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Compile Data Set for Download or QSAR

Found 523 hits with Last Name = 'doe' and Initial = 'c'   
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))
BDBM50119368
PNG
((R)-1,2,3,4-Tetrahydro-isoquinoline-3-carboxylic a...)
Show SMILES Clc1ccc(C[C@@H](NC(=O)[C@H]2Cc3ccccc3CN2)C(=O)N2CCC(Cn3cncn3)(CC2)C2CCCCC2)cc1
Show InChI InChI=1S/C33H41ClN6O2/c34-28-12-10-24(11-13-28)18-30(38-31(41)29-19-25-6-4-5-7-26(25)20-36-29)32(42)39-16-14-33(15-17-39,21-40-23-35-22-37-40)27-8-2-1-3-9-27/h4-7,10-13,22-23,27,29-30,36H,1-3,8-9,14-21H2,(H,38,41)/t29-,30-/m1/s1
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3n/an/an/an/an/an/an/an/a



Nanyang Technological University

Curated by ChEMBL


Assay Description
Displacement of europium labeled NDP-alpha-MSH from human MC4 receptor expressed in HEK293 cells


Bioorg Med Chem Lett 18: 1223-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.11.109
BindingDB Entry DOI: 10.7270/Q2TM7BZM
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM50186863
PNG
(CHEMBL379497 | N-((R)-3-(4-chlorophenyl)-1-(4-(1-c...)
Show SMILES CCN(CC)CC(CC1CCCCC1)N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)CC1NCc2ccccc12
Show InChI InChI=1S/C36H52ClN5O2/c1-3-40(4-2)26-31(22-27-10-6-5-7-11-27)41-18-20-42(21-19-41)36(44)34(23-28-14-16-30(37)17-15-28)39-35(43)24-33-32-13-9-8-12-29(32)25-38-33/h8-9,12-17,27,31,33-34,38H,3-7,10-11,18-26H2,1-2H3,(H,39,43)/t31?,33?,34-/m1/s1
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5n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from human MC4 receptor transfected in HEK293 cells


Bioorg Med Chem Lett 16: 3843-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.04.016
BindingDB Entry DOI: 10.7270/Q2SQ900D
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM50177564
PNG
(CHEMBL380540 | N-((R)-3-(4-chlorophenyl)-1-(4-(2-(...)
Show SMILES CCN(CC)CC(N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)C1Cc2ccccc2C(C)(C)N1)c1ccccc1F
Show InChI InChI=1S/C37H47ClFN5O2/c1-5-42(6-2)25-34(29-12-8-10-14-31(29)39)43-19-21-44(22-20-43)36(46)33(23-26-15-17-28(38)18-16-26)40-35(45)32-24-27-11-7-9-13-30(27)37(3,4)41-32/h7-18,32-34,41H,5-6,19-25H2,1-4H3,(H,40,45)/t32?,33-,34?/m1/s1
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5.80n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


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


Bioorg Med Chem Lett 16: 2341-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.103
BindingDB Entry DOI: 10.7270/Q2NS0TF6
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM50177560
PNG
(CHEMBL206042 | N-((R)-3-(4-chlorophenyl)-1-(4-(1-(...)
Show SMILES CCN(CC)CC(N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)CC1NCCc2ccccc12)c1ccccc1Cl
Show InChI InChI=1S/C36H45Cl2N5O2/c1-3-41(4-2)25-34(30-11-7-8-12-31(30)38)42-19-21-43(22-20-42)36(45)33(23-26-13-15-28(37)16-14-26)40-35(44)24-32-29-10-6-5-9-27(29)17-18-39-32/h5-16,32-34,39H,3-4,17-25H2,1-2H3,(H,40,44)/t32?,33-,34?/m1/s1
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6.40n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


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


Bioorg Med Chem Lett 16: 2341-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.103
BindingDB Entry DOI: 10.7270/Q2NS0TF6
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM50177560
PNG
(CHEMBL206042 | N-((R)-3-(4-chlorophenyl)-1-(4-(1-(...)
Show SMILES CCN(CC)CC(N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)CC1NCCc2ccccc12)c1ccccc1Cl
Show InChI InChI=1S/C36H45Cl2N5O2/c1-3-41(4-2)25-34(30-11-7-8-12-31(30)38)42-19-21-43(22-20-42)36(45)33(23-26-13-15-28(37)16-14-26)40-35(44)24-32-29-10-6-5-9-27(29)17-18-39-32/h5-16,32-34,39H,3-4,17-25H2,1-2H3,(H,40,44)/t32?,33-,34?/m1/s1
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6.40n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


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


Bioorg Med Chem Lett 16: 2341-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.103
BindingDB Entry DOI: 10.7270/Q2NS0TF6
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM50186868
PNG
(CHEMBL213340 | N-{(R)-1-(4-chloro-benzyl)-2-[4-(4-...)
Show SMILES CN1CCC(CC2CCCCC2)(CC1)N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)CC1NCc2ccccc12
Show InChI InChI=1S/C36H50ClN5O2/c1-40-17-15-36(16-18-40,25-28-7-3-2-4-8-28)42-21-19-41(20-22-42)35(44)33(23-27-11-13-30(37)14-12-27)39-34(43)24-32-31-10-6-5-9-29(31)26-38-32/h5-6,9-14,28,32-33,38H,2-4,7-8,15-26H2,1H3,(H,39,43)/t32?,33-/m1/s1
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6.80n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from human MC4 receptor transfected in HEK293 cells


Bioorg Med Chem Lett 16: 3843-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.04.016
BindingDB Entry DOI: 10.7270/Q2SQ900D
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM50177563
PNG
(CHEMBL380855 | N-((R)-3-(4-chlorophenyl)-1-(4-(2-(...)
Show SMILES CCN(CC)CC(N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)CC1NCc2ccccc12)c1ccccc1F
Show InChI InChI=1S/C35H43ClFN5O2/c1-3-40(4-2)24-33(29-11-7-8-12-30(29)37)41-17-19-42(20-18-41)35(44)32(21-25-13-15-27(36)16-14-25)39-34(43)22-31-28-10-6-5-9-26(28)23-38-31/h5-16,31-33,38H,3-4,17-24H2,1-2H3,(H,39,43)/t31?,32-,33?/m1/s1
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7.30n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


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


Bioorg Med Chem Lett 16: 2341-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.103
BindingDB Entry DOI: 10.7270/Q2NS0TF6
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM50177557
PNG
(CHEMBL380365 | N-((R)-3-(4-chlorophenyl)-1-(4-(2-(...)
Show SMILES CCN(CC)CC(N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)CC1NCCc2ccccc12)c1ccccc1F
Show InChI InChI=1S/C36H45ClFN5O2/c1-3-41(4-2)25-34(30-11-7-8-12-31(30)38)42-19-21-43(22-20-42)36(45)33(23-26-13-15-28(37)16-14-26)40-35(44)24-32-29-10-6-5-9-27(29)17-18-39-32/h5-16,32-34,39H,3-4,17-25H2,1-2H3,(H,40,44)/t32?,33-,34?/m1/s1
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10n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


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


Bioorg Med Chem Lett 16: 2341-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.103
BindingDB Entry DOI: 10.7270/Q2NS0TF6
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM50186874
PNG
(CHEMBL376999 | N-{(R)-1-(4-chloro-benzyl)-2-[4-(4-...)
Show SMILES CC(C)CC1(CCN(C)CC1)N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)CC1NCc2ccccc12
Show InChI InChI=1S/C33H46ClN5O2/c1-24(2)22-33(12-14-37(3)15-13-33)39-18-16-38(17-19-39)32(41)30(20-25-8-10-27(34)11-9-25)36-31(40)21-29-28-7-5-4-6-26(28)23-35-29/h4-11,24,29-30,35H,12-23H2,1-3H3,(H,36,40)/t29?,30-/m1/s1
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13n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from human MC4 receptor transfected in HEK293 cells


Bioorg Med Chem Lett 16: 3843-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.04.016
BindingDB Entry DOI: 10.7270/Q2SQ900D
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM50186862
PNG
(CHEMBL211260 | N-{(R)-1-(4-chloro-benzyl)-2-[4-(4-...)
Show SMILES CC(C)CC1(CCN(CC1)C(C)C)N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)CC1NCc2ccccc12
Show InChI InChI=1S/C35H50ClN5O2/c1-25(2)23-35(13-15-39(16-14-35)26(3)4)41-19-17-40(18-20-41)34(43)32(21-27-9-11-29(36)12-10-27)38-33(42)22-31-30-8-6-5-7-28(30)24-37-31/h5-12,25-26,31-32,37H,13-24H2,1-4H3,(H,38,42)/t31?,32-/m1/s1
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13n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from human MC4 receptor transfected in HEK293 cells


Bioorg Med Chem Lett 16: 3843-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.04.016
BindingDB Entry DOI: 10.7270/Q2SQ900D
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM50186865
PNG
(CHEMBL211202 | N-{(R)-1-(4-chloro-benzyl)-2-[4-(1-...)
Show SMILES CCN1CCC(CC(C)C)(CC1)N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)CC1NCc2ccccc12
Show InChI InChI=1S/C34H48ClN5O2/c1-4-38-15-13-34(14-16-38,23-25(2)3)40-19-17-39(18-20-40)33(42)31(21-26-9-11-28(35)12-10-26)37-32(41)22-30-29-8-6-5-7-27(29)24-36-30/h5-12,25,30-31,36H,4,13-24H2,1-3H3,(H,37,41)/t30?,31-/m1/s1
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16n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from human MC4 receptor transfected in HEK293 cells


Bioorg Med Chem Lett 16: 3843-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.04.016
BindingDB Entry DOI: 10.7270/Q2SQ900D
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM50177565
PNG
(CHEMBL380858 | N-((R)-3-(4-chlorophenyl)-1-(4-(2-(...)
Show SMILES CCN(CC)CC(N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)CC1N(C)Cc2ccccc12)c1ccccc1F
Show InChI InChI=1S/C36H45ClFN5O2/c1-4-41(5-2)25-34(30-12-8-9-13-31(30)38)42-18-20-43(21-19-42)36(45)32(22-26-14-16-28(37)17-15-26)39-35(44)23-33-29-11-7-6-10-27(29)24-40(33)3/h6-17,32-34H,4-5,18-25H2,1-3H3,(H,39,44)/t32-,33?,34?/m1/s1
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17n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


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


Bioorg Med Chem Lett 16: 2341-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.103
BindingDB Entry DOI: 10.7270/Q2NS0TF6
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM50372555
PNG
(CHEMBL272099)
Show SMILES N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCC(Cn2cncn2)(CC1)C1CCCCC1
Show InChI InChI=1S/C23H32ClN5O/c24-20-8-6-18(7-9-20)14-21(25)22(30)28-12-10-23(11-13-28,15-29-17-26-16-27-29)19-4-2-1-3-5-19/h6-9,16-17,19,21H,1-5,10-15,25H2/t21-/m1/s1
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23n/an/an/an/an/an/an/an/a



Nanyang Technological University

Curated by ChEMBL


Assay Description
Displacement of europium labeled NDP-alpha-MSH from human MC4 receptor expressed in HEK293 cells


Bioorg Med Chem Lett 18: 1223-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.11.109
BindingDB Entry DOI: 10.7270/Q2TM7BZM
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM50186869
PNG
(CHEMBL375388 | N-{(R)-1-(4-chloro-benzyl)-2-[4-(4-...)
Show SMILES CC(C)CC1(CCN(CC1)S(C)(=O)=O)N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)CC1NCc2ccccc12
Show InChI InChI=1S/C33H46ClN5O4S/c1-24(2)22-33(12-14-39(15-13-33)44(3,42)43)38-18-16-37(17-19-38)32(41)30(20-25-8-10-27(34)11-9-25)36-31(40)21-29-28-7-5-4-6-26(28)23-35-29/h4-11,24,29-30,35H,12-23H2,1-3H3,(H,36,40)/t29?,30-/m1/s1
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27n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from human MC4 receptor transfected in HEK293 cells


Bioorg Med Chem Lett 16: 3843-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.04.016
BindingDB Entry DOI: 10.7270/Q2SQ900D
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM50186861
PNG
(CHEMBL213940 | N-{(R)-1-(4-chloro-benzyl)-2-[4-(4-...)
Show SMILES CC(C)CC1(CCOCC1)N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)CC1NCc2ccccc12
Show InChI InChI=1S/C32H43ClN4O3/c1-23(2)21-32(11-17-40-18-12-32)37-15-13-36(14-16-37)31(39)29(19-24-7-9-26(33)10-8-24)35-30(38)20-28-27-6-4-3-5-25(27)22-34-28/h3-10,23,28-29,34H,11-22H2,1-2H3,(H,35,38)/t28?,29-/m1/s1
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31n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from human MC4 receptor transfected in HEK293 cells


Bioorg Med Chem Lett 16: 3843-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.04.016
BindingDB Entry DOI: 10.7270/Q2SQ900D
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM50186864
PNG
(CHEMBL373735 | N-[(R)-2-[4-(1-acetyl-4-isobutyl-pi...)
Show SMILES CC(C)CC1(CCN(CC1)C(C)=O)N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)CC1NCc2ccccc12
Show InChI InChI=1S/C34H46ClN5O3/c1-24(2)22-34(12-14-38(15-13-34)25(3)41)40-18-16-39(17-19-40)33(43)31(20-26-8-10-28(35)11-9-26)37-32(42)21-30-29-7-5-4-6-27(29)23-36-30/h4-11,24,30-31,36H,12-23H2,1-3H3,(H,37,42)/t30?,31-/m1/s1
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38n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from human MC4 receptor transfected in HEK293 cells


Bioorg Med Chem Lett 16: 3843-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.04.016
BindingDB Entry DOI: 10.7270/Q2SQ900D
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM50177561
PNG
((R)-N-((R)-3-(4-chlorophenyl)-1-(4-(2-(diethylamin...)
Show SMILES CCN(CC)CC(N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H]1Cc2ccccc2CN1)c1ccccc1F
Show InChI InChI=1S/C35H43ClFN5O2/c1-3-40(4-2)24-33(29-11-7-8-12-30(29)37)41-17-19-42(20-18-41)35(44)32(21-25-13-15-28(36)16-14-25)39-34(43)31-22-26-9-5-6-10-27(26)23-38-31/h5-16,31-33,38H,3-4,17-24H2,1-2H3,(H,39,43)/t31-,32-,33?/m1/s1
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41n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


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


Bioorg Med Chem Lett 16: 2341-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.103
BindingDB Entry DOI: 10.7270/Q2NS0TF6
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM50186871
PNG
(CHEMBL211032 | N-{(R)-1-(4-chloro-benzyl)-2-[4-(4-...)
Show SMILES CC(C)C1(CCN(C)CC1)N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)CC1NCc2ccccc12
Show InChI InChI=1S/C32H44ClN5O2/c1-23(2)32(12-14-36(3)15-13-32)38-18-16-37(17-19-38)31(40)29(20-24-8-10-26(33)11-9-24)35-30(39)21-28-27-7-5-4-6-25(27)22-34-28/h4-11,23,28-29,34H,12-22H2,1-3H3,(H,35,39)/t28?,29-/m1/s1
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42n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from human MC4 receptor transfected in HEK293 cells


Bioorg Med Chem Lett 16: 3843-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.04.016
BindingDB Entry DOI: 10.7270/Q2SQ900D
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM50186867
PNG
(CHEMBL378415 | N-[(R)-2-[4-(4-benzyl-1-methyl-pipe...)
Show SMILES CN1CCC(Cc2ccccc2)(CC1)N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)CC1NCc2ccccc12
Show InChI InChI=1S/C36H44ClN5O2/c1-40-17-15-36(16-18-40,25-28-7-3-2-4-8-28)42-21-19-41(20-22-42)35(44)33(23-27-11-13-30(37)14-12-27)39-34(43)24-32-31-10-6-5-9-29(31)26-38-32/h2-14,32-33,38H,15-26H2,1H3,(H,39,43)/t32?,33-/m1/s1
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44n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from human MC4 receptor transfected in HEK293 cells


Bioorg Med Chem Lett 16: 3843-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.04.016
BindingDB Entry DOI: 10.7270/Q2SQ900D
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM50186875
PNG
(CHEMBL375389 | N-{(R)-1-(4-chloro-benzyl)-2-[4-(1-...)
Show SMILES CC(C)CC1(CCCCC1)N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)CC1NCc2ccccc12
Show InChI InChI=1S/C33H45ClN4O2/c1-24(2)22-33(14-6-3-7-15-33)38-18-16-37(17-19-38)32(40)30(20-25-10-12-27(34)13-11-25)36-31(39)21-29-28-9-5-4-8-26(28)23-35-29/h4-5,8-13,24,29-30,35H,3,6-7,14-23H2,1-2H3,(H,36,39)/t29?,30-/m1/s1
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47n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from human MC4 receptor transfected in HEK293 cells


Bioorg Med Chem Lett 16: 3843-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.04.016
BindingDB Entry DOI: 10.7270/Q2SQ900D
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM50186859
PNG
(CHEMBL211475 | N-{(R)-1-(4-chloro-benzyl)-2-[4-(4-...)
Show SMILES CC(C)CC1(CCSCC1)N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)CC1NCc2ccccc12
Show InChI InChI=1S/C32H43ClN4O2S/c1-23(2)21-32(11-17-40-18-12-32)37-15-13-36(14-16-37)31(39)29(19-24-7-9-26(33)10-8-24)35-30(38)20-28-27-6-4-3-5-25(27)22-34-28/h3-10,23,28-29,34H,11-22H2,1-2H3,(H,35,38)/t28?,29-/m1/s1
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68n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from human MC4 receptor transfected in HEK293 cells


Bioorg Med Chem Lett 16: 3843-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.04.016
BindingDB Entry DOI: 10.7270/Q2SQ900D
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM50186860
PNG
(CHEMBL210922 | N-{(R)-1-(4-chloro-benzyl)-2-[4-(4-...)
Show SMILES CCCCCCC1(CCN(C)CC1)N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)CC1NCc2ccccc12
Show InChI InChI=1S/C35H50ClN5O2/c1-3-4-5-8-15-35(16-18-39(2)19-17-35)41-22-20-40(21-23-41)34(43)32(24-27-11-13-29(36)14-12-27)38-33(42)25-31-30-10-7-6-9-28(30)26-37-31/h6-7,9-14,31-32,37H,3-5,8,15-26H2,1-2H3,(H,38,42)/t31?,32-/m1/s1
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70n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from human MC4 receptor transfected in HEK293 cells


Bioorg Med Chem Lett 16: 3843-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.04.016
BindingDB Entry DOI: 10.7270/Q2SQ900D
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM50177558
PNG
(CHEMBL438432 | N-((R)-3-(4-chlorophenyl)-1-(4-(2-(...)
Show SMILES CCN(CC)CC(N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)CC1(C)NCc2ccccc12)c1ccccc1F
Show InChI InChI=1S/C36H45ClFN5O2/c1-4-41(5-2)25-33(29-11-7-9-13-31(29)38)42-18-20-43(21-19-42)35(45)32(22-26-14-16-28(37)17-15-26)40-34(44)23-36(3)30-12-8-6-10-27(30)24-39-36/h6-17,32-33,39H,4-5,18-25H2,1-3H3,(H,40,44)/t32-,33?,36?/m1/s1
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74n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


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


Bioorg Med Chem Lett 16: 2341-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.103
BindingDB Entry DOI: 10.7270/Q2NS0TF6
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM50186866
PNG
(CHEMBL211792 | N-{(R)-1-(4-chloro-benzyl)-2-[4-(4-...)
Show SMILES CC(C)CC1(CCS(=O)(=O)CC1)N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)CC1NCc2ccccc12
Show InChI InChI=1S/C32H43ClN4O4S/c1-23(2)21-32(11-17-42(40,41)18-12-32)37-15-13-36(14-16-37)31(39)29(19-24-7-9-26(33)10-8-24)35-30(38)20-28-27-6-4-3-5-25(27)22-34-28/h3-10,23,28-29,34H,11-22H2,1-2H3,(H,35,38)/t28?,29-/m1/s1
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76n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from human MC4 receptor transfected in HEK293 cells


Bioorg Med Chem Lett 16: 3843-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.04.016
BindingDB Entry DOI: 10.7270/Q2SQ900D
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM50177562
PNG
(CHEMBL206840 | N-((R)-3-(4-chlorophenyl)-1-(4-(2-(...)
Show SMILES CCN(CC)CC(N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)c1cc2ccccc2cn1)c1ccccc1F
Show InChI InChI=1S/C35H39ClFN5O2/c1-3-40(4-2)24-33(29-11-7-8-12-30(29)37)41-17-19-42(20-18-41)35(44)32(21-25-13-15-28(36)16-14-25)39-34(43)31-22-26-9-5-6-10-27(26)23-38-31/h5-16,22-23,32-33H,3-4,17-21,24H2,1-2H3,(H,39,43)/t32-,33?/m1/s1
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96n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


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


Bioorg Med Chem Lett 16: 2341-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.103
BindingDB Entry DOI: 10.7270/Q2NS0TF6
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM50186873
PNG
(CHEMBL209417 | N-{(R)-1-(4-chloro-benzyl)-2-[4-(4-...)
Show SMILES CC(C)CC1(CCN(CC1)C(=O)C(C)C)N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)CC1NCc2ccccc12
Show InChI InChI=1S/C36H50ClN5O3/c1-25(2)23-36(13-15-40(16-14-36)34(44)26(3)4)42-19-17-41(18-20-42)35(45)32(21-27-9-11-29(37)12-10-27)39-33(43)22-31-30-8-6-5-7-28(30)24-38-31/h5-12,25-26,31-32,38H,13-24H2,1-4H3,(H,39,43)/t31?,32-/m1/s1
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101n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from human MC4 receptor transfected in HEK293 cells


Bioorg Med Chem Lett 16: 3843-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.04.016
BindingDB Entry DOI: 10.7270/Q2SQ900D
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM50177559
PNG
(CHEMBL379352 | N-((R)-3-(4-chlorophenyl)-1-(4-(1-(...)
Show SMILES CCN(CC)CC(N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)CC1NCc2ccccc12)c1ccccc1Cl
Show InChI InChI=1S/C35H43Cl2N5O2/c1-3-40(4-2)24-33(29-11-7-8-12-30(29)37)41-17-19-42(20-18-41)35(44)32(21-25-13-15-27(36)16-14-25)39-34(43)22-31-28-10-6-5-9-26(28)23-38-31/h5-16,31-33,38H,3-4,17-24H2,1-2H3,(H,39,43)/t31?,32-,33?/m1/s1
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107n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


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


Bioorg Med Chem Lett 16: 2341-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.103
BindingDB Entry DOI: 10.7270/Q2NS0TF6
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM50177559
PNG
(CHEMBL379352 | N-((R)-3-(4-chlorophenyl)-1-(4-(1-(...)
Show SMILES CCN(CC)CC(N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)CC1NCc2ccccc12)c1ccccc1Cl
Show InChI InChI=1S/C35H43Cl2N5O2/c1-3-40(4-2)24-33(29-11-7-8-12-30(29)37)41-17-19-42(20-18-41)35(44)32(21-25-13-15-27(36)16-14-25)39-34(43)22-31-28-10-6-5-9-26(28)23-38-31/h5-16,31-33,38H,3-4,17-24H2,1-2H3,(H,39,43)/t31?,32-,33?/m1/s1
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107n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


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


Bioorg Med Chem Lett 16: 2341-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.103
BindingDB Entry DOI: 10.7270/Q2NS0TF6
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Homo sapiens (Human))
BDBM50119368
PNG
((R)-1,2,3,4-Tetrahydro-isoquinoline-3-carboxylic a...)
Show SMILES Clc1ccc(C[C@@H](NC(=O)[C@H]2Cc3ccccc3CN2)C(=O)N2CCC(Cn3cncn3)(CC2)C2CCCCC2)cc1
Show InChI InChI=1S/C33H41ClN6O2/c34-28-12-10-24(11-13-28)18-30(38-31(41)29-19-25-6-4-5-7-26(25)20-36-29)32(42)39-16-14-33(15-17-39,21-40-23-35-22-37-40)27-8-2-1-3-9-27/h4-7,10-13,22-23,27,29-30,36H,1-3,8-9,14-21H2,(H,38,41)/t29-,30-/m1/s1
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125n/an/an/an/an/an/an/an/a



Nanyang Technological University

Curated by ChEMBL


Assay Description
Displacement of europium labeled NDP-alpha-MSH from human MC3 receptor expressed in HEK293 cells


Bioorg Med Chem Lett 18: 1223-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.11.109
BindingDB Entry DOI: 10.7270/Q2TM7BZM
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM50186872
PNG
(CHEMBL376936 | N-{(R)-1-(4-chloro-benzyl)-2-[4-(1-...)
Show SMILES CN1CCC(CC1)(N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)CC1NCc2ccccc12)c1ccccc1
Show InChI InChI=1S/C35H42ClN5O2/c1-39-17-15-35(16-18-39,28-8-3-2-4-9-28)41-21-19-40(20-22-41)34(43)32(23-26-11-13-29(36)14-12-26)38-33(42)24-31-30-10-6-5-7-27(30)25-37-31/h2-14,31-32,37H,15-25H2,1H3,(H,38,42)/t31?,32-/m1/s1
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215n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from human MC4 receptor transfected in HEK293 cells


Bioorg Med Chem Lett 16: 3843-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.04.016
BindingDB Entry DOI: 10.7270/Q2SQ900D
More data for this
Ligand-Target Pair
Melanocyte-stimulating hormone receptor


(Homo sapiens (Human))
BDBM50119368
PNG
((R)-1,2,3,4-Tetrahydro-isoquinoline-3-carboxylic a...)
Show SMILES Clc1ccc(C[C@@H](NC(=O)[C@H]2Cc3ccccc3CN2)C(=O)N2CCC(Cn3cncn3)(CC2)C2CCCCC2)cc1
Show InChI InChI=1S/C33H41ClN6O2/c34-28-12-10-24(11-13-28)18-30(38-31(41)29-19-25-6-4-5-7-26(25)20-36-29)32(42)39-16-14-33(15-17-39,21-40-23-35-22-37-40)27-8-2-1-3-9-27/h4-7,10-13,22-23,27,29-30,36H,1-3,8-9,14-21H2,(H,38,41)/t29-,30-/m1/s1
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300n/an/an/an/an/an/an/an/a



Nanyang Technological University

Curated by ChEMBL


Assay Description
Displacement of europium labeled NDP-alpha-MSH from human MC1 receptor expressed in HEK293 cells


Bioorg Med Chem Lett 18: 1223-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.11.109
BindingDB Entry DOI: 10.7270/Q2TM7BZM
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM50186870
PNG
(CHEMBL208953 | N-{(R)-1-(4-chloro-benzyl)-2-[4-(4-...)
Show SMILES CCC1(CCN(C)CC1)N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)CC1NCc2ccccc12
Show InChI InChI=1S/C31H42ClN5O2/c1-3-31(12-14-35(2)15-13-31)37-18-16-36(17-19-37)30(39)28(20-23-8-10-25(32)11-9-23)34-29(38)21-27-26-7-5-4-6-24(26)22-33-27/h4-11,27-28,33H,3,12-22H2,1-2H3,(H,34,38)/t27?,28-/m1/s1
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370n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from human MC4 receptor transfected in HEK293 cells


Bioorg Med Chem Lett 16: 3843-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.04.016
BindingDB Entry DOI: 10.7270/Q2SQ900D
More data for this
Ligand-Target Pair
Melanocortin receptor 5


(Homo sapiens (Human))
BDBM50177564
PNG
(CHEMBL380540 | N-((R)-3-(4-chlorophenyl)-1-(4-(2-(...)
Show SMILES CCN(CC)CC(N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)C1Cc2ccccc2C(C)(C)N1)c1ccccc1F
Show InChI InChI=1S/C37H47ClFN5O2/c1-5-42(6-2)25-34(29-12-8-10-14-31(29)39)43-19-21-44(22-20-43)36(46)33(23-26-15-17-28(38)18-16-26)40-35(45)32-24-27-11-7-9-13-30(27)37(3,4)41-32/h7-18,32-34,41H,5-6,19-25H2,1-4H3,(H,40,45)/t32?,33-,34?/m1/s1
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420n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from cloned human MC5R expressed in HEK293 cell


Bioorg Med Chem Lett 16: 2341-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.103
BindingDB Entry DOI: 10.7270/Q2NS0TF6
More data for this
Ligand-Target Pair
Melanocortin receptor 5


(Homo sapiens (Human))
BDBM50177557
PNG
(CHEMBL380365 | N-((R)-3-(4-chlorophenyl)-1-(4-(2-(...)
Show SMILES CCN(CC)CC(N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)CC1NCCc2ccccc12)c1ccccc1F
Show InChI InChI=1S/C36H45ClFN5O2/c1-3-41(4-2)25-34(30-11-7-8-12-31(30)38)42-19-21-43(22-20-42)36(45)33(23-26-13-15-28(37)16-14-26)40-35(44)24-32-29-10-6-5-9-27(29)17-18-39-32/h5-16,32-34,39H,3-4,17-25H2,1-2H3,(H,40,44)/t32?,33-,34?/m1/s1
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910n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from cloned human MC5R expressed in HEK293 cell


Bioorg Med Chem Lett 16: 2341-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.103
BindingDB Entry DOI: 10.7270/Q2NS0TF6
More data for this
Ligand-Target Pair
Melanocortin receptor 5


(Homo sapiens (Human))
BDBM50177562
PNG
(CHEMBL206840 | N-((R)-3-(4-chlorophenyl)-1-(4-(2-(...)
Show SMILES CCN(CC)CC(N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)c1cc2ccccc2cn1)c1ccccc1F
Show InChI InChI=1S/C35H39ClFN5O2/c1-3-40(4-2)24-33(29-11-7-8-12-30(29)37)41-17-19-42(20-18-41)35(44)32(21-25-13-15-28(36)16-14-25)39-34(43)31-22-26-9-5-6-10-27(26)23-38-31/h5-16,22-23,32-33H,3-4,17-21,24H2,1-2H3,(H,39,43)/t32-,33?/m1/s1
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920n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from cloned human MC5R expressed in HEK293 cell


Bioorg Med Chem Lett 16: 2341-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.103
BindingDB Entry DOI: 10.7270/Q2NS0TF6
More data for this
Ligand-Target Pair
Melanocortin receptor 5


(Homo sapiens (Human))
BDBM50177561
PNG
((R)-N-((R)-3-(4-chlorophenyl)-1-(4-(2-(diethylamin...)
Show SMILES CCN(CC)CC(N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H]1Cc2ccccc2CN1)c1ccccc1F
Show InChI InChI=1S/C35H43ClFN5O2/c1-3-40(4-2)24-33(29-11-7-8-12-30(29)37)41-17-19-42(20-18-41)35(44)32(21-25-13-15-28(36)16-14-25)39-34(43)31-22-26-9-5-6-10-27(26)23-38-31/h5-16,31-33,38H,3-4,17-24H2,1-2H3,(H,39,43)/t31-,32-,33?/m1/s1
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950n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from cloned human MC5R expressed in HEK293 cell


Bioorg Med Chem Lett 16: 2341-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.103
BindingDB Entry DOI: 10.7270/Q2NS0TF6
More data for this
Ligand-Target Pair
Melanocortin receptor 5


(Homo sapiens (Human))
BDBM50177563
PNG
(CHEMBL380855 | N-((R)-3-(4-chlorophenyl)-1-(4-(2-(...)
Show SMILES CCN(CC)CC(N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)CC1NCc2ccccc12)c1ccccc1F
Show InChI InChI=1S/C35H43ClFN5O2/c1-3-40(4-2)24-33(29-11-7-8-12-30(29)37)41-17-19-42(20-18-41)35(44)32(21-25-13-15-27(36)16-14-25)39-34(43)22-31-28-10-6-5-9-26(28)23-38-31/h5-16,31-33,38H,3-4,17-24H2,1-2H3,(H,39,43)/t31?,32-,33?/m1/s1
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1.20E+3n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from cloned human MC5R expressed in HEK293 cell


Bioorg Med Chem Lett 16: 2341-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.103
BindingDB Entry DOI: 10.7270/Q2NS0TF6
More data for this
Ligand-Target Pair
Melanocortin receptor 5


(Homo sapiens (Human))
BDBM50177558
PNG
(CHEMBL438432 | N-((R)-3-(4-chlorophenyl)-1-(4-(2-(...)
Show SMILES CCN(CC)CC(N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)CC1(C)NCc2ccccc12)c1ccccc1F
Show InChI InChI=1S/C36H45ClFN5O2/c1-4-41(5-2)25-33(29-11-7-9-13-31(29)38)42-18-20-43(21-19-42)35(45)32(22-26-14-16-28(37)17-15-26)40-34(44)23-36(3)30-12-8-6-10-27(30)24-39-36/h6-17,32-33,39H,4-5,18-25H2,1-3H3,(H,40,44)/t32-,33?,36?/m1/s1
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1.40E+3n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from cloned human MC5R expressed in HEK293 cell


Bioorg Med Chem Lett 16: 2341-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.103
BindingDB Entry DOI: 10.7270/Q2NS0TF6
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Homo sapiens (Human))
BDBM50177562
PNG
(CHEMBL206840 | N-((R)-3-(4-chlorophenyl)-1-(4-(2-(...)
Show SMILES CCN(CC)CC(N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)c1cc2ccccc2cn1)c1ccccc1F
Show InChI InChI=1S/C35H39ClFN5O2/c1-3-40(4-2)24-33(29-11-7-8-12-30(29)37)41-17-19-42(20-18-41)35(44)32(21-25-13-15-28(36)16-14-25)39-34(43)31-22-26-9-5-6-10-27(26)23-38-31/h5-16,22-23,32-33H,3-4,17-21,24H2,1-2H3,(H,39,43)/t32-,33?/m1/s1
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1.40E+3n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from cloned human MC3R expressed in HEK293 cell


Bioorg Med Chem Lett 16: 2341-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.103
BindingDB Entry DOI: 10.7270/Q2NS0TF6
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Homo sapiens (Human))
BDBM50177564
PNG
(CHEMBL380540 | N-((R)-3-(4-chlorophenyl)-1-(4-(2-(...)
Show SMILES CCN(CC)CC(N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)C1Cc2ccccc2C(C)(C)N1)c1ccccc1F
Show InChI InChI=1S/C37H47ClFN5O2/c1-5-42(6-2)25-34(29-12-8-10-14-31(29)39)43-19-21-44(22-20-43)36(46)33(23-26-15-17-28(38)18-16-26)40-35(45)32-24-27-11-7-9-13-30(27)37(3,4)41-32/h7-18,32-34,41H,5-6,19-25H2,1-4H3,(H,40,45)/t32?,33-,34?/m1/s1
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1.90E+3n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from cloned human MC3R expressed in HEK293 cell


Bioorg Med Chem Lett 16: 2341-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.103
BindingDB Entry DOI: 10.7270/Q2NS0TF6
More data for this
Ligand-Target Pair
Melanocortin receptor 5


(Homo sapiens (Human))
BDBM50177565
PNG
(CHEMBL380858 | N-((R)-3-(4-chlorophenyl)-1-(4-(2-(...)
Show SMILES CCN(CC)CC(N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)CC1N(C)Cc2ccccc12)c1ccccc1F
Show InChI InChI=1S/C36H45ClFN5O2/c1-4-41(5-2)25-34(30-12-8-9-13-31(30)38)42-18-20-43(21-19-42)36(45)32(22-26-14-16-28(37)17-15-26)39-35(44)23-33-29-11-7-6-10-27(29)24-40(33)3/h6-17,32-34H,4-5,18-25H2,1-3H3,(H,39,44)/t32-,33?,34?/m1/s1
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2.00E+3n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from cloned human MC5R expressed in HEK293 cell


Bioorg Med Chem Lett 16: 2341-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.103
BindingDB Entry DOI: 10.7270/Q2NS0TF6
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Homo sapiens (Human))
BDBM50372555
PNG
(CHEMBL272099)
Show SMILES N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCC(Cn2cncn2)(CC1)C1CCCCC1
Show InChI InChI=1S/C23H32ClN5O/c24-20-8-6-18(7-9-20)14-21(25)22(30)28-12-10-23(11-13-28,15-29-17-26-16-27-29)19-4-2-1-3-5-19/h6-9,16-17,19,21H,1-5,10-15,25H2/t21-/m1/s1
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2.30E+3n/an/an/an/an/an/an/an/a



Nanyang Technological University

Curated by ChEMBL


Assay Description
Displacement of europium labeled NDP-alpha-MSH from human MC3 receptor expressed in HEK293 cells


Bioorg Med Chem Lett 18: 1223-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.11.109
BindingDB Entry DOI: 10.7270/Q2TM7BZM
More data for this
Ligand-Target Pair
Melanocyte-stimulating hormone receptor


(Homo sapiens (Human))
BDBM50177557
PNG
(CHEMBL380365 | N-((R)-3-(4-chlorophenyl)-1-(4-(2-(...)
Show SMILES CCN(CC)CC(N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)CC1NCCc2ccccc12)c1ccccc1F
Show InChI InChI=1S/C36H45ClFN5O2/c1-3-41(4-2)25-34(30-11-7-8-12-31(30)38)42-19-21-43(22-20-42)36(45)33(23-26-13-15-28(37)16-14-26)40-35(44)24-32-29-10-6-5-9-27(29)17-18-39-32/h5-16,32-34,39H,3-4,17-25H2,1-2H3,(H,40,44)/t32?,33-,34?/m1/s1
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3.00E+3n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from cloned human MC1R expressed in HEK293 cell


Bioorg Med Chem Lett 16: 2341-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.103
BindingDB Entry DOI: 10.7270/Q2NS0TF6
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Homo sapiens (Human))
BDBM50177563
PNG
(CHEMBL380855 | N-((R)-3-(4-chlorophenyl)-1-(4-(2-(...)
Show SMILES CCN(CC)CC(N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)CC1NCc2ccccc12)c1ccccc1F
Show InChI InChI=1S/C35H43ClFN5O2/c1-3-40(4-2)24-33(29-11-7-8-12-30(29)37)41-17-19-42(20-18-41)35(44)32(21-25-13-15-27(36)16-14-25)39-34(43)22-31-28-10-6-5-9-26(28)23-38-31/h5-16,31-33,38H,3-4,17-24H2,1-2H3,(H,39,43)/t31?,32-,33?/m1/s1
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3.40E+3n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from cloned human MC3R expressed in HEK293 cell


Bioorg Med Chem Lett 16: 2341-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.103
BindingDB Entry DOI: 10.7270/Q2NS0TF6
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Homo sapiens (Human))
BDBM50372554
PNG
(CHEMBL258295)
Show SMILES [#7]-[#6@H](-[#6]-c1ccc(F)cc1)-[#6](=O)-[#7]-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#6]-c1ccccc1
Show InChI InChI=1S/C21H28FN5O/c22-17-10-8-16(9-11-17)14-19(23)20(28)27-18(7-4-12-26-21(24)25)13-15-5-2-1-3-6-15/h1-3,5-6,8-11,18-19H,4,7,12-14,23H2,(H,27,28)(H4,24,25,26)/t18-,19-/m1/s1
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3.50E+3n/an/an/an/an/an/an/an/a



Nanyang Technological University

Curated by ChEMBL


Assay Description
Displacement of europium labeled NDP-alpha-MSH from human MC3 receptor expressed in HEK293 cells


Bioorg Med Chem Lett 18: 1223-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.11.109
BindingDB Entry DOI: 10.7270/Q2TM7BZM
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Homo sapiens (Human))
BDBM50177557
PNG
(CHEMBL380365 | N-((R)-3-(4-chlorophenyl)-1-(4-(2-(...)
Show SMILES CCN(CC)CC(N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)CC1NCCc2ccccc12)c1ccccc1F
Show InChI InChI=1S/C36H45ClFN5O2/c1-3-41(4-2)25-34(30-11-7-8-12-31(30)38)42-19-21-43(22-20-42)36(45)33(23-26-13-15-28(37)16-14-26)40-35(44)24-32-29-10-6-5-9-27(29)17-18-39-32/h5-16,32-34,39H,3-4,17-25H2,1-2H3,(H,40,44)/t32?,33-,34?/m1/s1
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4.20E+3n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from cloned human MC3R expressed in HEK293 cell


Bioorg Med Chem Lett 16: 2341-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.103
BindingDB Entry DOI: 10.7270/Q2NS0TF6
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM50372554
PNG
(CHEMBL258295)
Show SMILES [#7]-[#6@H](-[#6]-c1ccc(F)cc1)-[#6](=O)-[#7]-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#6]-c1ccccc1
Show InChI InChI=1S/C21H28FN5O/c22-17-10-8-16(9-11-17)14-19(23)20(28)27-18(7-4-12-26-21(24)25)13-15-5-2-1-3-6-15/h1-3,5-6,8-11,18-19H,4,7,12-14,23H2,(H,27,28)(H4,24,25,26)/t18-,19-/m1/s1
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4.20E+3n/an/an/an/an/an/an/an/a



Nanyang Technological University

Curated by ChEMBL


Assay Description
Displacement of europium labeled NDP-alpha-MSH from human MC4 receptor expressed in HEK293 cells


Bioorg Med Chem Lett 18: 1223-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.11.109
BindingDB Entry DOI: 10.7270/Q2TM7BZM
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Homo sapiens (Human))
BDBM50372552
PNG
(CHEMBL403722)
Show SMILES N[C@H](Cc1ccc(F)cc1)C(=O)NCCC(Cn1cncn1)C1CCCCC1 |w:15.15|
Show InChI InChI=1S/C21H30FN5O/c22-19-8-6-16(7-9-19)12-20(23)21(28)25-11-10-18(13-27-15-24-14-26-27)17-4-2-1-3-5-17/h6-9,14-15,17-18,20H,1-5,10-13,23H2,(H,25,28)/t18?,20-/m1/s1
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4.50E+3n/an/an/an/an/an/an/an/a



Nanyang Technological University

Curated by ChEMBL


Assay Description
Displacement of europium labeled NDP-alpha-MSH from human MC3 receptor expressed in HEK293 cells


Bioorg Med Chem Lett 18: 1223-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.11.109
BindingDB Entry DOI: 10.7270/Q2TM7BZM
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Homo sapiens (Human))
BDBM50177565
PNG
(CHEMBL380858 | N-((R)-3-(4-chlorophenyl)-1-(4-(2-(...)
Show SMILES CCN(CC)CC(N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)CC1N(C)Cc2ccccc12)c1ccccc1F
Show InChI InChI=1S/C36H45ClFN5O2/c1-4-41(5-2)25-34(30-12-8-9-13-31(30)38)42-18-20-43(21-19-42)36(45)32(22-26-14-16-28(37)17-15-26)39-35(44)23-33-29-11-7-6-10-27(29)24-40(33)3/h6-17,32-34H,4-5,18-25H2,1-3H3,(H,39,44)/t32-,33?,34?/m1/s1
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4.60E+3n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from cloned human MC3R expressed in HEK293 cell


Bioorg Med Chem Lett 16: 2341-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.103
BindingDB Entry DOI: 10.7270/Q2NS0TF6
More data for this
Ligand-Target Pair
Melanocyte-stimulating hormone receptor


(Homo sapiens (Human))
BDBM50177561
PNG
((R)-N-((R)-3-(4-chlorophenyl)-1-(4-(2-(diethylamin...)
Show SMILES CCN(CC)CC(N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H]1Cc2ccccc2CN1)c1ccccc1F
Show InChI InChI=1S/C35H43ClFN5O2/c1-3-40(4-2)24-33(29-11-7-8-12-30(29)37)41-17-19-42(20-18-41)35(44)32(21-25-13-15-28(36)16-14-25)39-34(43)31-22-26-9-5-6-10-27(26)23-38-31/h5-16,31-33,38H,3-4,17-24H2,1-2H3,(H,39,43)/t31-,32-,33?/m1/s1
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Article
PubMed
5.80E+3n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-alpha-MSH from cloned human MC1R expressed in HEK293 cell


Bioorg Med Chem Lett 16: 2341-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.103
BindingDB Entry DOI: 10.7270/Q2NS0TF6
More data for this
Ligand-Target Pair
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