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PubMed code 16183282

Compile data set for download or QSAR
Found 47 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))		BDBM50174251
PNG
((S)-N-((R)-3-(4-chlorophenyl)-1-oxo-1-(4-(1-((2-ph...)
Show SMILES Clc1ccc(C[C@@H](NC(=O)[C@@H]2Cc3ccccc3CN2)C(=O)N2CCN(CC2)C2(CNC(=O)Cc3ccccc3)CCCCC2)cc1
Show InChI InChI=1S/C38H46ClN5O3/c39-32-15-13-29(14-16-32)23-34(42-36(46)33-25-30-11-5-6-12-31(30)26-40-33)37(47)43-19-21-44(22-20-43)38(17-7-2-8-18-38)27-41-35(45)24-28-9-3-1-4-10-28/h1,3-6,9-16,33-34,40H,2,7-8,17-27H2,(H,41,45)(H,42,46)/t33-,34+/m0/s1
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 11n/an/an/an/an/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-MSH from human MC4R expressed in HEK293 cells

Bioorg Med Chem Lett 15: 5237-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.061
BindingDB Entry DOI: 10.7270/Q2794476
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50174233
PNG
(CHEMBL373037 | N-((R)-1-(4-chloro-benzyl)-2-oxo-2-...)
Show SMILES Clc1ccc(C[C@@H](NC(=O)CC2Cc3ccccc3CN2)C(=O)N2CCN(CC2)C2(CNC(=O)Cc3ccccc3)CCCCC2)cc1
Show InChI InChI=1S/C39H48ClN5O3/c40-33-15-13-30(14-16-33)23-35(43-37(47)26-34-25-31-11-5-6-12-32(31)27-41-34)38(48)44-19-21-45(22-20-44)39(17-7-2-8-18-39)28-42-36(46)24-29-9-3-1-4-10-29/h1,3-6,9-16,34-35,41H,2,7-8,17-28H2,(H,42,46)(H,43,47)/t34?,35-/m1/s1
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 16n/an/an/an/an/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-MSH from human MC4R expressed in HEK293 cells

Bioorg Med Chem Lett 15: 5237-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.061
BindingDB Entry DOI: 10.7270/Q2794476
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50174243
PNG
((R)-N-((R)-3-(4-chlorophenyl)-1-oxo-1-(4-(1-((2-ph...)
Show SMILES Clc1ccc(C[C@@H](NC(=O)[C@H]2Cc3ccccc3CN2)C(=O)N2CCN(CC2)C2(CNC(=O)Cc3ccccc3)CCCCC2)cc1
Show InChI InChI=1S/C38H46ClN5O3/c39-32-15-13-29(14-16-32)23-34(42-36(46)33-25-30-11-5-6-12-31(30)26-40-33)37(47)43-19-21-44(22-20-43)38(17-7-2-8-18-38)27-41-35(45)24-28-9-3-1-4-10-28/h1,3-6,9-16,33-34,40H,2,7-8,17-27H2,(H,41,45)(H,42,46)/t33-,34-/m1/s1
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 16n/an/an/an/an/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-MSH from human MC4R expressed in HEK293 cells

Bioorg Med Chem Lett 15: 5237-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.061
BindingDB Entry DOI: 10.7270/Q2794476
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50174256
PNG
(3-amino-N-((R)-3-(4-chlorophenyl)-1-oxo-1-(4-(1-((...)
Show SMILES NC(CC(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)C1(CNC(=O)Cc2ccccc2)CCCCC1)c1ccccc1
Show InChI InChI=1S/C37H46ClN5O3/c38-31-16-14-29(15-17-31)24-33(41-35(45)26-32(39)30-12-6-2-7-13-30)36(46)42-20-22-43(23-21-42)37(18-8-3-9-19-37)27-40-34(44)25-28-10-4-1-5-11-28/h1-2,4-7,10-17,32-33H,3,8-9,18-27,39H2,(H,40,44)(H,41,45)/t32?,33-/m1/s1
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 42n/an/an/an/an/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-MSH from human MC4R expressed in HEK293 cells

Bioorg Med Chem Lett 15: 5237-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.061
BindingDB Entry DOI: 10.7270/Q2794476
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50174237
PNG
((R)-N-(3-(4-chlorophenyl)-1-oxo-1-(4-(1-((2-phenyl...)
Show SMILES Clc1ccc(C[C@@H](NC(=O)c2cccnc2)C(=O)N2CCN(CC2)C2(CNC(=O)Cc3ccccc3)CCCCC2)cc1
Show InChI InChI=1S/C34H40ClN5O3/c35-29-13-11-27(12-14-29)22-30(38-32(42)28-10-7-17-36-24-28)33(43)39-18-20-40(21-19-39)34(15-5-2-6-16-34)25-37-31(41)23-26-8-3-1-4-9-26/h1,3-4,7-14,17,24,30H,2,5-6,15-16,18-23,25H2,(H,37,41)(H,38,42)/t30-/m1/s1
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 60n/an/an/an/an/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-MSH from human MC4R expressed in HEK293 cells

Bioorg Med Chem Lett 15: 5237-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.061
BindingDB Entry DOI: 10.7270/Q2794476
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50174232
PNG
((R)-N-(3-(4-chlorophenyl)-1-oxo-1-(4-(1-((2-phenyl...)
Show SMILES Clc1ccc(C[C@@H](NC(=O)c2cnc3ccccc3c2)C(=O)N2CCN(CC2)C2(CNC(=O)Cc3ccccc3)CCCCC2)cc1
Show InChI InChI=1S/C38H42ClN5O3/c39-32-15-13-29(14-16-32)23-34(42-36(46)31-25-30-11-5-6-12-33(30)40-26-31)37(47)43-19-21-44(22-20-43)38(17-7-2-8-18-38)27-41-35(45)24-28-9-3-1-4-10-28/h1,3-6,9-16,25-26,34H,2,7-8,17-24,27H2,(H,41,45)(H,42,46)/t34-/m1/s1
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 61n/an/an/an/an/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-MSH from human MC4R expressed in HEK293 cells

Bioorg Med Chem Lett 15: 5237-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.061
BindingDB Entry DOI: 10.7270/Q2794476
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50174253
PNG
(2-amino-N-((R)-1-(4-chloro-benzyl)-2-oxo-2-{4-[1-(...)
Show SMILES NC(C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)C1(CNC(=O)Cc2ccccc2)CCCCC1)c1ccccc1
Show InChI InChI=1S/C36H44ClN5O3/c37-30-16-14-28(15-17-30)24-31(40-34(44)33(38)29-12-6-2-7-13-29)35(45)41-20-22-42(23-21-41)36(18-8-3-9-19-36)26-39-32(43)25-27-10-4-1-5-11-27/h1-2,4-7,10-17,31,33H,3,8-9,18-26,38H2,(H,39,43)(H,40,44)/t31-,33?/m1/s1
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 79n/an/an/an/an/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-MSH from human MC4R expressed in HEK293 cells

Bioorg Med Chem Lett 15: 5237-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.061
BindingDB Entry DOI: 10.7270/Q2794476
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50174259
PNG
(CHEMBL197435 | N-((R)-1-(4-chloro-benzyl)-2-oxo-2-...)
Show SMILES Clc1ccc(C[C@@H](NC(=O)Cc2cccs2)C(=O)N2CCN(CC2)C2(CNC(=O)Cc3ccccc3)CCCCC2)cc1
Show InChI InChI=1S/C34H41ClN4O3S/c35-28-13-11-27(12-14-28)22-30(37-32(41)24-29-10-7-21-43-29)33(42)38-17-19-39(20-18-38)34(15-5-2-6-16-34)25-36-31(40)23-26-8-3-1-4-9-26/h1,3-4,7-14,21,30H,2,5-6,15-20,22-25H2,(H,36,40)(H,37,41)/t30-/m1/s1
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 80n/an/an/an/an/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-MSH from human MC4R expressed in HEK293 cells

Bioorg Med Chem Lett 15: 5237-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.061
BindingDB Entry DOI: 10.7270/Q2794476
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50174250
PNG
(2-amino-N-((R)-3-(4-chlorophenyl)-1-oxo-1-(4-(1-((...)
Show SMILES NC1(CCc2ccccc2C1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)C1(CNC(=O)Cc2ccccc2)CCCCC1
Show InChI InChI=1S/C39H48ClN5O3/c40-33-15-13-30(14-16-33)25-34(43-37(48)39(41)20-17-31-11-5-6-12-32(31)27-39)36(47)44-21-23-45(24-22-44)38(18-7-2-8-19-38)28-42-35(46)26-29-9-3-1-4-10-29/h1,3-6,9-16,34H,2,7-8,17-28,41H2,(H,42,46)(H,43,48)/t34-,39?/m1/s1
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 82n/an/an/an/an/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-MSH from human MC4R expressed in HEK293 cells

Bioorg Med Chem Lett 15: 5237-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.061
BindingDB Entry DOI: 10.7270/Q2794476
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50174239
PNG
((R)-N-(3-(4-chlorophenyl)-1-oxo-1-(4-(1-((2-phenyl...)
Show SMILES Clc1ccc(C[C@@H](NC(=O)c2ccccc2)C(=O)N2CCN(CC2)C2(CNC(=O)Cc3ccccc3)CCCCC2)cc1
Show InChI InChI=1S/C35H41ClN4O3/c36-30-16-14-28(15-17-30)24-31(38-33(42)29-12-6-2-7-13-29)34(43)39-20-22-40(23-21-39)35(18-8-3-9-19-35)26-37-32(41)25-27-10-4-1-5-11-27/h1-2,4-7,10-17,31H,3,8-9,18-26H2,(H,37,41)(H,38,42)/t31-/m1/s1
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 84n/an/an/an/an/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-MSH from human MC4R expressed in HEK293 cells

Bioorg Med Chem Lett 15: 5237-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.061
BindingDB Entry DOI: 10.7270/Q2794476
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50174244
PNG
((R)-N-(3-(4-chlorophenyl)-1-oxo-1-(4-(1-((2-phenyl...)
Show SMILES Fc1ccc(cc1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)C1(CNC(=O)Cc2ccccc2)CCCCC1
Show InChI InChI=1S/C35H40ClFN4O3/c36-29-13-9-27(10-14-29)23-31(39-33(43)28-11-15-30(37)16-12-28)34(44)40-19-21-41(22-20-40)35(17-5-2-6-18-35)25-38-32(42)24-26-7-3-1-4-8-26/h1,3-4,7-16,31H,2,5-6,17-25H2,(H,38,42)(H,39,43)/t31-/m1/s1
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 97n/an/an/an/an/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-MSH from human MC4R expressed in HEK293 cells

Bioorg Med Chem Lett 15: 5237-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.061
BindingDB Entry DOI: 10.7270/Q2794476
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50174242
PNG
(CHEMBL433991 | N-((R)-3-(4-chlorophenyl)-1-oxo-1-(...)
Show SMILES Clc1ccc(C[C@@H](NC(=O)C2NCc3ccccc23)C(=O)N2CCN(CC2)C2(CNC(=O)Cc3ccccc3)CCCCC2)cc1
Show InChI InChI=1S/C37H44ClN5O3/c38-30-15-13-28(14-16-30)23-32(41-35(45)34-31-12-6-5-11-29(31)25-39-34)36(46)42-19-21-43(22-20-42)37(17-7-2-8-18-37)26-40-33(44)24-27-9-3-1-4-10-27/h1,3-6,9-16,32,34,39H,2,7-8,17-26H2,(H,40,44)(H,41,45)/t32-,34?/m1/s1
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 99n/an/an/an/an/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-MSH from human MC4R expressed in HEK293 cells

Bioorg Med Chem Lett 15: 5237-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.061
BindingDB Entry DOI: 10.7270/Q2794476
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50174254
PNG
(CHEMBL199061 | N-((R)-1-(4-chloro-benzyl)-2-oxo-2-...)
Show SMILES CN(C)CC(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)C1(CNC(=O)Cc2ccccc2)CCCCC1
Show InChI InChI=1S/C32H44ClN5O3/c1-36(2)23-30(40)35-28(21-26-11-13-27(33)14-12-26)31(41)37-17-19-38(20-18-37)32(15-7-4-8-16-32)24-34-29(39)22-25-9-5-3-6-10-25/h3,5-6,9-14,28H,4,7-8,15-24H2,1-2H3,(H,34,39)(H,35,40)/t28-/m1/s1
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 100n/an/an/an/an/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-MSH from human MC4R expressed in HEK293 cells

Bioorg Med Chem Lett 15: 5237-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.061
BindingDB Entry DOI: 10.7270/Q2794476
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50174262
PNG
((R)-N-(3-(4-chlorophenyl)-1-oxo-1-(4-(1-((2-phenyl...)
Show SMILES Clc1ccc(C[C@@H](NC(=O)c2ccco2)C(=O)N2CCN(CC2)C2(CNC(=O)Cc3ccccc3)CCCCC2)cc1
Show InChI InChI=1S/C33H39ClN4O4/c34-27-13-11-26(12-14-27)22-28(36-31(40)29-10-7-21-42-29)32(41)37-17-19-38(20-18-37)33(15-5-2-6-16-33)24-35-30(39)23-25-8-3-1-4-9-25/h1,3-4,7-14,21,28H,2,5-6,15-20,22-24H2,(H,35,39)(H,36,40)/t28-/m1/s1
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 100n/an/an/an/an/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-MSH from human MC4R expressed in HEK293 cells

Bioorg Med Chem Lett 15: 5237-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.061
BindingDB Entry DOI: 10.7270/Q2794476
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50174238
PNG
(CHEMBL371683 | N-(1-{4-[(R)-2-acetylamino-3-(4-chl...)
Show SMILES CC(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)C1(CNC(=O)Cc2ccccc2)CCCCC1
Show InChI InChI=1S/C30H39ClN4O3/c1-23(36)33-27(20-25-10-12-26(31)13-11-25)29(38)34-16-18-35(19-17-34)30(14-6-3-7-15-30)22-32-28(37)21-24-8-4-2-5-9-24/h2,4-5,8-13,27H,3,6-7,14-22H2,1H3,(H,32,37)(H,33,36)/t27-/m1/s1
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 110n/an/an/an/an/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-MSH from human MC4R expressed in HEK293 cells

Bioorg Med Chem Lett 15: 5237-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.061
BindingDB Entry DOI: 10.7270/Q2794476
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50174248
PNG
(2-amino-N-((R)-3-(4-chlorophenyl)-1-oxo-1-(4-(1-((...)
Show SMILES NC(Cc1ccncc1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)C1(CNC(=O)Cc2ccccc2)CCCCC1
Show InChI InChI=1S/C36H45ClN6O3/c37-30-11-9-28(10-12-30)24-32(41-34(45)31(38)23-29-13-17-39-18-14-29)35(46)42-19-21-43(22-20-42)36(15-5-2-6-16-36)26-40-33(44)25-27-7-3-1-4-8-27/h1,3-4,7-14,17-18,31-32H,2,5-6,15-16,19-26,38H2,(H,40,44)(H,41,45)/t31?,32-/m1/s1
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 120n/an/an/an/an/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-MSH from human MC4R expressed in HEK293 cells

Bioorg Med Chem Lett 15: 5237-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.061
BindingDB Entry DOI: 10.7270/Q2794476
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50174246
PNG
(2-amino-N-((R)-3-(4-chlorophenyl)-1-oxo-1-(4-(1-((...)
Show SMILES NC(Cc1ccccc1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)C1(CNC(=O)Cc2ccccc2)CCCCC1
Show InChI InChI=1S/C37H46ClN5O3/c38-31-16-14-30(15-17-31)25-33(41-35(45)32(39)24-28-10-4-1-5-11-28)36(46)42-20-22-43(23-21-42)37(18-8-3-9-19-37)27-40-34(44)26-29-12-6-2-7-13-29/h1-2,4-7,10-17,32-33H,3,8-9,18-27,39H2,(H,40,44)(H,41,45)/t32?,33-/m1/s1
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 130n/an/an/an/an/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-MSH from human MC4R expressed in HEK293 cells

Bioorg Med Chem Lett 15: 5237-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.061
BindingDB Entry DOI: 10.7270/Q2794476
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50174263
PNG
((R)-N-(3-(4-chlorophenyl)-1-oxo-1-(4-(1-((2-phenyl...)
Show SMILES Clc1ccc(C[C@@H](NC(=O)C2CC2)C(=O)N2CCN(CC2)C2(CNC(=O)Cc3ccccc3)CCCCC2)cc1
Show InChI InChI=1S/C32H41ClN4O3/c33-27-13-9-25(10-14-27)21-28(35-30(39)26-11-12-26)31(40)36-17-19-37(20-18-36)32(15-5-2-6-16-32)23-34-29(38)22-24-7-3-1-4-8-24/h1,3-4,7-10,13-14,26,28H,2,5-6,11-12,15-23H2,(H,34,38)(H,35,39)/t28-/m1/s1
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 130n/an/an/an/an/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-MSH from human MC4R expressed in HEK293 cells

Bioorg Med Chem Lett 15: 5237-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.061
BindingDB Entry DOI: 10.7270/Q2794476
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50174234
PNG
((R)-2-amino-N-(3-(4-chlorophenyl)-1-oxo-1-(4-(1-((...)
Show SMILES NC1(Cc2ccccc2C1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)C1(CNC(=O)Cc2ccccc2)CCCCC1
Show InChI InChI=1S/C38H46ClN5O3/c39-32-15-13-29(14-16-32)23-33(42-36(47)38(40)25-30-11-5-6-12-31(30)26-38)35(46)43-19-21-44(22-20-43)37(17-7-2-8-18-37)27-41-34(45)24-28-9-3-1-4-10-28/h1,3-6,9-16,33H,2,7-8,17-27,40H2,(H,41,45)(H,42,47)/t33-/m1/s1
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 140n/an/an/an/an/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-MSH from human MC4R expressed in HEK293 cells

Bioorg Med Chem Lett 15: 5237-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.061
BindingDB Entry DOI: 10.7270/Q2794476
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50174257
PNG
((R)-N-(3-(4-chlorophenyl)-1-oxo-1-(4-(1-((2-phenyl...)
Show SMILES Clc1ccc(C[C@@H](NC(=O)C2CCC2)C(=O)N2CCN(CC2)C2(CNC(=O)Cc3ccccc3)CCCCC2)cc1
Show InChI InChI=1S/C33H43ClN4O3/c34-28-14-12-26(13-15-28)22-29(36-31(40)27-10-7-11-27)32(41)37-18-20-38(21-19-37)33(16-5-2-6-17-33)24-35-30(39)23-25-8-3-1-4-9-25/h1,3-4,8-9,12-15,27,29H,2,5-7,10-11,16-24H2,(H,35,39)(H,36,40)/t29-/m1/s1
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 140n/an/an/an/an/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-MSH from human MC4R expressed in HEK293 cells

Bioorg Med Chem Lett 15: 5237-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.061
BindingDB Entry DOI: 10.7270/Q2794476
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50174258
PNG
((R)-N-(3-(4-chlorophenyl)-1-oxo-1-(4-(1-((2-phenyl...)
Show SMILES CCCCC(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)C1(CNC(=O)Cc2ccccc2)CCCCC1
Show InChI InChI=1S/C33H45ClN4O3/c1-2-3-12-30(39)36-29(23-27-13-15-28(34)16-14-27)32(41)37-19-21-38(22-20-37)33(17-8-5-9-18-33)25-35-31(40)24-26-10-6-4-7-11-26/h4,6-7,10-11,13-16,29H,2-3,5,8-9,12,17-25H2,1H3,(H,35,40)(H,36,39)/t29-/m1/s1
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 150n/an/an/an/an/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-MSH from human MC4R expressed in HEK293 cells

Bioorg Med Chem Lett 15: 5237-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.061
BindingDB Entry DOI: 10.7270/Q2794476
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50174231
PNG
((R)-N-(3-(4-chlorophenyl)-1-oxo-1-(4-(1-((2-phenyl...)
Show SMILES CCC(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)C1(CNC(=O)Cc2ccccc2)CCCCC1
Show InChI InChI=1S/C31H41ClN4O3/c1-2-28(37)34-27(21-25-11-13-26(32)14-12-25)30(39)35-17-19-36(20-18-35)31(15-7-4-8-16-31)23-33-29(38)22-24-9-5-3-6-10-24/h3,5-6,9-14,27H,2,4,7-8,15-23H2,1H3,(H,33,38)(H,34,37)/t27-/m1/s1
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 160n/an/an/an/an/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-MSH from human MC4R expressed in HEK293 cells

Bioorg Med Chem Lett 15: 5237-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.061
BindingDB Entry DOI: 10.7270/Q2794476
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50174252
PNG
(CHEMBL199273 | N-((R)-1-(4-chloro-benzyl)-2-oxo-2-...)
Show SMILES COCC(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)C1(CNC(=O)Cc2ccccc2)CCCCC1
Show InChI InChI=1S/C31H41ClN4O4/c1-40-22-29(38)34-27(20-25-10-12-26(32)13-11-25)30(39)35-16-18-36(19-17-35)31(14-6-3-7-15-31)23-33-28(37)21-24-8-4-2-5-9-24/h2,4-5,8-13,27H,3,6-7,14-23H2,1H3,(H,33,37)(H,34,38)/t27-/m1/s1
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 170n/an/an/an/an/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-MSH from human MC4R expressed in HEK293 cells

Bioorg Med Chem Lett 15: 5237-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.061
BindingDB Entry DOI: 10.7270/Q2794476
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50174235
PNG
(CHEMBL372621 | N-((R)-1-(4-Chloro-benzyl)-2-oxo-2-...)
Show SMILES Fc1ccccc1CC(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)C1(CNC(=O)Cc2ccccc2)CCCCC1
Show InChI InChI=1S/C36H42ClFN4O3/c37-30-15-13-28(14-16-30)23-32(40-34(44)25-29-11-5-6-12-31(29)38)35(45)41-19-21-42(22-20-41)36(17-7-2-8-18-36)26-39-33(43)24-27-9-3-1-4-10-27/h1,3-6,9-16,32H,2,7-8,17-26H2,(H,39,43)(H,40,44)/t32-/m1/s1
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 180n/an/an/an/an/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-MSH from human MC4R expressed in HEK293 cells

Bioorg Med Chem Lett 15: 5237-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.061
BindingDB Entry DOI: 10.7270/Q2794476
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50174240
PNG
(CHEMBL197278 | N-((R)-3-(4-chlorophenyl)-1-oxo-1-(...)
Show SMILES Clc1ccc(C[C@@H](NC(=O)C2Cc3ccccc3N2)C(=O)N2CCN(CC2)C2(CNC(=O)Cc3ccccc3)CCCCC2)cc1
Show InChI InChI=1S/C37H44ClN5O3/c38-30-15-13-28(14-16-30)23-33(41-35(45)32-25-29-11-5-6-12-31(29)40-32)36(46)42-19-21-43(22-20-42)37(17-7-2-8-18-37)26-39-34(44)24-27-9-3-1-4-10-27/h1,3-6,9-16,32-33,40H,2,7-8,17-26H2,(H,39,44)(H,41,45)/t32?,33-/m1/s1
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 210n/an/an/an/an/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-MSH from human MC4R expressed in HEK293 cells

Bioorg Med Chem Lett 15: 5237-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.061
BindingDB Entry DOI: 10.7270/Q2794476
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50174261
PNG
((R)-N-(3-(4-chlorophenyl)-1-oxo-1-(4-(1-((2-phenyl...)
Show SMILES CCCC(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)C1(CNC(=O)Cc2ccccc2)CCCCC1
Show InChI InChI=1S/C32H43ClN4O3/c1-2-9-29(38)35-28(22-26-12-14-27(33)15-13-26)31(40)36-18-20-37(21-19-36)32(16-7-4-8-17-32)24-34-30(39)23-25-10-5-3-6-11-25/h3,5-6,10-15,28H,2,4,7-9,16-24H2,1H3,(H,34,39)(H,35,38)/t28-/m1/s1
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 210n/an/an/an/an/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-MSH from human MC4R expressed in HEK293 cells

Bioorg Med Chem Lett 15: 5237-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.061
BindingDB Entry DOI: 10.7270/Q2794476
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50174245
PNG
((R)-N-(3-(4-chlorophenyl)-1-oxo-1-(4-(1-((2-phenyl...)
Show SMILES Clc1ccc(C[C@@H](NC(=O)C2CCCC2)C(=O)N2CCN(CC2)C2(CNC(=O)Cc3ccccc3)CCCCC2)cc1
Show InChI InChI=1S/C34H45ClN4O3/c35-29-15-13-27(14-16-29)23-30(37-32(41)28-11-5-6-12-28)33(42)38-19-21-39(22-20-38)34(17-7-2-8-18-34)25-36-31(40)24-26-9-3-1-4-10-26/h1,3-4,9-10,13-16,28,30H,2,5-8,11-12,17-25H2,(H,36,40)(H,37,41)/t30-/m1/s1
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 230n/an/an/an/an/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-MSH from human MC4R expressed in HEK293 cells

Bioorg Med Chem Lett 15: 5237-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.061
BindingDB Entry DOI: 10.7270/Q2794476
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50174249
PNG
(1-amino-N-((R)-3-(4-chlorophenyl)-1-oxo-1-(4-(1-((...)
Show SMILES NC1(CCc2ccccc12)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)C1(CNC(=O)Cc2ccccc2)CCCCC1
Show InChI InChI=1S/C38H46ClN5O3/c39-31-15-13-29(14-16-31)25-33(42-36(47)38(40)20-17-30-11-5-6-12-32(30)38)35(46)43-21-23-44(24-22-43)37(18-7-2-8-19-37)27-41-34(45)26-28-9-3-1-4-10-28/h1,3-6,9-16,33H,2,7-8,17-27,40H2,(H,41,45)(H,42,47)/t33-,38?/m1/s1
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 260n/an/an/an/an/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-MSH from human MC4R expressed in HEK293 cells

Bioorg Med Chem Lett 15: 5237-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.061
BindingDB Entry DOI: 10.7270/Q2794476
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50174241
PNG
((R)-N-(3-(4-chlorophenyl)-1-oxo-1-(4-(1-((2-phenyl...)
Show SMILES CC(C)CC(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)C1(CNC(=O)Cc2ccccc2)CCCCC1
Show InChI InChI=1S/C33H45ClN4O3/c1-25(2)21-31(40)36-29(22-27-11-13-28(34)14-12-27)32(41)37-17-19-38(20-18-37)33(15-7-4-8-16-33)24-35-30(39)23-26-9-5-3-6-10-26/h3,5-6,9-14,25,29H,4,7-8,15-24H2,1-2H3,(H,35,39)(H,36,40)/t29-/m1/s1
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 270n/an/an/an/an/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-MSH from human MC4R expressed in HEK293 cells

Bioorg Med Chem Lett 15: 5237-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.061
BindingDB Entry DOI: 10.7270/Q2794476
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50174255
PNG
((R)-isobutyl 3-(4-chlorophenyl)-1-oxo-1-(4-(1-((2-...)
Show SMILES CC(C)COC(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)C1(CNC(=O)Cc2ccccc2)CCCCC1
Show InChI InChI=1S/C33H45ClN4O4/c1-25(2)23-42-32(41)36-29(21-27-11-13-28(34)14-12-27)31(40)37-17-19-38(20-18-37)33(15-7-4-8-16-33)24-35-30(39)22-26-9-5-3-6-10-26/h3,5-6,9-14,25,29H,4,7-8,15-24H2,1-2H3,(H,35,39)(H,36,41)/t29-/m1/s1
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 280n/an/an/an/an/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-MSH from human MC4R expressed in HEK293 cells

Bioorg Med Chem Lett 15: 5237-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.061
BindingDB Entry DOI: 10.7270/Q2794476
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50174247
PNG
((R)-N-(3-(4-chlorophenyl)-1-oxo-1-(4-(1-((2-phenyl...)
Show SMILES CC(C)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)C1(CNC(=O)Cc2ccccc2)CCCCC1
Show InChI InChI=1S/C32H43ClN4O3/c1-24(2)30(39)35-28(21-26-11-13-27(33)14-12-26)31(40)36-17-19-37(20-18-36)32(15-7-4-8-16-32)23-34-29(38)22-25-9-5-3-6-10-25/h3,5-6,9-14,24,28H,4,7-8,15-23H2,1-2H3,(H,34,38)(H,35,39)/t28-/m1/s1
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 300n/an/an/an/an/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-MSH from human MC4R expressed in HEK293 cells

Bioorg Med Chem Lett 15: 5237-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.061
BindingDB Entry DOI: 10.7270/Q2794476
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50174236
PNG
((R)-N-(3-(4-chlorophenyl)-1-oxo-1-(4-(1-((2-phenyl...)
Show SMILES CC(C)(C)CC(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)C1(CNC(=O)Cc2ccccc2)CCCCC1
Show InChI InChI=1S/C34H47ClN4O3/c1-33(2,3)24-31(41)37-29(22-27-12-14-28(35)15-13-27)32(42)38-18-20-39(21-19-38)34(16-8-5-9-17-34)25-36-30(40)23-26-10-6-4-7-11-26/h4,6-7,10-15,29H,5,8-9,16-25H2,1-3H3,(H,36,40)(H,37,41)/t29-/m1/s1
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 750n/an/an/an/an/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-MSH from human MC4R expressed in HEK293 cells

Bioorg Med Chem Lett 15: 5237-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.061
BindingDB Entry DOI: 10.7270/Q2794476
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50174260
PNG
((R)-N-(3-(4-chlorophenyl)-1-oxo-1-(4-(1-((2-phenyl...)
Show SMILES CCC(CC)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)C1(CNC(=O)Cc2ccccc2)CCCCC1
Show InChI InChI=1S/C34H47ClN4O3/c1-3-28(4-2)32(41)37-30(23-27-13-15-29(35)16-14-27)33(42)38-19-21-39(22-20-38)34(17-9-6-10-18-34)25-36-31(40)24-26-11-7-5-8-12-26/h5,7-8,11-16,28,30H,3-4,6,9-10,17-25H2,1-2H3,(H,36,40)(H,37,41)/t30-/m1/s1
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 1.00E+3n/an/an/an/an/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-MSH from human MC4R expressed in HEK293 cells

Bioorg Med Chem Lett 15: 5237-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.061
BindingDB Entry DOI: 10.7270/Q2794476
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50174234
PNG
((R)-2-amino-N-(3-(4-chlorophenyl)-1-oxo-1-(4-(1-((...)
Show SMILES NC1(Cc2ccccc2C1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)C1(CNC(=O)Cc2ccccc2)CCCCC1
Show InChI InChI=1S/C38H46ClN5O3/c39-32-15-13-29(14-16-32)23-33(42-36(47)38(40)25-30-11-5-6-12-31(30)26-38)35(46)43-19-21-44(22-20-43)37(17-7-2-8-18-37)27-41-34(45)24-28-9-3-1-4-10-28/h1,3-6,9-16,33H,2,7-8,17-27,40H2,(H,41,45)(H,42,47)/t33-/m1/s1
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n/an/an/an/a 280n/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
cAMP stimulation in HEK293 cells transfected with human MC4R

Bioorg Med Chem Lett 15: 5237-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.061
BindingDB Entry DOI: 10.7270/Q2794476
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50174243
PNG
((R)-N-((R)-3-(4-chlorophenyl)-1-oxo-1-(4-(1-((2-ph...)
Show SMILES Clc1ccc(C[C@@H](NC(=O)[C@H]2Cc3ccccc3CN2)C(=O)N2CCN(CC2)C2(CNC(=O)Cc3ccccc3)CCCCC2)cc1
Show InChI InChI=1S/C38H46ClN5O3/c39-32-15-13-29(14-16-32)23-34(42-36(46)33-25-30-11-5-6-12-31(30)26-40-33)37(47)43-19-21-44(22-20-43)38(17-7-2-8-18-38)27-41-35(45)24-28-9-3-1-4-10-28/h1,3-6,9-16,33-34,40H,2,7-8,17-27H2,(H,41,45)(H,42,46)/t33-,34-/m1/s1
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n/an/an/an/a 33n/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
cAMP stimulation in HEK293 cells transfected with human MC4R

Bioorg Med Chem Lett 15: 5237-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.061
BindingDB Entry DOI: 10.7270/Q2794476
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50174256
PNG
(3-amino-N-((R)-3-(4-chlorophenyl)-1-oxo-1-(4-(1-((...)
Show SMILES NC(CC(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)C1(CNC(=O)Cc2ccccc2)CCCCC1)c1ccccc1
Show InChI InChI=1S/C37H46ClN5O3/c38-31-16-14-29(15-17-31)24-33(41-35(45)26-32(39)30-12-6-2-7-13-30)36(46)42-20-22-43(23-21-42)37(18-8-3-9-19-37)27-40-34(44)25-28-10-4-1-5-11-28/h1-2,4-7,10-17,32-33H,3,8-9,18-27,39H2,(H,40,44)(H,41,45)/t32?,33-/m1/s1
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n/an/an/an/a 270n/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
cAMP stimulation in HEK293 cells transfected with human MC4R

Bioorg Med Chem Lett 15: 5237-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.061
BindingDB Entry DOI: 10.7270/Q2794476
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50174251
PNG
((S)-N-((R)-3-(4-chlorophenyl)-1-oxo-1-(4-(1-((2-ph...)
Show SMILES Clc1ccc(C[C@@H](NC(=O)[C@@H]2Cc3ccccc3CN2)C(=O)N2CCN(CC2)C2(CNC(=O)Cc3ccccc3)CCCCC2)cc1
Show InChI InChI=1S/C38H46ClN5O3/c39-32-15-13-29(14-16-32)23-34(42-36(46)33-25-30-11-5-6-12-31(30)26-40-33)37(47)43-19-21-44(22-20-43)38(17-7-2-8-18-38)27-41-35(45)24-28-9-3-1-4-10-28/h1,3-6,9-16,33-34,40H,2,7-8,17-27H2,(H,41,45)(H,42,46)/t33-,34+/m0/s1
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n/an/an/an/a 46n/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
cAMP stimulation in HEK293 cells transfected with human MC4R

Bioorg Med Chem Lett 15: 5237-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.061
BindingDB Entry DOI: 10.7270/Q2794476
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50174253
PNG
(2-amino-N-((R)-1-(4-chloro-benzyl)-2-oxo-2-{4-[1-(...)
Show SMILES NC(C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)C1(CNC(=O)Cc2ccccc2)CCCCC1)c1ccccc1
Show InChI InChI=1S/C36H44ClN5O3/c37-30-16-14-28(15-17-30)24-31(40-34(44)33(38)29-12-6-2-7-13-29)35(45)41-20-22-42(23-21-41)36(18-8-3-9-19-36)26-39-32(43)25-27-10-4-1-5-11-27/h1-2,4-7,10-17,31,33H,3,8-9,18-26,38H2,(H,39,43)(H,40,44)/t31-,33?/m1/s1
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n/an/an/an/a 530n/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
cAMP stimulation in HEK293 cells transfected with human MC4R

Bioorg Med Chem Lett 15: 5237-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.061
BindingDB Entry DOI: 10.7270/Q2794476
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50174242
PNG
(CHEMBL433991 | N-((R)-3-(4-chlorophenyl)-1-oxo-1-(...)
Show SMILES Clc1ccc(C[C@@H](NC(=O)C2NCc3ccccc23)C(=O)N2CCN(CC2)C2(CNC(=O)Cc3ccccc3)CCCCC2)cc1
Show InChI InChI=1S/C37H44ClN5O3/c38-30-15-13-28(14-16-30)23-32(41-35(45)34-31-12-6-5-11-29(31)25-39-34)36(46)42-19-21-43(22-20-42)37(17-7-2-8-18-37)26-40-33(44)24-27-9-3-1-4-10-27/h1,3-6,9-16,32,34,39H,2,7-8,17-26H2,(H,40,44)(H,41,45)/t32-,34?/m1/s1
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n/an/an/an/a 440n/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
cAMP stimulation in HEK293 cells transfected with human MC4R

Bioorg Med Chem Lett 15: 5237-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.061
BindingDB Entry DOI: 10.7270/Q2794476
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50174248
PNG
(2-amino-N-((R)-3-(4-chlorophenyl)-1-oxo-1-(4-(1-((...)
Show SMILES NC(Cc1ccncc1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)C1(CNC(=O)Cc2ccccc2)CCCCC1
Show InChI InChI=1S/C36H45ClN6O3/c37-30-11-9-28(10-12-30)24-32(41-34(45)31(38)23-29-13-17-39-18-14-29)35(46)42-19-21-43(22-20-42)36(15-5-2-6-16-36)26-40-33(44)25-27-7-3-1-4-8-27/h1,3-4,7-14,17-18,31-32H,2,5-6,15-16,19-26,38H2,(H,40,44)(H,41,45)/t31?,32-/m1/s1
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n/an/an/an/a 590n/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
cAMP stimulation in HEK293 cells transfected with human MC4R

Bioorg Med Chem Lett 15: 5237-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.061
BindingDB Entry DOI: 10.7270/Q2794476
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50174236
PNG
((R)-N-(3-(4-chlorophenyl)-1-oxo-1-(4-(1-((2-phenyl...)
Show SMILES CC(C)(C)CC(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)C1(CNC(=O)Cc2ccccc2)CCCCC1
Show InChI InChI=1S/C34H47ClN4O3/c1-33(2,3)24-31(41)37-29(22-27-12-14-28(35)15-13-27)32(42)38-18-20-39(21-19-38)34(16-8-5-9-17-34)25-36-30(40)23-26-10-6-4-7-11-26/h4,6-7,10-15,29H,5,8-9,16-25H2,1-3H3,(H,36,40)(H,37,41)/t29-/m1/s1
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n/an/an/an/a 570n/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
cAMP stimulation in HEK293 cells transfected with human MC4R

Bioorg Med Chem Lett 15: 5237-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.061
BindingDB Entry DOI: 10.7270/Q2794476
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50174254
PNG
(CHEMBL199061 | N-((R)-1-(4-chloro-benzyl)-2-oxo-2-...)
Show SMILES CN(C)CC(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)C1(CNC(=O)Cc2ccccc2)CCCCC1
Show InChI InChI=1S/C32H44ClN5O3/c1-36(2)23-30(40)35-28(21-26-11-13-27(33)14-12-26)31(41)37-17-19-38(20-18-37)32(15-7-4-8-16-32)24-34-29(39)22-25-9-5-3-6-10-25/h3,5-6,9-14,28H,4,7-8,15-24H2,1-2H3,(H,34,39)(H,35,40)/t28-/m1/s1
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n/an/an/an/a 300n/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
cAMP stimulation in HEK293 cells transfected with human MC4R

Bioorg Med Chem Lett 15: 5237-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.061
BindingDB Entry DOI: 10.7270/Q2794476
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50174250
PNG
(2-amino-N-((R)-3-(4-chlorophenyl)-1-oxo-1-(4-(1-((...)
Show SMILES NC1(CCc2ccccc2C1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)C1(CNC(=O)Cc2ccccc2)CCCCC1
Show InChI InChI=1S/C39H48ClN5O3/c40-33-15-13-30(14-16-33)25-34(43-37(48)39(41)20-17-31-11-5-6-12-32(31)27-39)36(47)44-21-23-45(24-22-44)38(18-7-2-8-19-38)28-42-35(46)26-29-9-3-1-4-10-29/h1,3-6,9-16,34H,2,7-8,17-28,41H2,(H,42,46)(H,43,48)/t34-,39?/m1/s1
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n/an/an/an/a 160n/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
cAMP stimulation in HEK293 cells transfected with human MC4R

Bioorg Med Chem Lett 15: 5237-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.061
BindingDB Entry DOI: 10.7270/Q2794476
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50174240
PNG
(CHEMBL197278 | N-((R)-3-(4-chlorophenyl)-1-oxo-1-(...)
Show SMILES Clc1ccc(C[C@@H](NC(=O)C2Cc3ccccc3N2)C(=O)N2CCN(CC2)C2(CNC(=O)Cc3ccccc3)CCCCC2)cc1
Show InChI InChI=1S/C37H44ClN5O3/c38-30-15-13-28(14-16-30)23-33(41-35(45)32-25-29-11-5-6-12-31(29)40-32)36(46)42-19-21-43(22-20-42)37(17-7-2-8-18-37)26-39-34(44)24-27-9-3-1-4-10-27/h1,3-6,9-16,32-33,40H,2,7-8,17-26H2,(H,39,44)(H,41,45)/t32?,33-/m1/s1
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n/an/an/an/a 360n/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
cAMP stimulation in HEK293 cells transfected with human MC4R

Bioorg Med Chem Lett 15: 5237-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.061
BindingDB Entry DOI: 10.7270/Q2794476
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50174233
PNG
(CHEMBL373037 | N-((R)-1-(4-chloro-benzyl)-2-oxo-2-...)
Show SMILES Clc1ccc(C[C@@H](NC(=O)CC2Cc3ccccc3CN2)C(=O)N2CCN(CC2)C2(CNC(=O)Cc3ccccc3)CCCCC2)cc1
Show InChI InChI=1S/C39H48ClN5O3/c40-33-15-13-30(14-16-33)23-35(43-37(47)26-34-25-31-11-5-6-12-32(31)27-41-34)38(48)44-19-21-45(22-20-44)39(17-7-2-8-18-39)28-42-36(46)24-29-9-3-1-4-10-29/h1,3-6,9-16,34-35,41H,2,7-8,17-28H2,(H,42,46)(H,43,47)/t34?,35-/m1/s1
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n/an/an/an/a 37n/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
cAMP stimulation in HEK293 cells transfected with human MC4R

Bioorg Med Chem Lett 15: 5237-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.061
BindingDB Entry DOI: 10.7270/Q2794476
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50174246
PNG
(2-amino-N-((R)-3-(4-chlorophenyl)-1-oxo-1-(4-(1-((...)
Show SMILES NC(Cc1ccccc1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)C1(CNC(=O)Cc2ccccc2)CCCCC1
Show InChI InChI=1S/C37H46ClN5O3/c38-31-16-14-30(15-17-31)25-33(41-35(45)32(39)24-28-10-4-1-5-11-28)36(46)42-20-22-43(23-21-42)37(18-8-3-9-19-37)27-40-34(44)26-29-12-6-2-7-13-29/h1-2,4-7,10-17,32-33H,3,8-9,18-27,39H2,(H,40,44)(H,41,45)/t32?,33-/m1/s1
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n/an/an/an/a 420n/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
cAMP stimulation in HEK293 cells transfected with human MC4R

Bioorg Med Chem Lett 15: 5237-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.061
BindingDB Entry DOI: 10.7270/Q2794476
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50174249
PNG
(1-amino-N-((R)-3-(4-chlorophenyl)-1-oxo-1-(4-(1-((...)
Show SMILES NC1(CCc2ccccc12)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)C1(CNC(=O)Cc2ccccc2)CCCCC1
Show InChI InChI=1S/C38H46ClN5O3/c39-31-15-13-29(14-16-31)25-33(42-36(47)38(40)20-17-30-11-5-6-12-32(30)38)35(46)43-21-23-44(24-22-43)37(18-7-2-8-19-37)27-41-34(45)26-28-9-3-1-4-10-28/h1,3-6,9-16,33H,2,7-8,17-27,40H2,(H,41,45)(H,42,47)/t33-,38?/m1/s1
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n/an/an/an/a 810n/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
cAMP stimulation in HEK293 cells transfected with human MC4R

Bioorg Med Chem Lett 15: 5237-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.061
BindingDB Entry DOI: 10.7270/Q2794476
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%