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Compile Data Set for Download or QSAR

Found 268 hits with Last Name = 'fleming' and Initial = 'ka'   
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
Melanocyte-stimulating hormone receptor


(Mus musculus)
BDBM50258943
PNG
(CHEMBL4060087)
Show SMILES C[C@@H]1NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CS)NC(=O)[C@H](CS)NC1=O |r|
Show InChI InChI=1S/C38H53N11O9S2/c1-21-31(52)48-28(19-59)37(58)49-29(20-60)36(57)45-24(13-8-14-41-38(39)40)33(54)47-26(16-23-11-6-3-7-12-23)34(55)46-25(15-22-9-4-2-5-10-22)32(53)42-17-30(51)44-27(18-50)35(56)43-21/h2-7,9-12,21,24-29,50,59-60H,8,13-20H2,1H3,(H,42,53)(H,43,56)(H,44,51)(H,45,57)(H,46,55)(H,47,54)(H,48,52)(H,49,58)(H4,39,40,41)/t21-,24-,25-,26-,27-,28-,29-/m0/s1
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2.60n/an/an/an/an/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Displacement of [125I]-NDP-R-MSH from melanocortin receptor 1 in mouse B16F10 cells after 2 hrs by scintillation counting method


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Mus musculus)
BDBM50258943
PNG
(CHEMBL4060087)
Show SMILES C[C@@H]1NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CS)NC(=O)[C@H](CS)NC1=O |r|
Show InChI InChI=1S/C38H53N11O9S2/c1-21-31(52)48-28(19-59)37(58)49-29(20-60)36(57)45-24(13-8-14-41-38(39)40)33(54)47-26(16-23-11-6-3-7-12-23)34(55)46-25(15-22-9-4-2-5-10-22)32(53)42-17-30(51)44-27(18-50)35(56)43-21/h2-7,9-12,21,24-29,50,59-60H,8,13-20H2,1H3,(H,42,53)(H,43,56)(H,44,51)(H,45,57)(H,46,55)(H,47,54)(H,48,52)(H,49,58)(H4,39,40,41)/t21-,24-,25-,26-,27-,28-,29-/m0/s1
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54n/an/an/an/an/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Displacement of [125I]-NDP-R-MSH from mouse melanocortin receptor 4 expressed in HEK293 cells after 2 hrs by scintillation counting method


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Mus musculus)
BDBM50258943
PNG
(CHEMBL4060087)
Show SMILES C[C@@H]1NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CS)NC(=O)[C@H](CS)NC1=O |r|
Show InChI InChI=1S/C38H53N11O9S2/c1-21-31(52)48-28(19-59)37(58)49-29(20-60)36(57)45-24(13-8-14-41-38(39)40)33(54)47-26(16-23-11-6-3-7-12-23)34(55)46-25(15-22-9-4-2-5-10-22)32(53)42-17-30(51)44-27(18-50)35(56)43-21/h2-7,9-12,21,24-29,50,59-60H,8,13-20H2,1H3,(H,42,53)(H,43,56)(H,44,51)(H,45,57)(H,46,55)(H,47,54)(H,48,52)(H,49,58)(H4,39,40,41)/t21-,24-,25-,26-,27-,28-,29-/m0/s1
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190n/an/an/an/an/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Displacement of [125I]-NDP-R-MSH from mouse melanocortin receptor 3 expressed in HEK293 cells after 2 hrs by scintillation counting method


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Mus musculus)
BDBM50258944
PNG
(CHEMBL4077783)
Show SMILES [H][C@@]12CCCN1C(=O)[C@@]1([H])CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC2=O |r|
Show InChI InChI=1S/C49H63N11O8/c1-30-41(61)53-31(2)42(62)58-38(29-34-19-10-5-11-20-34)47(67)60-26-14-23-40(60)48(68)59-25-13-22-39(59)46(66)55-35(21-12-24-52-49(50)51)43(63)56-37(28-33-17-8-4-9-18-33)45(65)57-36(44(64)54-30)27-32-15-6-3-7-16-32/h3-11,15-20,30-31,35-40H,12-14,21-29H2,1-2H3,(H,53,61)(H,54,64)(H,55,66)(H,56,63)(H,57,65)(H,58,62)(H4,50,51,52)/t30-,31-,35-,36-,37-,38-,39-,40+/m0/s1
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n/an/an/an/a>1.00E+5n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse melanocortin receptor 4 expressed in HEK293 cells assessed as increase in cAMP accumulation after 2 hrs by AlphaScreen assa...


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Mus musculus)
BDBM50258945
PNG
(CHEMBL4094419)
Show SMILES [H][C@@]12CCCN1C(=O)[C@@]1([H])CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC2=O)C(C)C |r|
Show InChI InChI=1S/C51H67N11O8/c1-31(2)42-48(68)55-32(3)43(63)59-39(30-35-20-11-6-12-21-35)49(69)62-27-15-24-41(62)50(70)61-26-14-23-40(61)47(67)56-36(22-13-25-54-51(52)53)44(64)57-37(28-33-16-7-4-8-17-33)45(65)58-38(46(66)60-42)29-34-18-9-5-10-19-34/h4-12,16-21,31-32,36-42H,13-15,22-30H2,1-3H3,(H,55,68)(H,56,67)(H,57,64)(H,58,65)(H,59,63)(H,60,66)(H4,52,53,54)/t32-,36-,37-,38-,39-,40-,41+,42-/m0/s1
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n/an/an/an/a>1.00E+5n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse melanocortin receptor 4 expressed in HEK293 cells assessed as increase in cAMP accumulation after 2 hrs by AlphaScreen assa...


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Mus musculus)
BDBM50258946
PNG
(CHEMBL4089149)
Show SMILES [H][C@@]12CCCN1C(=O)[C@@]1([H])CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC2=O |r|
Show InChI InChI=1S/C55H67N11O8/c1-35-47(67)64-44(34-39-23-12-5-13-24-39)53(73)66-30-16-27-46(66)54(74)65-29-15-26-45(65)52(72)60-40(25-14-28-58-55(56)57)48(68)61-42(32-37-19-8-3-9-20-37)50(70)63-43(33-38-21-10-4-11-22-38)51(71)62-41(49(69)59-35)31-36-17-6-2-7-18-36/h2-13,17-24,35,40-46H,14-16,25-34H2,1H3,(H,59,69)(H,60,72)(H,61,68)(H,62,71)(H,63,70)(H,64,67)(H4,56,57,58)/t35-,40-,41-,42-,43-,44-,45-,46+/m0/s1
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n/an/an/an/a>1.00E+5n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse melanocortin receptor 4 expressed in HEK293 cells assessed as increase in cAMP accumulation after 2 hrs by AlphaScreen assa...


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Mus musculus)
BDBM50258947
PNG
(CHEMBL4078828)
Show SMILES [H][C@@]12CCCN1C(=O)[C@@]1([H])CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC2=O |r|
Show InChI InChI=1S/C52H66N12O11/c53-42(65)30-38-48(72)57-35(22-23-43(66)67)45(69)62-39(29-33-17-8-3-9-18-33)50(74)64-26-12-21-41(64)51(75)63-25-11-20-40(63)49(73)58-34(19-10-24-56-52(54)55)44(68)59-36(27-31-13-4-1-5-14-31)46(70)60-37(47(71)61-38)28-32-15-6-2-7-16-32/h1-9,13-18,34-41H,10-12,19-30H2,(H2,53,65)(H,57,72)(H,58,73)(H,59,68)(H,60,70)(H,61,71)(H,62,69)(H,66,67)(H4,54,55,56)/t34-,35-,36-,37-,38-,39-,40-,41+/m0/s1
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n/an/an/an/a>1.00E+5n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse melanocortin receptor 4 expressed in HEK293 cells assessed as increase in cAMP accumulation after 2 hrs by AlphaScreen assa...


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Mus musculus)
BDBM50258948
PNG
(CHEMBL4093505)
Show SMILES [H][C@@]12CCCN1C(=O)[C@@]1([H])CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC2=O |r|
Show InChI InChI=1S/C53H71N13O9/c54-25-11-10-21-36-46(69)64-41(31-35-19-8-3-9-20-35)51(74)66-28-14-24-43(66)52(75)65-27-13-23-42(65)50(73)60-37(22-12-26-58-53(56)57)45(68)61-38(29-33-15-4-1-5-16-33)47(70)62-39(30-34-17-6-2-7-18-34)48(71)63-40(32-44(55)67)49(72)59-36/h1-9,15-20,36-43H,10-14,21-32,54H2,(H2,55,67)(H,59,72)(H,60,73)(H,61,68)(H,62,70)(H,63,71)(H,64,69)(H4,56,57,58)/t36-,37-,38-,39-,40-,41-,42-,43+/m0/s1
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n/an/an/an/a>1.00E+5n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse melanocortin receptor 4 expressed in HEK293 cells assessed as increase in cAMP accumulation after 2 hrs by AlphaScreen assa...


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Mus musculus)
BDBM50258949
PNG
(CHEMBL4072797)
Show SMILES [H][C@@]12CCCN1C(=O)[C@@]1([H])CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC2=O |r|
Show InChI InChI=1S/C53H66N14O9/c54-44(68)29-40-49(73)63-39(28-35-30-57-31-59-35)48(72)65-41(27-34-17-8-3-9-18-34)51(75)67-24-12-21-43(67)52(76)66-23-11-20-42(66)50(74)60-36(19-10-22-58-53(55)56)45(69)61-37(25-32-13-4-1-5-14-32)46(70)62-38(47(71)64-40)26-33-15-6-2-7-16-33/h1-9,13-18,30-31,36-43H,10-12,19-29H2,(H2,54,68)(H,57,59)(H,60,74)(H,61,69)(H,62,70)(H,63,73)(H,64,71)(H,65,72)(H4,55,56,58)/t36-,37-,38-,39-,40-,41-,42-,43+/m0/s1
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n/an/an/an/a>1.00E+5n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse melanocortin receptor 4 expressed in HEK293 cells assessed as increase in cAMP accumulation after 2 hrs by AlphaScreen assa...


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Mus musculus)
BDBM50258951
PNG
(CHEMBL4066514)
Show SMILES [H][C@@]12CCCN1C(=O)[C@@]1([H])CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC2=O |r|
Show InChI InChI=1S/C49H62N12O9/c50-40(62)28-36-42(64)54-29-41(63)55-37(27-32-17-8-3-9-18-32)47(69)61-24-12-21-39(61)48(70)60-23-11-20-38(60)46(68)56-33(19-10-22-53-49(51)52)43(65)57-34(25-30-13-4-1-5-14-30)44(66)58-35(45(67)59-36)26-31-15-6-2-7-16-31/h1-9,13-18,33-39H,10-12,19-29H2,(H2,50,62)(H,54,64)(H,55,63)(H,56,68)(H,57,65)(H,58,66)(H,59,67)(H4,51,52,53)/t33-,34-,35-,36-,37-,38-,39+/m0/s1
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n/an/an/an/a>1.00E+5n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse melanocortin receptor 4 expressed in HEK293 cells assessed as increase in cAMP accumulation after 2 hrs by AlphaScreen assa...


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Mus musculus)
BDBM50258952
PNG
(CHEMBL4065443)
Show SMILES [H][C@@]12CCCN1C(=O)[C@@]1([H])CCCN1C(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC2=O |r|
Show InChI InChI=1S/C44H60N12O9/c1-25-36(58)50-26(2)42(64)56-21-11-18-34(56)43(65)55-20-10-17-33(55)41(63)51-29(16-9-19-48-44(46)47)37(59)52-30(22-27-12-5-3-6-13-27)39(61)53-31(23-28-14-7-4-8-15-28)40(62)54-32(24-35(45)57)38(60)49-25/h3-8,12-15,25-26,29-34H,9-11,16-24H2,1-2H3,(H2,45,57)(H,49,60)(H,50,58)(H,51,63)(H,52,59)(H,53,61)(H,54,62)(H4,46,47,48)/t25-,26-,29-,30-,31-,32-,33-,34+/m0/s1
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n/an/an/an/a>1.00E+5n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse melanocortin receptor 4 expressed in HEK293 cells assessed as increase in cAMP accumulation after 2 hrs by AlphaScreen assa...


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
Melanocortin receptor 5


(Mus musculus (Mouse))
BDBM50258953
PNG
(CHEMBL4086679)
Show SMILES [H][C@@]12CCCN1C(=O)[C@@]1([H])CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](CCCC)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC2=O |r|
Show InChI InChI=1S/C52H69N11O8/c1-3-4-23-37-45(65)56-33(2)44(64)61-41(32-36-21-12-7-13-22-36)50(70)63-29-16-26-43(63)51(71)62-28-15-25-42(62)49(69)58-38(24-14-27-55-52(53)54)46(66)59-40(31-35-19-10-6-11-20-35)48(68)60-39(47(67)57-37)30-34-17-8-5-9-18-34/h5-13,17-22,33,37-43H,3-4,14-16,23-32H2,1-2H3,(H,56,65)(H,57,67)(H,58,69)(H,59,66)(H,60,68)(H,61,64)(H4,53,54,55)/t33-,37-,38-,39-,40-,41-,42-,43+/m0/s1
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n/an/an/an/a>1.00E+5n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse melanocortin receptor 5 expressed in HEK293 cells assessed as increase in cAMP accumulation after 2 hrs by AlphaScreen assa...


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
Melanocortin receptor 5


(Mus musculus (Mouse))
BDBM50258946
PNG
(CHEMBL4089149)
Show SMILES [H][C@@]12CCCN1C(=O)[C@@]1([H])CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC2=O |r|
Show InChI InChI=1S/C55H67N11O8/c1-35-47(67)64-44(34-39-23-12-5-13-24-39)53(73)66-30-16-27-46(66)54(74)65-29-15-26-45(65)52(72)60-40(25-14-28-58-55(56)57)48(68)61-42(32-37-19-8-3-9-20-37)50(70)63-43(33-38-21-10-4-11-22-38)51(71)62-41(49(69)59-35)31-36-17-6-2-7-18-36/h2-13,17-24,35,40-46H,14-16,25-34H2,1H3,(H,59,69)(H,60,72)(H,61,68)(H,62,71)(H,63,70)(H,64,67)(H4,56,57,58)/t35-,40-,41-,42-,43-,44-,45-,46+/m0/s1
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n/an/an/an/a>1.00E+5n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse melanocortin receptor 5 expressed in HEK293 cells assessed as increase in cAMP accumulation after 2 hrs by AlphaScreen assa...


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
Melanocortin receptor 5


(Mus musculus (Mouse))
BDBM50258947
PNG
(CHEMBL4078828)
Show SMILES [H][C@@]12CCCN1C(=O)[C@@]1([H])CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC2=O |r|
Show InChI InChI=1S/C52H66N12O11/c53-42(65)30-38-48(72)57-35(22-23-43(66)67)45(69)62-39(29-33-17-8-3-9-18-33)50(74)64-26-12-21-41(64)51(75)63-25-11-20-40(63)49(73)58-34(19-10-24-56-52(54)55)44(68)59-36(27-31-13-4-1-5-14-31)46(70)60-37(47(71)61-38)28-32-15-6-2-7-16-32/h1-9,13-18,34-41H,10-12,19-30H2,(H2,53,65)(H,57,72)(H,58,73)(H,59,68)(H,60,70)(H,61,71)(H,62,69)(H,66,67)(H4,54,55,56)/t34-,35-,36-,37-,38-,39-,40-,41+/m0/s1
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n/an/an/an/a>1.00E+5n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse melanocortin receptor 5 expressed in HEK293 cells assessed as increase in cAMP accumulation after 2 hrs by AlphaScreen assa...


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
Melanocortin receptor 5


(Mus musculus (Mouse))
BDBM50258954
PNG
(CHEMBL4087835)
Show SMILES [H][C@@]12CCCN1C(=O)[C@@]1([H])CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC2=O |r|
Show InChI InChI=1S/C53H70N12O9/c1-32(2)27-37-46(68)63-41(30-35-19-10-5-11-20-35)51(73)65-26-14-23-43(65)52(74)64-25-13-22-42(64)50(72)58-36(21-12-24-57-53(55)56)45(67)60-38(28-33-15-6-3-7-16-33)47(69)61-39(29-34-17-8-4-9-18-34)48(70)62-40(31-44(54)66)49(71)59-37/h3-11,15-20,32,36-43H,12-14,21-31H2,1-2H3,(H2,54,66)(H,58,72)(H,59,71)(H,60,67)(H,61,69)(H,62,70)(H,63,68)(H4,55,56,57)/t36-,37-,38-,39-,40-,41-,42-,43+/m0/s1
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n/an/an/an/a>1.00E+5n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse melanocortin receptor 5 expressed in HEK293 cells assessed as increase in cAMP accumulation after 2 hrs by AlphaScreen assa...


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
Melanocortin receptor 5


(Mus musculus (Mouse))
BDBM50017181
PNG
(CHEMBL441738)
Show SMILES CCCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(C)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C(C)C)C(N)=O |r|
Show InChI InChI=1S/C78H111N21O19/c1-5-6-19-52(91-75(116)61(41-101)97-72(113)57(34-46-24-26-49(103)27-25-46)94-74(115)60(40-100)88-44(4)102)68(109)92-54(28-29-64(105)106)70(111)96-59(36-48-38-83-42-87-48)73(114)93-56(33-45-16-8-7-9-17-45)71(112)90-53(22-14-31-84-78(81)82)69(110)95-58(35-47-37-85-51-20-11-10-18-50(47)51)67(108)86-39-63(104)89-55(21-12-13-30-79)77(118)99-32-15-23-62(99)76(117)98-65(43(2)3)66(80)107/h7-11,16-18,20,24-27,37-38,42-43,52-62,65,85,100-101,103H,5-6,12-15,19,21-23,28-36,39-41,79H2,1-4H3,(H2,80,107)(H,83,87)(H,86,108)(H,88,102)(H,89,104)(H,90,112)(H,91,116)(H,92,109)(H,93,114)(H,94,115)(H,95,110)(H,96,111)(H,97,113)(H,98,117)(H,105,106)(H4,81,82,84)/t52-,53-,54-,55-,56+,57-,58-,59-,60-,61-,62-,65-/m0/s1
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n/an/an/an/a 0.180n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse melanocortin receptor 5 expressed in HEK293 cells assessed as increase in cAMP accumulation after 2 hrs by AlphaScreen assa...


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Mus musculus)
BDBM50258951
PNG
(CHEMBL4066514)
Show SMILES [H][C@@]12CCCN1C(=O)[C@@]1([H])CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC2=O |r|
Show InChI InChI=1S/C49H62N12O9/c50-40(62)28-36-42(64)54-29-41(63)55-37(27-32-17-8-3-9-18-32)47(69)61-24-12-21-39(61)48(70)60-23-11-20-38(60)46(68)56-33(19-10-22-53-49(51)52)43(65)57-34(25-30-13-4-1-5-14-30)44(66)58-35(45(67)59-36)26-31-15-6-2-7-16-31/h1-9,13-18,33-39H,10-12,19-29H2,(H2,50,62)(H,54,64)(H,55,63)(H,56,68)(H,57,65)(H,58,66)(H,59,67)(H4,51,52,53)/t33-,34-,35-,36-,37-,38-,39+/m0/s1
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n/an/an/an/a>1.00E+5n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse melanocortin receptor 3 expressed in HEK293 cells assessed as increase in cAMP accumulation after 2 hrs by AlphaScreen assa...


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Mus musculus)
BDBM50258955
PNG
(CHEMBL4075125)
Show SMILES [H][C@@]12CCCN1C(=O)[C@@]1([H])CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC2=O |r|
Show InChI InChI=1S/C50H64N12O10/c51-41(64)28-36-45(68)60-38(29-63)46(69)59-37(27-32-17-8-3-9-18-32)48(71)62-24-12-21-40(62)49(72)61-23-11-20-39(61)47(70)55-33(19-10-22-54-50(52)53)42(65)56-34(25-30-13-4-1-5-14-30)43(66)57-35(44(67)58-36)26-31-15-6-2-7-16-31/h1-9,13-18,33-40,63H,10-12,19-29H2,(H2,51,64)(H,55,70)(H,56,65)(H,57,66)(H,58,67)(H,59,69)(H,60,68)(H4,52,53,54)/t33-,34-,35-,36-,37-,38-,39-,40+/m0/s1
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n/an/an/an/a>1.00E+5n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse melanocortin receptor 3 expressed in HEK293 cells assessed as increase in cAMP accumulation after 2 hrs by AlphaScreen assa...


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Mus musculus)
BDBM50258947
PNG
(CHEMBL4078828)
Show SMILES [H][C@@]12CCCN1C(=O)[C@@]1([H])CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC2=O |r|
Show InChI InChI=1S/C52H66N12O11/c53-42(65)30-38-48(72)57-35(22-23-43(66)67)45(69)62-39(29-33-17-8-3-9-18-33)50(74)64-26-12-21-41(64)51(75)63-25-11-20-40(63)49(73)58-34(19-10-24-56-52(54)55)44(68)59-36(27-31-13-4-1-5-14-31)46(70)60-37(47(71)61-38)28-32-15-6-2-7-16-32/h1-9,13-18,34-41H,10-12,19-30H2,(H2,53,65)(H,57,72)(H,58,73)(H,59,68)(H,60,70)(H,61,71)(H,62,69)(H,66,67)(H4,54,55,56)/t34-,35-,36-,37-,38-,39-,40-,41+/m0/s1
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n/an/an/an/a>1.00E+5n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse melanocortin receptor 3 expressed in HEK293 cells assessed as increase in cAMP accumulation after 2 hrs by AlphaScreen assa...


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Mus musculus)
BDBM50258956
PNG
(CHEMBL4096856)
Show SMILES [H][C@@]12CCCN1C(=O)[C@@]1([H])CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC2=O |r|
Show InChI InChI=1S/C51H64N12O11/c52-41(64)28-36-46(70)60-37(29-42(65)66)47(71)61-38(27-32-17-8-3-9-18-32)49(73)63-24-12-21-40(63)50(74)62-23-11-20-39(62)48(72)56-33(19-10-22-55-51(53)54)43(67)57-34(25-30-13-4-1-5-14-30)44(68)58-35(45(69)59-36)26-31-15-6-2-7-16-31/h1-9,13-18,33-40H,10-12,19-29H2,(H2,52,64)(H,56,72)(H,57,67)(H,58,68)(H,59,69)(H,60,70)(H,61,71)(H,65,66)(H4,53,54,55)/t33-,34-,35-,36-,37-,38-,39-,40+/m0/s1
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n/an/an/an/a>1.00E+5n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse melanocortin receptor 3 expressed in HEK293 cells assessed as increase in cAMP accumulation after 2 hrs by AlphaScreen assa...


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Mus musculus)
BDBM50258946
PNG
(CHEMBL4089149)
Show SMILES [H][C@@]12CCCN1C(=O)[C@@]1([H])CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC2=O |r|
Show InChI InChI=1S/C55H67N11O8/c1-35-47(67)64-44(34-39-23-12-5-13-24-39)53(73)66-30-16-27-46(66)54(74)65-29-15-26-45(65)52(72)60-40(25-14-28-58-55(56)57)48(68)61-42(32-37-19-8-3-9-20-37)50(70)63-43(33-38-21-10-4-11-22-38)51(71)62-41(49(69)59-35)31-36-17-6-2-7-18-36/h2-13,17-24,35,40-46H,14-16,25-34H2,1H3,(H,59,69)(H,60,72)(H,61,68)(H,62,71)(H,63,70)(H,64,67)(H4,56,57,58)/t35-,40-,41-,42-,43-,44-,45-,46+/m0/s1
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n/an/an/an/a>1.00E+5n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse melanocortin receptor 3 expressed in HEK293 cells assessed as increase in cAMP accumulation after 2 hrs by AlphaScreen assa...


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Mus musculus)
BDBM50258957
PNG
(CHEMBL4066929)
Show SMILES [H][C@@]12CCCN1C(=O)[C@@]1([H])CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC2=O |r|
Show InChI InChI=1S/C52H69N11O8/c1-32(2)28-38-46(66)56-33(3)44(64)61-41(31-36-20-11-6-12-21-36)50(70)63-27-15-24-43(63)51(71)62-26-14-23-42(62)49(69)57-37(22-13-25-55-52(53)54)45(65)59-39(29-34-16-7-4-8-17-34)48(68)60-40(47(67)58-38)30-35-18-9-5-10-19-35/h4-12,16-21,32-33,37-43H,13-15,22-31H2,1-3H3,(H,56,66)(H,57,69)(H,58,67)(H,59,65)(H,60,68)(H,61,64)(H4,53,54,55)/t33-,37-,38-,39-,40-,41-,42-,43+/m0/s1
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n/an/an/an/a>1.00E+5n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse melanocortin receptor 3 expressed in HEK293 cells assessed as increase in cAMP accumulation after 2 hrs by AlphaScreen assa...


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Mus musculus)
BDBM50258953
PNG
(CHEMBL4086679)
Show SMILES [H][C@@]12CCCN1C(=O)[C@@]1([H])CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](CCCC)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC2=O |r|
Show InChI InChI=1S/C52H69N11O8/c1-3-4-23-37-45(65)56-33(2)44(64)61-41(32-36-21-12-7-13-22-36)50(70)63-29-16-26-43(63)51(71)62-28-15-25-42(62)49(69)58-38(24-14-27-55-52(53)54)46(66)59-40(31-35-19-10-6-11-20-35)48(68)60-39(47(67)57-37)30-34-17-8-5-9-18-34/h5-13,17-22,33,37-43H,3-4,14-16,23-32H2,1-2H3,(H,56,65)(H,57,67)(H,58,69)(H,59,66)(H,60,68)(H,61,64)(H4,53,54,55)/t33-,37-,38-,39-,40-,41-,42-,43+/m0/s1
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n/an/an/an/a>1.00E+5n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse melanocortin receptor 3 expressed in HEK293 cells assessed as increase in cAMP accumulation after 2 hrs by AlphaScreen assa...


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Mus musculus)
BDBM50258958
PNG
(CHEMBL4104582)
Show SMILES [H][C@@]12CCCN1C(=O)[C@@]1([H])CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC2=O |r|
Show InChI InChI=1S/C52H65N13O8/c1-32-44(66)63-41(28-35-18-9-4-10-19-35)50(72)65-25-13-22-43(65)51(73)64-24-12-21-42(64)49(71)59-37(20-11-23-56-52(53)54)45(67)60-38(26-33-14-5-2-6-15-33)47(69)61-39(27-34-16-7-3-8-17-34)48(70)62-40(46(68)58-32)29-36-30-55-31-57-36/h2-10,14-19,30-32,37-43H,11-13,20-29H2,1H3,(H,55,57)(H,58,68)(H,59,71)(H,60,67)(H,61,69)(H,62,70)(H,63,66)(H4,53,54,56)/t32-,37-,38-,39-,40-,41-,42-,43+/m0/s1
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n/an/an/an/a>1.00E+5n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse melanocortin receptor 3 expressed in HEK293 cells assessed as increase in cAMP accumulation after 2 hrs by AlphaScreen assa...


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Mus musculus)
BDBM50258959
PNG
(CHEMBL4098651)
Show SMILES [H][C@@]12CCCN1C(=O)[C@@]1([H])CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC2=O
Show InChI InChI=1S/C51H65N11O10/c1-31-43(65)60-39(30-34-18-9-4-10-19-34)49(71)62-27-13-22-41(62)50(72)61-26-12-21-40(61)48(70)57-35(20-11-25-54-51(52)53)45(67)58-38(29-33-16-7-3-8-17-33)47(69)59-37(28-32-14-5-2-6-15-32)46(68)56-36(44(66)55-31)23-24-42(63)64/h2-10,14-19,31,35-41H,11-13,20-30H2,1H3,(H,55,66)(H,56,68)(H,57,70)(H,58,67)(H,59,69)(H,60,65)(H,63,64)(H4,52,53,54)/t31-,35-,36-,37-,38-,39-,40-,41+/m0/s1
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n/an/an/an/a>1.00E+5n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse melanocortin receptor 3 expressed in HEK293 cells assessed as increase in cAMP accumulation after 2 hrs by AlphaScreen assa...


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Mus musculus)
BDBM50258960
PNG
(CHEMBL4093379)
Show SMILES [H][C@@]12CCCN1C(=O)[C@@]1([H])CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC2=O |r|
Show InChI InChI=1S/C50H63N11O10/c1-30-42(64)59-38(28-33-18-9-4-10-19-33)48(70)61-25-13-22-40(61)49(71)60-24-12-21-39(60)47(69)55-34(20-11-23-53-50(51)52)43(65)56-35(26-31-14-5-2-6-15-31)45(67)57-36(27-32-16-7-3-8-17-32)46(68)58-37(29-41(62)63)44(66)54-30/h2-10,14-19,30,34-40H,11-13,20-29H2,1H3,(H,54,66)(H,55,69)(H,56,65)(H,57,67)(H,58,68)(H,59,64)(H,62,63)(H4,51,52,53)/t30-,34-,35-,36-,37-,38-,39-,40+/m0/s1
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n/an/an/an/a>1.00E+5n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse melanocortin receptor 3 expressed in HEK293 cells assessed as increase in cAMP accumulation after 2 hrs by AlphaScreen assa...


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Mus musculus)
BDBM50258961
PNG
(CHEMBL4101128)
Show SMILES [H][C@@]12CCCN1C(=O)[C@@]1([H])CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC2=O |r|
Show InChI InChI=1S/C49H63N11O9/c1-30-41(62)57-37(28-33-18-9-4-10-19-33)47(68)60-25-13-22-40(60)48(69)59-24-12-21-39(59)46(67)54-34(20-11-23-52-49(50)51)42(63)55-35(26-31-14-5-2-6-15-31)43(64)56-36(27-32-16-7-3-8-17-32)44(65)58-38(29-61)45(66)53-30/h2-10,14-19,30,34-40,61H,11-13,20-29H2,1H3,(H,53,66)(H,54,67)(H,55,63)(H,56,64)(H,57,62)(H,58,65)(H4,50,51,52)/t30-,34-,35-,36-,37-,38-,39-,40+/m0/s1
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n/an/an/an/a>1.00E+5n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse melanocortin receptor 3 expressed in HEK293 cells assessed as increase in cAMP accumulation after 2 hrs by AlphaScreen assa...


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Mus musculus)
BDBM50258962
PNG
(CHEMBL4083137)
Show SMILES [H][C@@]12CCCN1C(=O)[C@@]1([H])CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)C(CC)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC2=O |r|
Show InChI InChI=1S/C50H65N11O8/c1-3-35-43(63)54-31(2)42(62)59-39(30-34-20-11-6-12-21-34)48(68)61-27-15-24-41(61)49(69)60-26-14-23-40(60)47(67)56-36(22-13-25-53-50(51)52)44(64)57-38(29-33-18-9-5-10-19-33)46(66)58-37(45(65)55-35)28-32-16-7-4-8-17-32/h4-12,16-21,31,35-41H,3,13-15,22-30H2,1-2H3,(H,54,63)(H,55,65)(H,56,67)(H,57,64)(H,58,66)(H,59,62)(H4,51,52,53)/t31-,35?,36-,37-,38-,39-,40-,41+/m0/s1
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n/an/an/an/a>1.00E+5n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse melanocortin receptor 3 expressed in HEK293 cells assessed as increase in cAMP accumulation after 2 hrs by AlphaScreen assa...


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Mus musculus)
BDBM50258944
PNG
(CHEMBL4077783)
Show SMILES [H][C@@]12CCCN1C(=O)[C@@]1([H])CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC2=O |r|
Show InChI InChI=1S/C49H63N11O8/c1-30-41(61)53-31(2)42(62)58-38(29-34-19-10-5-11-20-34)47(67)60-26-14-23-40(60)48(68)59-25-13-22-39(59)46(66)55-35(21-12-24-52-49(50)51)43(63)56-37(28-33-17-8-4-9-18-33)45(65)57-36(44(64)54-30)27-32-15-6-3-7-16-32/h3-11,15-20,30-31,35-40H,12-14,21-29H2,1-2H3,(H,53,61)(H,54,64)(H,55,66)(H,56,63)(H,57,65)(H,58,62)(H4,50,51,52)/t30-,31-,35-,36-,37-,38-,39-,40+/m0/s1
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n/an/an/an/a>1.00E+5n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse melanocortin receptor 3 expressed in HEK293 cells assessed as increase in cAMP accumulation after 2 hrs by AlphaScreen assa...


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Mus musculus)
BDBM50089398
PNG
(CHEMBL3577981)
Show SMILES [H][C@@]12CCCN1C(=O)[C@@]1([H])CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC2=O |r|
Show InChI InChI=1S/C50H64N12O9/c1-30-42(64)60-38(28-33-18-9-4-10-19-33)48(70)62-25-13-22-40(62)49(71)61-24-12-21-39(61)47(69)56-34(20-11-23-54-50(52)53)43(65)57-35(26-31-14-5-2-6-15-31)45(67)58-36(27-32-16-7-3-8-17-32)46(68)59-37(29-41(51)63)44(66)55-30/h2-10,14-19,30,34-40H,11-13,20-29H2,1H3,(H2,51,63)(H,55,66)(H,56,69)(H,57,65)(H,58,67)(H,59,68)(H,60,64)(H4,52,53,54)/t30-,34-,35-,36-,37-,38-,39-,40+/m0/s1
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n/an/an/an/a>1.00E+5n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse melanocortin receptor 3 expressed in HEK293 cells assessed as increase in cAMP accumulation after 2 hrs by AlphaScreen assa...


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
Melanocyte-stimulating hormone receptor


(Mus musculus)
BDBM50017181
PNG
(CHEMBL441738)
Show SMILES CCCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(C)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C(C)C)C(N)=O |r|
Show InChI InChI=1S/C78H111N21O19/c1-5-6-19-52(91-75(116)61(41-101)97-72(113)57(34-46-24-26-49(103)27-25-46)94-74(115)60(40-100)88-44(4)102)68(109)92-54(28-29-64(105)106)70(111)96-59(36-48-38-83-42-87-48)73(114)93-56(33-45-16-8-7-9-17-45)71(112)90-53(22-14-31-84-78(81)82)69(110)95-58(35-47-37-85-51-20-11-10-18-50(47)51)67(108)86-39-63(104)89-55(21-12-13-30-79)77(118)99-32-15-23-62(99)76(117)98-65(43(2)3)66(80)107/h7-11,16-18,20,24-27,37-38,42-43,52-62,65,85,100-101,103H,5-6,12-15,19,21-23,28-36,39-41,79H2,1-4H3,(H2,80,107)(H,83,87)(H,86,108)(H,88,102)(H,89,104)(H,90,112)(H,91,116)(H,92,109)(H,93,114)(H,94,115)(H,95,110)(H,96,111)(H,97,113)(H,98,117)(H,105,106)(H4,81,82,84)/t52-,53-,54-,55-,56+,57-,58-,59-,60-,61-,62-,65-/m0/s1
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n/an/an/an/a 0.0210n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse melanocortin receptor 1 expressed in HEK293 cells assessed as increase in cAMP accumulation after 2 hrs by AlphaScreen assa...


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
Melanocyte-stimulating hormone receptor


(Mus musculus)
BDBM50258951
PNG
(CHEMBL4066514)
Show SMILES [H][C@@]12CCCN1C(=O)[C@@]1([H])CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC2=O |r|
Show InChI InChI=1S/C49H62N12O9/c50-40(62)28-36-42(64)54-29-41(63)55-37(27-32-17-8-3-9-18-32)47(69)61-24-12-21-39(61)48(70)60-23-11-20-38(60)46(68)56-33(19-10-22-53-49(51)52)43(65)57-34(25-30-13-4-1-5-14-30)44(66)58-35(45(67)59-36)26-31-15-6-2-7-16-31/h1-9,13-18,33-39H,10-12,19-29H2,(H2,50,62)(H,54,64)(H,55,63)(H,56,68)(H,57,65)(H,58,66)(H,59,67)(H4,51,52,53)/t33-,34-,35-,36-,37-,38-,39+/m0/s1
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n/an/an/an/a>1.00E+5n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse melanocortin receptor 1 expressed in HEK293 cells assessed as increase in cAMP accumulation after 2 hrs by AlphaScreen assa...


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
Melanocyte-stimulating hormone receptor


(Mus musculus)
BDBM50258955
PNG
(CHEMBL4075125)
Show SMILES [H][C@@]12CCCN1C(=O)[C@@]1([H])CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC2=O |r|
Show InChI InChI=1S/C50H64N12O10/c51-41(64)28-36-45(68)60-38(29-63)46(69)59-37(27-32-17-8-3-9-18-32)48(71)62-24-12-21-40(62)49(72)61-23-11-20-39(61)47(70)55-33(19-10-22-54-50(52)53)42(65)56-34(25-30-13-4-1-5-14-30)43(66)57-35(44(67)58-36)26-31-15-6-2-7-16-31/h1-9,13-18,33-40,63H,10-12,19-29H2,(H2,51,64)(H,55,70)(H,56,65)(H,57,66)(H,58,67)(H,59,69)(H,60,68)(H4,52,53,54)/t33-,34-,35-,36-,37-,38-,39-,40+/m0/s1
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n/an/an/an/a>1.00E+5n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse melanocortin receptor 1 expressed in HEK293 cells assessed as increase in cAMP accumulation after 2 hrs by AlphaScreen assa...


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
Melanocyte-stimulating hormone receptor


(Mus musculus)
BDBM50258949
PNG
(CHEMBL4072797)
Show SMILES [H][C@@]12CCCN1C(=O)[C@@]1([H])CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC2=O |r|
Show InChI InChI=1S/C53H66N14O9/c54-44(68)29-40-49(73)63-39(28-35-30-57-31-59-35)48(72)65-41(27-34-17-8-3-9-18-34)51(75)67-24-12-21-43(67)52(76)66-23-11-20-42(66)50(74)60-36(19-10-22-58-53(55)56)45(69)61-37(25-32-13-4-1-5-14-32)46(70)62-38(47(71)64-40)26-33-15-6-2-7-16-33/h1-9,13-18,30-31,36-43H,10-12,19-29H2,(H2,54,68)(H,57,59)(H,60,74)(H,61,69)(H,62,70)(H,63,73)(H,64,71)(H,65,72)(H4,55,56,58)/t36-,37-,38-,39-,40-,41-,42-,43+/m0/s1
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n/an/an/an/a 2.60E+3n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse melanocortin receptor 1 expressed in HEK293 cells assessed as increase in cAMP accumulation after 2 hrs by AlphaScreen assa...


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
Melanocyte-stimulating hormone receptor


(Mus musculus)
BDBM50258957
PNG
(CHEMBL4066929)
Show SMILES [H][C@@]12CCCN1C(=O)[C@@]1([H])CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC2=O |r|
Show InChI InChI=1S/C52H69N11O8/c1-32(2)28-38-46(66)56-33(3)44(64)61-41(31-36-20-11-6-12-21-36)50(70)63-27-15-24-43(63)51(71)62-26-14-23-42(62)49(69)57-37(22-13-25-55-52(53)54)45(65)59-39(29-34-16-7-4-8-17-34)48(68)60-40(47(67)58-38)30-35-18-9-5-10-19-35/h4-12,16-21,32-33,37-43H,13-15,22-31H2,1-3H3,(H,56,66)(H,57,69)(H,58,67)(H,59,65)(H,60,68)(H,61,64)(H4,53,54,55)/t33-,37-,38-,39-,40-,41-,42-,43+/m0/s1
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n/an/an/an/a>1.00E+5n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse melanocortin receptor 1 expressed in HEK293 cells assessed as increase in cAMP accumulation after 2 hrs by AlphaScreen assa...


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
Melanocyte-stimulating hormone receptor


(Mus musculus)
BDBM50258953
PNG
(CHEMBL4086679)
Show SMILES [H][C@@]12CCCN1C(=O)[C@@]1([H])CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](CCCC)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC2=O |r|
Show InChI InChI=1S/C52H69N11O8/c1-3-4-23-37-45(65)56-33(2)44(64)61-41(32-36-21-12-7-13-22-36)50(70)63-29-16-26-43(63)51(71)62-28-15-25-42(62)49(69)58-38(24-14-27-55-52(53)54)46(66)59-40(31-35-19-10-6-11-20-35)48(68)60-39(47(67)57-37)30-34-17-8-5-9-18-34/h5-13,17-22,33,37-43H,3-4,14-16,23-32H2,1-2H3,(H,56,65)(H,57,67)(H,58,69)(H,59,66)(H,60,68)(H,61,64)(H4,53,54,55)/t33-,37-,38-,39-,40-,41-,42-,43+/m0/s1
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n/an/an/an/a>1.00E+5n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse melanocortin receptor 1 expressed in HEK293 cells assessed as increase in cAMP accumulation after 2 hrs by AlphaScreen assa...


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
Melanocyte-stimulating hormone receptor


(Mus musculus)
BDBM50258963
PNG
(CHEMBL4071633)
Show SMILES [H][C@@]12CCCN1C(=O)[C@@]1([H])CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@@H](CN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC2=O |r|
Show InChI InChI=1S/C49H64N12O8/c1-30-41(62)58-37(28-33-18-9-4-10-19-33)47(68)61-25-13-22-40(61)48(69)60-24-12-21-39(60)46(67)55-34(20-11-23-53-49(51)52)42(63)56-35(26-31-14-5-2-6-15-31)43(64)57-36(27-32-16-7-3-8-17-32)44(65)59-38(29-50)45(66)54-30/h2-10,14-19,30,34-40H,11-13,20-29,50H2,1H3,(H,54,66)(H,55,67)(H,56,63)(H,57,64)(H,58,62)(H,59,65)(H4,51,52,53)/t30-,34-,35-,36-,37-,38+,39-,40+/m0/s1
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n/an/an/an/a>1.00E+5n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse melanocortin receptor 1 expressed in HEK293 cells assessed as increase in cAMP accumulation after 2 hrs by AlphaScreen assa...


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
Melanocyte-stimulating hormone receptor


(Mus musculus)
BDBM50258959
PNG
(CHEMBL4098651)
Show SMILES [H][C@@]12CCCN1C(=O)[C@@]1([H])CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC2=O
Show InChI InChI=1S/C51H65N11O10/c1-31-43(65)60-39(30-34-18-9-4-10-19-34)49(71)62-27-13-22-41(62)50(72)61-26-12-21-40(61)48(70)57-35(20-11-25-54-51(52)53)45(67)58-38(29-33-16-7-3-8-17-33)47(69)59-37(28-32-14-5-2-6-15-32)46(68)56-36(44(66)55-31)23-24-42(63)64/h2-10,14-19,31,35-41H,11-13,20-30H2,1H3,(H,55,66)(H,56,68)(H,57,70)(H,58,67)(H,59,69)(H,60,65)(H,63,64)(H4,52,53,54)/t31-,35-,36-,37-,38-,39-,40-,41+/m0/s1
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n/an/an/an/a 2.05E+4n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse melanocortin receptor 1 expressed in HEK293 cells assessed as increase in cAMP accumulation after 2 hrs by AlphaScreen assa...


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
Melanocyte-stimulating hormone receptor


(Mus musculus)
BDBM50258960
PNG
(CHEMBL4093379)
Show SMILES [H][C@@]12CCCN1C(=O)[C@@]1([H])CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC2=O |r|
Show InChI InChI=1S/C50H63N11O10/c1-30-42(64)59-38(28-33-18-9-4-10-19-33)48(70)61-25-13-22-40(61)49(71)60-24-12-21-39(60)47(69)55-34(20-11-23-53-50(51)52)43(65)56-35(26-31-14-5-2-6-15-31)45(67)57-36(27-32-16-7-3-8-17-32)46(68)58-37(29-41(62)63)44(66)54-30/h2-10,14-19,30,34-40H,11-13,20-29H2,1H3,(H,54,66)(H,55,69)(H,56,65)(H,57,67)(H,58,68)(H,59,64)(H,62,63)(H4,51,52,53)/t30-,34-,35-,36-,37-,38-,39-,40+/m0/s1
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n/an/an/an/a>1.00E+5n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse melanocortin receptor 1 expressed in HEK293 cells assessed as increase in cAMP accumulation after 2 hrs by AlphaScreen assa...


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
Melanocyte-stimulating hormone receptor


(Mus musculus)
BDBM50258961
PNG
(CHEMBL4101128)
Show SMILES [H][C@@]12CCCN1C(=O)[C@@]1([H])CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC2=O |r|
Show InChI InChI=1S/C49H63N11O9/c1-30-41(62)57-37(28-33-18-9-4-10-19-33)47(68)60-25-13-22-40(60)48(69)59-24-12-21-39(59)46(67)54-34(20-11-23-52-49(50)51)42(63)55-35(26-31-14-5-2-6-15-31)43(64)56-36(27-32-16-7-3-8-17-32)44(65)58-38(29-61)45(66)53-30/h2-10,14-19,30,34-40,61H,11-13,20-29H2,1H3,(H,53,66)(H,54,67)(H,55,63)(H,56,64)(H,57,62)(H,58,65)(H4,50,51,52)/t30-,34-,35-,36-,37-,38-,39-,40+/m0/s1
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n/an/an/an/a>1.00E+5n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse melanocortin receptor 1 expressed in HEK293 cells assessed as increase in cAMP accumulation after 2 hrs by AlphaScreen assa...


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
Melanocyte-stimulating hormone receptor


(Mus musculus)
BDBM50258962
PNG
(CHEMBL4083137)
Show SMILES [H][C@@]12CCCN1C(=O)[C@@]1([H])CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)C(CC)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC2=O |r|
Show InChI InChI=1S/C50H65N11O8/c1-3-35-43(63)54-31(2)42(62)59-39(30-34-20-11-6-12-21-34)48(68)61-27-15-24-41(61)49(69)60-26-14-23-40(60)47(67)56-36(22-13-25-53-50(51)52)44(64)57-38(29-33-18-9-5-10-19-33)46(66)58-37(45(65)55-35)28-32-16-7-4-8-17-32/h4-12,16-21,31,35-41H,3,13-15,22-30H2,1-2H3,(H,54,63)(H,55,65)(H,56,67)(H,57,64)(H,58,66)(H,59,62)(H4,51,52,53)/t31-,35?,36-,37-,38-,39-,40-,41+/m0/s1
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n/an/an/an/a>1.00E+5n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Inhibitory concentration towards acetylcholinesterase in electric eel


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
Melanocyte-stimulating hormone receptor


(Mus musculus)
BDBM50258944
PNG
(CHEMBL4077783)
Show SMILES [H][C@@]12CCCN1C(=O)[C@@]1([H])CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC2=O |r|
Show InChI InChI=1S/C49H63N11O8/c1-30-41(61)53-31(2)42(62)58-38(29-34-19-10-5-11-20-34)47(67)60-26-14-23-40(60)48(68)59-25-13-22-39(59)46(66)55-35(21-12-24-52-49(50)51)43(63)56-37(28-33-17-8-4-9-18-33)45(65)57-36(44(64)54-30)27-32-15-6-3-7-16-32/h3-11,15-20,30-31,35-40H,12-14,21-29H2,1-2H3,(H,53,61)(H,54,64)(H,55,66)(H,56,63)(H,57,65)(H,58,62)(H4,50,51,52)/t30-,31-,35-,36-,37-,38-,39-,40+/m0/s1
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n/an/an/an/a>1.00E+5n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse melanocortin receptor 1 expressed in HEK293 cells assessed as increase in cAMP accumulation after 2 hrs by AlphaScreen assa...


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Mus musculus)
BDBM50258957
PNG
(CHEMBL4066929)
Show SMILES [H][C@@]12CCCN1C(=O)[C@@]1([H])CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC2=O |r|
Show InChI InChI=1S/C52H69N11O8/c1-32(2)28-38-46(66)56-33(3)44(64)61-41(31-36-20-11-6-12-21-36)50(70)63-27-15-24-43(63)51(71)62-26-14-23-42(62)49(69)57-37(22-13-25-55-52(53)54)45(65)59-39(29-34-16-7-4-8-17-34)48(68)60-40(47(67)58-38)30-35-18-9-5-10-19-35/h4-12,16-21,32-33,37-43H,13-15,22-31H2,1-3H3,(H,56,66)(H,57,69)(H,58,67)(H,59,65)(H,60,68)(H,61,64)(H4,53,54,55)/t33-,37-,38-,39-,40-,41-,42-,43+/m0/s1
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n/an/an/an/a>1.00E+5n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse melanocortin receptor 4 expressed in HEK293 cells assessed as increase in cAMP accumulation after 2 hrs by AlphaScreen assa...


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Mus musculus)
BDBM50258953
PNG
(CHEMBL4086679)
Show SMILES [H][C@@]12CCCN1C(=O)[C@@]1([H])CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](CCCC)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC2=O |r|
Show InChI InChI=1S/C52H69N11O8/c1-3-4-23-37-45(65)56-33(2)44(64)61-41(32-36-21-12-7-13-22-36)50(70)63-29-16-26-43(63)51(71)62-28-15-25-42(62)49(69)58-38(24-14-27-55-52(53)54)46(66)59-40(31-35-19-10-6-11-20-35)48(68)60-39(47(67)57-37)30-34-17-8-5-9-18-34/h5-13,17-22,33,37-43H,3-4,14-16,23-32H2,1-2H3,(H,56,65)(H,57,67)(H,58,69)(H,59,66)(H,60,68)(H,61,64)(H4,53,54,55)/t33-,37-,38-,39-,40-,41-,42-,43+/m0/s1
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n/an/an/an/a>1.00E+5n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Inhibitory concentration towards acetylcholinesterase in electric eel


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Mus musculus)
BDBM50258963
PNG
(CHEMBL4071633)
Show SMILES [H][C@@]12CCCN1C(=O)[C@@]1([H])CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@@H](CN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC2=O |r|
Show InChI InChI=1S/C49H64N12O8/c1-30-41(62)58-37(28-33-18-9-4-10-19-33)47(68)61-25-13-22-40(61)48(69)60-24-12-21-39(60)46(67)55-34(20-11-23-53-49(51)52)42(63)56-35(26-31-14-5-2-6-15-31)43(64)57-36(27-32-16-7-3-8-17-32)44(65)59-38(29-50)45(66)54-30/h2-10,14-19,30,34-40H,11-13,20-29,50H2,1H3,(H,54,66)(H,55,67)(H,56,63)(H,57,64)(H,58,62)(H,59,65)(H4,51,52,53)/t30-,34-,35-,36-,37-,38+,39-,40+/m0/s1
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n/an/an/an/a>1.00E+5n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse melanocortin receptor 4 expressed in HEK293 cells assessed as increase in cAMP accumulation after 2 hrs by AlphaScreen assa...


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Mus musculus)
BDBM50258959
PNG
(CHEMBL4098651)
Show SMILES [H][C@@]12CCCN1C(=O)[C@@]1([H])CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC2=O
Show InChI InChI=1S/C51H65N11O10/c1-31-43(65)60-39(30-34-18-9-4-10-19-34)49(71)62-27-13-22-41(62)50(72)61-26-12-21-40(61)48(70)57-35(20-11-25-54-51(52)53)45(67)58-38(29-33-16-7-3-8-17-33)47(69)59-37(28-32-14-5-2-6-15-32)46(68)56-36(44(66)55-31)23-24-42(63)64/h2-10,14-19,31,35-41H,11-13,20-30H2,1H3,(H,55,66)(H,56,68)(H,57,70)(H,58,67)(H,59,69)(H,60,65)(H,63,64)(H4,52,53,54)/t31-,35-,36-,37-,38-,39-,40-,41+/m0/s1
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n/an/an/an/a>1.00E+5n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse melanocortin receptor 4 expressed in HEK293 cells assessed as increase in cAMP accumulation after 2 hrs by AlphaScreen assa...


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Mus musculus)
BDBM50258960
PNG
(CHEMBL4093379)
Show SMILES [H][C@@]12CCCN1C(=O)[C@@]1([H])CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC2=O |r|
Show InChI InChI=1S/C50H63N11O10/c1-30-42(64)59-38(28-33-18-9-4-10-19-33)48(70)61-25-13-22-40(61)49(71)60-24-12-21-39(60)47(69)55-34(20-11-23-53-50(51)52)43(65)56-35(26-31-14-5-2-6-15-31)45(67)57-36(27-32-16-7-3-8-17-32)46(68)58-37(29-41(62)63)44(66)54-30/h2-10,14-19,30,34-40H,11-13,20-29H2,1H3,(H,54,66)(H,55,69)(H,56,65)(H,57,67)(H,58,68)(H,59,64)(H,62,63)(H4,51,52,53)/t30-,34-,35-,36-,37-,38-,39-,40+/m0/s1
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n/an/an/an/a>1.00E+5n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse melanocortin receptor 4 expressed in HEK293 cells assessed as increase in cAMP accumulation after 2 hrs by AlphaScreen assa...


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Mus musculus)
BDBM50258961
PNG
(CHEMBL4101128)
Show SMILES [H][C@@]12CCCN1C(=O)[C@@]1([H])CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC2=O |r|
Show InChI InChI=1S/C49H63N11O9/c1-30-41(62)57-37(28-33-18-9-4-10-19-33)47(68)60-25-13-22-40(60)48(69)59-24-12-21-39(59)46(67)54-34(20-11-23-52-49(50)51)42(63)55-35(26-31-14-5-2-6-15-31)43(64)56-36(27-32-16-7-3-8-17-32)44(65)58-38(29-61)45(66)53-30/h2-10,14-19,30,34-40,61H,11-13,20-29H2,1H3,(H,53,66)(H,54,67)(H,55,63)(H,56,64)(H,57,62)(H,58,65)(H4,50,51,52)/t30-,34-,35-,36-,37-,38-,39-,40+/m0/s1
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n/an/an/an/a>1.00E+5n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse melanocortin receptor 4 expressed in HEK293 cells assessed as increase in cAMP accumulation after 2 hrs by AlphaScreen assa...


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Mus musculus)
BDBM50258962
PNG
(CHEMBL4083137)
Show SMILES [H][C@@]12CCCN1C(=O)[C@@]1([H])CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)C(CC)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC2=O |r|
Show InChI InChI=1S/C50H65N11O8/c1-3-35-43(63)54-31(2)42(62)59-39(30-34-20-11-6-12-21-34)48(68)61-27-15-24-41(61)49(69)60-26-14-23-40(60)47(67)56-36(22-13-25-53-50(51)52)44(64)57-38(29-33-18-9-5-10-19-33)46(66)58-37(45(65)55-35)28-32-16-7-4-8-17-32/h4-12,16-21,31,35-41H,3,13-15,22-30H2,1-2H3,(H,54,63)(H,55,65)(H,56,67)(H,57,64)(H,58,66)(H,59,62)(H4,51,52,53)/t31-,35?,36-,37-,38-,39-,40-,41+/m0/s1
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n/an/an/an/a>1.00E+5n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse melanocortin receptor 4 expressed in HEK293 cells assessed as increase in cAMP accumulation after 2 hrs by AlphaScreen assa...


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Mus musculus)
BDBM50089398
PNG
(CHEMBL3577981)
Show SMILES [H][C@@]12CCCN1C(=O)[C@@]1([H])CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC2=O |r|
Show InChI InChI=1S/C50H64N12O9/c1-30-42(64)60-38(28-33-18-9-4-10-19-33)48(70)62-25-13-22-40(62)49(71)61-24-12-21-39(61)47(69)56-34(20-11-23-54-50(52)53)43(65)57-35(26-31-14-5-2-6-15-31)45(67)58-36(27-32-16-7-3-8-17-32)46(68)59-37(29-41(51)63)44(66)55-30/h2-10,14-19,30,34-40H,11-13,20-29H2,1H3,(H2,51,63)(H,55,66)(H,56,69)(H,57,65)(H,58,67)(H,59,68)(H,60,64)(H4,52,53,54)/t30-,34-,35-,36-,37-,38-,39-,40+/m0/s1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a>1.00E+5n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse melanocortin receptor 4 expressed in HEK293 cells assessed as increase in cAMP accumulation after 2 hrs by AlphaScreen assa...


J Med Chem 60: 8103-8114 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00856
BindingDB Entry DOI: 10.7270/Q2DN47H1
More data for this
Ligand-Target Pair
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