)24-33(27-11-9-8-10-12-27)39-15-17-40(18-16-39)34(42)31-23-41(35(5,6)7)22-30(31)29-14-13-28(36)19-32(29)37/h13-14,19,25-27,30-31,33H,8-12,15-18,20-24H2,1-7H3/t30-,31+,33?/m0/s1
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n/an/an/an/a 6.70E+3n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human MC4 receptor expressed in CHO cells assessed as increase of alpha-MSH-induced cAMP accumulation

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50323160
PNG
(CHEMBL1209320 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)N(CC(C1CCCCC1)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C)C(=O)c1cnn(c1)C(C)C |r|
Show InChI InChI=1S/C37H56F2N6O2/c1-25(2)44(35(46)28-20-40-45(21-28)26(3)4)24-34(27-11-9-8-10-12-27)41-15-17-42(18-16-41)36(47)32-23-43(37(5,6)7)22-31(32)30-14-13-29(38)19-33(30)39/h13-14,19-21,25-27,31-32,34H,8-12,15-18,22-24H2,1-7H3/t31-,32+,34?/m0/s1
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n/an/an/an/a 19n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human MC4 receptor expressed in CHO cells assessed as increase of alpha-MSH-induced cAMP accumulation

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Homo sapiens (Human))		BDBM50323150
PNG
(CHEMBL1209253 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)N(CC(C1CCCCC1)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C)S(C)(=O)=O |r|
Show InChI InChI=1S/C31H50F2N4O3S/c1-22(2)37(41(6,39)40)21-29(23-10-8-7-9-11-23)34-14-16-35(17-15-34)30(38)27-20-36(31(3,4)5)19-26(27)25-13-12-24(32)18-28(25)33/h12-13,18,22-23,26-27,29H,7-11,14-17,19-21H2,1-6H3/t26-,27+,29?/m0/s1
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n/an/an/an/a 1.80E+3n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human MC3 receptor expressed in CHO cells assessed as increase of alpha-MSH-induced cAMP accumulation

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Homo sapiens (Human))		BDBM50323149
PNG
(CHEMBL1209318 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)N(CC(C1CCCCC1)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C)C(=O)c1cccnn1 |r|
Show InChI InChI=1S/C35H50F2N6O2/c1-24(2)43(34(45)31-12-9-15-38-39-31)23-32(25-10-7-6-8-11-25)40-16-18-41(19-17-40)33(44)29-22-42(35(3,4)5)21-28(29)27-14-13-26(36)20-30(27)37/h9,12-15,20,24-25,28-29,32H,6-8,10-11,16-19,21-23H2,1-5H3/t28-,29+,32?/m0/s1
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n/an/an/an/a 90n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human MC3 receptor expressed in CHO cells assessed as increase of alpha-MSH-induced cAMP accumulation

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 5


(Homo sapiens (Human))		BDBM50323158
PNG
(CHEMBL1209382 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)CC(CN(C(C)C)S(C)(=O)=O)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C |r|
Show InChI InChI=1S/C29H48F2N4O3S/c1-20(2)15-23(17-35(21(3)4)39(8,37)38)32-11-13-33(14-12-32)28(36)26-19-34(29(5,6)7)18-25(26)24-10-9-22(30)16-27(24)31/h9-10,16,20-21,23,25-26H,11-15,17-19H2,1-8H3/t23?,25-,26+/m0/s1
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n/an/an/an/a>5.00E+3n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human MC5 receptor expressed in CHO cells assessed as increase of alpha-MSH-induced cAMP accumulation

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 5


(Homo sapiens (Human))		BDBM50323150
PNG
(CHEMBL1209253 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)N(CC(C1CCCCC1)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C)S(C)(=O)=O |r|
Show InChI InChI=1S/C31H50F2N4O3S/c1-22(2)37(41(6,39)40)21-29(23-10-8-7-9-11-23)34-14-16-35(17-15-34)30(38)27-20-36(31(3,4)5)19-26(27)25-13-12-24(32)18-28(25)33/h12-13,18,22-23,26-27,29H,7-11,14-17,19-21H2,1-6H3/t26-,27+,29?/m0/s1
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n/an/an/an/a>5.00E+3n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human MC5 receptor expressed in CHO cells assessed as increase of alpha-MSH-induced cAMP accumulation

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Homo sapiens (Human))		BDBM50323158
PNG
(CHEMBL1209382 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)CC(CN(C(C)C)S(C)(=O)=O)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C |r|
Show InChI InChI=1S/C29H48F2N4O3S/c1-20(2)15-23(17-35(21(3)4)39(8,37)38)32-11-13-33(14-12-32)28(36)26-19-34(29(5,6)7)18-25(26)24-10-9-22(30)16-27(24)31/h9-10,16,20-21,23,25-26H,11-15,17-19H2,1-8H3/t23?,25-,26+/m0/s1
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n/an/an/an/a 2.50E+3n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human MC3 receptor expressed in CHO cells assessed as increase of alpha-MSH-induced cAMP accumulation

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50323151
PNG
(CHEMBL1209252 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)N(CC(C1CCCCC1)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C)C(C)=O |r|
Show InChI InChI=1S/C32H50F2N4O2/c1-22(2)38(23(3)39)21-30(24-10-8-7-9-11-24)35-14-16-36(17-15-35)31(40)28-20-37(32(4,5)6)19-27(28)26-13-12-25(33)18-29(26)34/h12-13,18,22,24,27-28,30H,7-11,14-17,19-21H2,1-6H3/t27-,28+,30?/m0/s1
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n/an/an/an/a 25n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human MC4 receptor expressed in CHO cells assessed as increase of alpha-MSH-induced cAMP accumulation

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocyte-stimulating hormone receptor


(Homo sapiens (Human))		BDBM50323158
PNG
(CHEMBL1209382 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)CC(CN(C(C)C)S(C)(=O)=O)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C |r|
Show InChI InChI=1S/C29H48F2N4O3S/c1-20(2)15-23(17-35(21(3)4)39(8,37)38)32-11-13-33(14-12-32)28(36)26-19-34(29(5,6)7)18-25(26)24-10-9-22(30)16-27(24)31/h9-10,16,20-21,23,25-26H,11-15,17-19H2,1-8H3/t23?,25-,26+/m0/s1
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n/an/an/an/a>5.00E+3n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human MC1 receptor expressed in CHO cells assessed as increase of alpha-MSH-induced cAMP accumulation

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50323150
PNG
(CHEMBL1209253 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)N(CC(C1CCCCC1)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C)S(C)(=O)=O |r|
Show InChI InChI=1S/C31H50F2N4O3S/c1-22(2)37(41(6,39)40)21-29(23-10-8-7-9-11-23)34-14-16-35(17-15-34)30(38)27-20-36(31(3,4)5)19-26(27)25-13-12-24(32)18-28(25)33/h12-13,18,22-23,26-27,29H,7-11,14-17,19-21H2,1-6H3/t26-,27+,29?/m0/s1
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n/an/an/an/a 13n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human MC4 receptor expressed in CHO cells assessed as increase of alpha-MSH-induced cAMP accumulation

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocyte-stimulating hormone receptor


(Homo sapiens (Human))		BDBM50323159
PNG
(CHEMBL1209321 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)CC(CN(C(C)C)C(C)=O)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C |r|
Show InChI InChI=1S/C30H48F2N4O2/c1-20(2)15-24(17-36(21(3)4)22(5)37)33-11-13-34(14-12-33)29(38)27-19-35(30(6,7)8)18-26(27)25-10-9-23(31)16-28(25)32/h9-10,16,20-21,24,26-27H,11-15,17-19H2,1-8H3/t24?,26-,27+/m0/s1
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n/an/an/an/a 560n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human MC1 receptor expressed in CHO cells assessed as increase of alpha-MSH-induced cAMP accumulation

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocyte-stimulating hormone receptor


(Homo sapiens (Human))		BDBM50323150
PNG
(CHEMBL1209253 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)N(CC(C1CCCCC1)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C)S(C)(=O)=O |r|
Show InChI InChI=1S/C31H50F2N4O3S/c1-22(2)37(41(6,39)40)21-29(23-10-8-7-9-11-23)34-14-16-35(17-15-34)30(38)27-20-36(31(3,4)5)19-26(27)25-13-12-24(32)18-28(25)33/h12-13,18,22-23,26-27,29H,7-11,14-17,19-21H2,1-6H3/t26-,27+,29?/m0/s1
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n/an/an/an/a 540n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human MC1 receptor expressed in CHO cells assessed as increase of alpha-MSH-induced cAMP accumulation

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Homo sapiens (Human))		BDBM50323160
PNG
(CHEMBL1209320 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)N(CC(C1CCCCC1)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C)C(=O)c1cnn(c1)C(C)C |r|
Show InChI InChI=1S/C37H56F2N6O2/c1-25(2)44(35(46)28-20-40-45(21-28)26(3)4)24-34(27-11-9-8-10-12-27)41-15-17-42(18-16-41)36(47)32-23-43(37(5,6)7)22-31(32)30-14-13-29(38)19-33(30)39/h13-14,19-21,25-27,31-32,34H,8-12,15-18,22-24H2,1-7H3/t31-,32+,34?/m0/s1
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n/an/an/an/a 79n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human MC3 receptor expressed in CHO cells assessed as increase of alpha-MSH-induced cAMP accumulation

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50323158
PNG
(CHEMBL1209382 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)CC(CN(C(C)C)S(C)(=O)=O)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C |r|
Show InChI InChI=1S/C29H48F2N4O3S/c1-20(2)15-23(17-35(21(3)4)39(8,37)38)32-11-13-33(14-12-32)28(36)26-19-34(29(5,6)7)18-25(26)24-10-9-22(30)16-27(24)31/h9-10,16,20-21,23,25-26H,11-15,17-19H2,1-8H3/t23?,25-,26+/m0/s1
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n/an/an/an/a 19n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human MC4 receptor expressed in CHO cells assessed as increase of alpha-MSH-induced cAMP accumulation

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50323155
PNG
(((3S,4R)-1-tert-butyl-4-(2,4-difluorophenyl)pyrrol...)
Show SMILES CC(C)NCC(C1CCCCC1)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C |r|
Show InChI InChI=1S/C30H48F2N4O/c1-21(2)33-18-28(22-9-7-6-8-10-22)34-13-15-35(16-14-34)29(37)26-20-36(30(3,4)5)19-25(26)24-12-11-23(31)17-27(24)32/h11-12,17,21-22,25-26,28,33H,6-10,13-16,18-20H2,1-5H3/t25-,26+,28?/m0/s1
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n/an/an/an/a 240n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human MC4 receptor expressed in CHO cells assessed as increase of alpha-MSH-induced cAMP accumulation

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50323156
PNG
(CHEMBL1209458 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)N(CC(N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C)C(C)(C)C)S(C)(=O)=O |r|
Show InChI InChI=1S/C29H48F2N4O3S/c1-20(2)35(39(9,37)38)19-26(28(3,4)5)32-12-14-33(15-13-32)27(36)24-18-34(29(6,7)8)17-23(24)22-11-10-21(30)16-25(22)31/h10-11,16,20,23-24,26H,12-15,17-19H2,1-9H3/t23-,24+,26?/m0/s1
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n/an/an/an/a 44n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human MC4 receptor expressed in CHO cells assessed as increase of alpha-MSH-induced cAMP accumulation

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50323157
PNG
(CHEMBL1209383 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)N(CC(N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C)C(C)(C)C)C(C)=O |r|
Show InChI InChI=1S/C30H48F2N4O2/c1-20(2)36(21(3)37)19-27(29(4,5)6)33-12-14-34(15-13-33)28(38)25-18-35(30(7,8)9)17-24(25)23-11-10-22(31)16-26(23)32/h10-11,16,20,24-25,27H,12-15,17-19H2,1-9H3/t24-,25+,27?/m0/s1
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n/an/an/an/a 180n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human MC4 receptor expressed in CHO cells assessed as increase of alpha-MSH-induced cAMP accumulation

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50323148
PNG
(CHEMBL1209319 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)N(CC(C1CCCCC1)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C)C(=O)c1ncccn1 |r|
Show InChI InChI=1S/C35H50F2N6O2/c1-24(2)43(34(45)32-38-14-9-15-39-32)23-31(25-10-7-6-8-11-25)40-16-18-41(19-17-40)33(44)29-22-42(35(3,4)5)21-28(29)27-13-12-26(36)20-30(27)37/h9,12-15,20,24-25,28-29,31H,6-8,10-11,16-19,21-23H2,1-5H3/t28-,29+,31?/m0/s1
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n/an/an/an/a 15n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human MC4 receptor expressed in CHO cells assessed as increase of alpha-MSH-induced cAMP accumulation

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50323152
PNG
(((3S,4R)-1-tert-butyl-4-(2,4-difluorophenyl)pyrrol...)
Show SMILES CCN(CC)CC(C1CCCCC1)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C |r|
Show InChI InChI=1S/C31H50F2N4O/c1-6-34(7-2)22-29(23-11-9-8-10-12-23)35-15-17-36(18-16-35)30(38)27-21-37(31(3,4)5)20-26(27)25-14-13-24(32)19-28(25)33/h13-14,19,23,26-27,29H,6-12,15-18,20-22H2,1-5H3/t26-,27+,29?/m0/s1
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n/an/an/an/a 570n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human MC4 receptor expressed in CHO cells assessed as increase of alpha-MSH-induced cAMP accumulation

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50323153
PNG
(((3S,4R)-1-tert-butyl-4-(2,4-difluorophenyl)pyrrol...)
Show SMILES CCCN(CCC)CC(C1CCCCC1)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C |r|
Show InChI InChI=1S/C33H54F2N4O/c1-6-15-36(16-7-2)24-31(25-11-9-8-10-12-25)37-17-19-38(20-18-37)32(40)29-23-39(33(3,4)5)22-28(29)27-14-13-26(34)21-30(27)35/h13-14,21,25,28-29,31H,6-12,15-20,22-24H2,1-5H3/t28-,29+,31?/m0/s1
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n/an/an/an/a 710n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human MC4 receptor expressed in CHO cells assessed as increase of alpha-MSH-induced cAMP accumulation

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 5


(Homo sapiens (Human))		BDBM50323160
PNG
(CHEMBL1209320 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)N(CC(C1CCCCC1)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C)C(=O)c1cnn(c1)C(C)C |r|
Show InChI InChI=1S/C37H56F2N6O2/c1-25(2)44(35(46)28-20-40-45(21-28)26(3)4)24-34(27-11-9-8-10-12-27)41-15-17-42(18-16-41)36(47)32-23-43(37(5,6)7)22-31(32)30-14-13-29(38)19-33(30)39/h13-14,19-21,25-27,31-32,34H,8-12,15-18,22-24H2,1-7H3/t31-,32+,34?/m0/s1
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n/an/an/an/a 1.00E+3n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human MC5 receptor expressed in CHO cells assessed as increase of alpha-MSH-induced cAMP accumulation

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 5


(Homo sapiens (Human))		BDBM50323159
PNG
(CHEMBL1209321 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)CC(CN(C(C)C)C(C)=O)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C |r|
Show InChI InChI=1S/C30H48F2N4O2/c1-20(2)15-24(17-36(21(3)4)22(5)37)33-11-13-34(14-12-33)29(38)27-19-35(30(6,7)8)18-26(27)25-10-9-23(31)16-28(25)32/h9-10,16,20-21,24,26-27H,11-15,17-19H2,1-8H3/t24?,26-,27+/m0/s1
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n/an/an/an/a>5.00E+3n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human MC5 receptor expressed in CHO cells assessed as increase of alpha-MSH-induced cAMP accumulation

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 5


(Homo sapiens (Human))		BDBM50323149
PNG
(CHEMBL1209318 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)N(CC(C1CCCCC1)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C)C(=O)c1cccnn1 |r|
Show InChI InChI=1S/C35H50F2N6O2/c1-24(2)43(34(45)31-12-9-15-38-39-31)23-32(25-10-7-6-8-11-25)40-16-18-41(19-17-40)33(44)29-22-42(35(3,4)5)21-28(29)27-14-13-26(36)20-30(27)37/h9,12-15,20,24-25,28-29,32H,6-8,10-11,16-19,21-23H2,1-5H3/t28-,29+,32?/m0/s1
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n/an/an/an/a 490n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human MC5 receptor expressed in CHO cells assessed as increase of alpha-MSH-induced cAMP accumulation

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50323149
PNG
(CHEMBL1209318 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)N(CC(C1CCCCC1)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C)C(=O)c1cccnn1 |r|
Show InChI InChI=1S/C35H50F2N6O2/c1-24(2)43(34(45)31-12-9-15-38-39-31)23-32(25-10-7-6-8-11-25)40-16-18-41(19-17-40)33(44)29-22-42(35(3,4)5)21-28(29)27-14-13-26(36)20-30(27)37/h9,12-15,20,24-25,28-29,32H,6-8,10-11,16-19,21-23H2,1-5H3/t28-,29+,32?/m0/s1
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n/an/an/an/a 9.10n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human MC4 receptor expressed in CHO cells assessed as increase of alpha-MSH-induced cAMP accumulation

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocyte-stimulating hormone receptor


(Homo sapiens (Human))		BDBM50323160
PNG
(CHEMBL1209320 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)N(CC(C1CCCCC1)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C)C(=O)c1cnn(c1)C(C)C |r|
Show InChI InChI=1S/C37H56F2N6O2/c1-25(2)44(35(46)28-20-40-45(21-28)26(3)4)24-34(27-11-9-8-10-12-27)41-15-17-42(18-16-41)36(47)32-23-43(37(5,6)7)22-31(32)30-14-13-29(38)19-33(30)39/h13-14,19-21,25-27,31-32,34H,8-12,15-18,22-24H2,1-7H3/t31-,32+,34?/m0/s1
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n/an/an/an/a 520n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human MC1 receptor expressed in CHO cells assessed as increase of alpha-MSH-induced cAMP accumulation

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50323148
PNG
(CHEMBL1209319 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)N(CC(C1CCCCC1)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C)C(=O)c1ncccn1 |r|
Show InChI InChI=1S/C35H50F2N6O2/c1-24(2)43(34(45)32-38-14-9-15-39-32)23-31(25-10-7-6-8-11-25)40-16-18-41(19-17-40)33(44)29-22-42(35(3,4)5)21-28(29)27-13-12-26(36)20-30(27)37/h9,12-15,20,24-25,28-29,31H,6-8,10-11,16-19,21-23H2,1-5H3/t28-,29+,31?/m0/s1
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n/an/an/an/a 15n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human MC4 receptor expressed in CHO cells assessed as increase of alpha-MSH-induced cAMP accumulation

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Homo sapiens (Human))		BDBM50323159
PNG
(CHEMBL1209321 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)CC(CN(C(C)C)C(C)=O)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C |r|
Show InChI InChI=1S/C30H48F2N4O2/c1-20(2)15-24(17-36(21(3)4)22(5)37)33-11-13-34(14-12-33)29(38)27-19-35(30(6,7)8)18-26(27)25-10-9-23(31)16-28(25)32/h9-10,16,20-21,24,26-27H,11-15,17-19H2,1-8H3/t24?,26-,27+/m0/s1
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n/an/an/an/a 880n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human MC3 receptor expressed in CHO cells assessed as increase of alpha-MSH-induced cAMP accumulation

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 5


(Homo sapiens (Human))		BDBM50323151
PNG
(CHEMBL1209252 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)N(CC(C1CCCCC1)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C)C(C)=O |r|
Show InChI InChI=1S/C32H50F2N4O2/c1-22(2)38(23(3)39)21-30(24-10-8-7-9-11-24)35-14-16-36(17-15-35)31(40)28-20-37(32(4,5)6)19-27(28)26-13-12-25(33)18-29(26)34/h12-13,18,22,24,27-28,30H,7-11,14-17,19-21H2,1-6H3/t27-,28+,30?/m0/s1
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n/an/an/an/a 2.80E+3n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human MC5 receptor expressed in CHO cells assessed as increase of alpha-MSH-induced cAMP accumulation

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Homo sapiens (Human))		BDBM50323151
PNG
(CHEMBL1209252 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...)
Show SMILES CC(C)N(CC(C1CCCCC1)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C)C(C)=O |r|
Show InChI InChI=1S/C32H50F2N4O2/c1-22(2)38(23(3)39)21-30(24-10-8-7-9-11-24)35-14-16-36(17-15-35)31(40)28-20-37(32(4,5)6)19-27(28)26-13-12-25(33)18-29(26)34/h12-13,18,22,24,27-28,30H,7-11,14-17,19-21H2,1-6H3/t27-,28+,30?/m0/s1
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n/an/an/an/a 2.00E+3n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human MC3 receptor expressed in CHO cells assessed as increase of alpha-MSH-induced cAMP accumulation

Bioorg Med Chem Lett 20: 4483-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.038
BindingDB Entry DOI: 10.7270/Q2C829GJ
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%