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PubMed code 28045525

Compile data set for download or QSAR
Found 54 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Melanocortin receptor 4


(Mus musculus)		BDBM50232409
PNG
(CHEMBL4104402)
Show SMILES C[C@@H]1NC(=O)[C@H](CN)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O |r|
Show InChI InChI=1S/C57H72N16O9/c1-33-48(74)70-44(26-35-15-6-3-7-16-35)55(81)73-24-12-21-47(73)56(82)72-23-11-20-46(72)54(80)69-43(28-37-31-61-32-64-37)52(78)67-41(25-34-13-4-2-5-14-34)50(76)66-40(19-10-22-62-57(59)60)49(75)68-42(51(77)71-45(29-58)53(79)65-33)27-36-30-63-39-18-9-8-17-38(36)39/h2-9,13-18,30-33,40-47,63H,10-12,19-29,58H2,1H3,(H,61,64)(H,65,79)(H,66,76)(H,67,78)(H,68,75)(H,69,80)(H,70,74)(H,71,77)(H4,59,60,62)/t33-,40-,41+,42-,43-,44-,45-,46-,47+/m0/s1
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n/an/an/an/a 23n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse MC4R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Mus musculus)		BDBM50232415
PNG
(CHEMBL4103508)
Show SMILES C[C@@H]1NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C1=O |r|
Show InChI InChI=1S/C43H56N12O8/c1-24-41(62)55-19-9-16-34(55)42(63)54-18-8-15-33(54)40(61)53-30(20-25-10-3-2-4-11-25)38(59)50-29(14-7-17-47-43(45)46)36(57)51-31(21-26-23-48-28-13-6-5-12-27(26)28)39(60)52-32(22-35(44)56)37(58)49-24/h2-6,10-13,23-24,29-34,48H,7-9,14-22H2,1H3,(H2,44,56)(H,49,58)(H,50,59)(H,51,57)(H,52,60)(H,53,61)(H4,45,46,47)/t24-,29-,30+,31-,32-,33-,34+/m0/s1
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n/an/an/an/a 420n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse MC4R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocortin receptor 5


(Mus musculus (Mouse))		BDBM50232407
PNG
(CHEMBL4096678)
Show SMILES C[C@@H]1NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C1=O |r|
Show InChI InChI=1S/C49H63N15O9/c1-27-47(72)64-19-9-16-39(64)48(73)63-18-8-15-38(63)46(71)62-36(22-30-25-53-26-56-30)45(70)59-34(20-28-10-3-2-4-11-28)43(68)58-33(14-7-17-54-49(51)52)41(66)60-35(21-29-24-55-32-13-6-5-12-31(29)32)44(69)61-37(23-40(50)65)42(67)57-27/h2-6,10-13,24-27,33-39,55H,7-9,14-23H2,1H3,(H2,50,65)(H,53,56)(H,57,67)(H,58,68)(H,59,70)(H,60,66)(H,61,69)(H,62,71)(H4,51,52,54)/t27-,33-,34+,35-,36-,37-,38-,39+/m0/s1
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n/an/an/an/a 2.10n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse MC5R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Mus musculus)		BDBM50232417
PNG
(CHEMBL4062633)
Show SMILES NC[C@@H]1NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C1=O |r|
Show InChI InChI=1S/C39H51N11O6/c40-21-30-37(55)50-18-8-15-32(50)38(56)49-17-7-14-31(49)36(54)47-28(19-23-9-2-1-3-10-23)34(52)45-27(13-6-16-43-39(41)42)33(51)46-29(35(53)48-30)20-24-22-44-26-12-5-4-11-25(24)26/h1-5,9-12,22,27-32,44H,6-8,13-21,40H2,(H,45,52)(H,46,51)(H,47,54)(H,48,53)(H4,41,42,43)/t27-,28+,29-,30-,31-,32+/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 MC3R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Mus musculus)		BDBM50232408
PNG
(CHEMBL4080169)
Show SMILES NC(=O)C[C@@H]1NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C1=O |r|
Show InChI InChI=1S/C46H58N14O8/c47-38(61)22-35-44(67)60-18-8-15-37(60)45(68)59-17-7-14-36(59)43(66)57-34(21-28-24-50-25-53-28)42(65)55-32(19-26-9-2-1-3-10-26)40(63)54-31(13-6-16-51-46(48)49)39(62)56-33(41(64)58-35)20-27-23-52-30-12-5-4-11-29(27)30/h1-5,9-12,23-25,31-37,52H,6-8,13-22H2,(H2,47,61)(H,50,53)(H,54,63)(H,55,65)(H,56,62)(H,57,66)(H,58,64)(H4,48,49,51)/t31-,32+,33-,34-,35-,36-,37+/m0/s1
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n/an/an/an/a 510n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse MC3R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Mus musculus)		BDBM50232406
PNG
(CHEMBL4071283)
Show SMILES C[C@@H]1NC(=O)[C@H](CN)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O |r|
Show InChI InChI=1S/C51H65N13O8/c1-30-43(65)61-39(26-32-15-6-3-7-16-32)49(71)64-24-12-21-42(64)50(72)63-23-11-20-41(63)48(70)60-37(25-31-13-4-2-5-14-31)45(67)58-36(19-10-22-55-51(53)54)44(66)59-38(46(68)62-40(28-52)47(69)57-30)27-33-29-56-35-18-9-8-17-34(33)35/h2-9,13-18,29-30,36-42,56H,10-12,19-28,52H2,1H3,(H,57,69)(H,58,67)(H,59,66)(H,60,70)(H,61,65)(H,62,68)(H4,53,54,55)/t30-,36-,37+,38-,39-,40-,41-,42+/m0/s1
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n/an/an/an/a 3.00E+3n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse MC3R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocortin receptor 5


(Mus musculus (Mouse))		BDBM50232406
PNG
(CHEMBL4071283)
Show SMILES C[C@@H]1NC(=O)[C@H](CN)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O |r|
Show InChI InChI=1S/C51H65N13O8/c1-30-43(65)61-39(26-32-15-6-3-7-16-32)49(71)64-24-12-21-42(64)50(72)63-23-11-20-41(63)48(70)60-37(25-31-13-4-2-5-14-31)45(67)58-36(19-10-22-55-51(53)54)44(66)59-38(46(68)62-40(28-52)47(69)57-30)27-33-29-56-35-18-9-8-17-34(33)35/h2-9,13-18,29-30,36-42,56H,10-12,19-28,52H2,1H3,(H,57,69)(H,58,67)(H,59,66)(H,60,70)(H,61,65)(H,62,68)(H4,53,54,55)/t30-,36-,37+,38-,39-,40-,41-,42+/m0/s1
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n/an/an/an/a 46n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse MC5R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocyte-stimulating hormone receptor


(Mus musculus)		BDBM50232408
PNG
(CHEMBL4080169)
Show SMILES NC(=O)C[C@@H]1NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C1=O |r|
Show InChI InChI=1S/C46H58N14O8/c47-38(61)22-35-44(67)60-18-8-15-37(60)45(68)59-17-7-14-36(59)43(66)57-34(21-28-24-50-25-53-28)42(65)55-32(19-26-9-2-1-3-10-26)40(63)54-31(13-6-16-51-46(48)49)39(62)56-33(41(64)58-35)20-27-23-52-30-12-5-4-11-29(27)30/h1-5,9-12,23-25,31-37,52H,6-8,13-22H2,(H2,47,61)(H,50,53)(H,54,63)(H,55,65)(H,56,62)(H,57,66)(H,58,64)(H4,48,49,51)/t31-,32+,33-,34-,35-,36-,37+/m0/s1
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n/an/an/an/a 50n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse MC1R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocyte-stimulating hormone receptor


(Mus musculus)		BDBM50232409
PNG
(CHEMBL4104402)
Show SMILES C[C@@H]1NC(=O)[C@H](CN)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O |r|
Show InChI InChI=1S/C57H72N16O9/c1-33-48(74)70-44(26-35-15-6-3-7-16-35)55(81)73-24-12-21-47(73)56(82)72-23-11-20-46(72)54(80)69-43(28-37-31-61-32-64-37)52(78)67-41(25-34-13-4-2-5-14-34)50(76)66-40(19-10-22-62-57(59)60)49(75)68-42(51(77)71-45(29-58)53(79)65-33)27-36-30-63-39-18-9-8-17-38(36)39/h2-9,13-18,30-33,40-47,63H,10-12,19-29,58H2,1H3,(H,61,64)(H,65,79)(H,66,76)(H,67,78)(H,68,75)(H,69,80)(H,70,74)(H,71,77)(H4,59,60,62)/t33-,40-,41+,42-,43-,44-,45-,46-,47+/m0/s1
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n/an/an/an/a 24n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse MC1R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(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 0.0900n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse MC3R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Mus musculus)		BDBM50232414
PNG
(CHEMBL4069451)
Show SMILES C[C@@H]1NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O |r|
Show InChI InChI=1S/C58H72N16O10/c1-33-49(76)72-45(26-35-15-6-3-7-16-35)56(83)74-24-12-21-47(74)57(84)73-23-11-20-46(73)55(82)71-43(28-37-31-62-32-65-37)54(81)68-41(25-34-13-4-2-5-14-34)52(79)67-40(19-10-22-63-58(60)61)50(77)69-42(27-36-30-64-39-18-9-8-17-38(36)39)53(80)70-44(29-48(59)75)51(78)66-33/h2-9,13-18,30-33,40-47,64H,10-12,19-29H2,1H3,(H2,59,75)(H,62,65)(H,66,78)(H,67,79)(H,68,81)(H,69,77)(H,70,80)(H,71,82)(H,72,76)(H4,60,61,63)/t33-,40-,41+,42-,43-,44-,45-,46-,47+/m0/s1
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n/an/an/an/a 32n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse MC3R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
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 0.110n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse MC5R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocortin receptor 5


(Mus musculus (Mouse))		BDBM50232408
PNG
(CHEMBL4080169)
Show SMILES NC(=O)C[C@@H]1NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C1=O |r|
Show InChI InChI=1S/C46H58N14O8/c47-38(61)22-35-44(67)60-18-8-15-37(60)45(68)59-17-7-14-36(59)43(66)57-34(21-28-24-50-25-53-28)42(65)55-32(19-26-9-2-1-3-10-26)40(63)54-31(13-6-16-51-46(48)49)39(62)56-33(41(64)58-35)20-27-23-52-30-12-5-4-11-29(27)30/h1-5,9-12,23-25,31-37,52H,6-8,13-22H2,(H2,47,61)(H,50,53)(H,54,63)(H,55,65)(H,56,62)(H,57,66)(H,58,64)(H4,48,49,51)/t31-,32+,33-,34-,35-,36-,37+/m0/s1
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n/an/an/an/a 17n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse MC5R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocortin receptor 5


(Mus musculus (Mouse))		BDBM50232411
PNG
(CHEMBL4088980)
Show SMILES C[C@@H]1NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O |r|
Show InChI InChI=1S/C52H65N13O9/c1-30-44(67)63-40(26-32-15-6-3-7-16-32)50(73)65-24-12-21-42(65)51(74)64-23-11-20-41(64)49(72)62-37(25-31-13-4-2-5-14-31)47(70)59-36(19-10-22-56-52(54)55)45(68)60-38(27-33-29-57-35-18-9-8-17-34(33)35)48(71)61-39(28-43(53)66)46(69)58-30/h2-9,13-18,29-30,36-42,57H,10-12,19-28H2,1H3,(H2,53,66)(H,58,69)(H,59,70)(H,60,68)(H,61,71)(H,62,72)(H,63,67)(H4,54,55,56)/t30-,36-,37+,38-,39-,40-,41-,42+/m0/s1
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n/an/an/an/a 40n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse MC5R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Homo sapiens (Human))		BDBM50232416
PNG
(CHEMBL4061566)
Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C1=O)C(N)=O |r|
Show InChI InChI=1S/C49H69N13O9/c1-3-4-17-35(56-29(2)63)43(66)61-39-27-41(64)53-22-11-10-19-34(42(50)65)57-46(69)38(26-31-28-55-33-18-9-8-16-32(31)33)59-44(67)36(20-12-23-54-49(51)52)58-45(68)37(25-30-14-6-5-7-15-30)60-47(70)40-21-13-24-62(40)48(39)71/h5-9,14-16,18,28,34-40,55H,3-4,10-13,17,19-27H2,1-2H3,(H2,50,65)(H,53,64)(H,56,63)(H,57,69)(H,58,68)(H,59,67)(H,60,70)(H,61,66)(H4,51,52,54)/t34-,35-,36-,37+,38-,39-,40-/m0/s1
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n/an/an/an/a 5.10n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at human MC3R expressed in CHO cells assessed as increase in IBMX-induced cAMP accumulation after 40 mins

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocortin receptor 5


(Mus musculus (Mouse))		BDBM50232417
PNG
(CHEMBL4062633)
Show SMILES NC[C@@H]1NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C1=O |r|
Show InChI InChI=1S/C39H51N11O6/c40-21-30-37(55)50-18-8-15-32(50)38(56)49-17-7-14-31(49)36(54)47-28(19-23-9-2-1-3-10-23)34(52)45-27(13-6-16-43-39(41)42)33(51)46-29(35(53)48-30)20-24-22-44-26-12-5-4-11-25(24)26/h1-5,9-12,22,27-32,44H,6-8,13-21,40H2,(H,45,52)(H,46,51)(H,47,54)(H,48,53)(H4,41,42,43)/t27-,28+,29-,30-,31-,32+/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 MC5R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
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 0.0150n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse MC1R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocyte-stimulating hormone receptor


(Mus musculus)		BDBM50232417
PNG
(CHEMBL4062633)
Show SMILES NC[C@@H]1NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C1=O |r|
Show InChI InChI=1S/C39H51N11O6/c40-21-30-37(55)50-18-8-15-32(50)38(56)49-17-7-14-31(49)36(54)47-28(19-23-9-2-1-3-10-23)34(52)45-27(13-6-16-43-39(41)42)33(51)46-29(35(53)48-30)20-24-22-44-26-12-5-4-11-25(24)26/h1-5,9-12,22,27-32,44H,6-8,13-21,40H2,(H,45,52)(H,46,51)(H,47,54)(H,48,53)(H4,41,42,43)/t27-,28+,29-,30-,31-,32+/m0/s1
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n/an/an/an/a 110n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse MC1R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Mus musculus)		BDBM50232407
PNG
(CHEMBL4096678)
Show SMILES C[C@@H]1NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C1=O |r|
Show InChI InChI=1S/C49H63N15O9/c1-27-47(72)64-19-9-16-39(64)48(73)63-18-8-15-38(63)46(71)62-36(22-30-25-53-26-56-30)45(70)59-34(20-28-10-3-2-4-11-28)43(68)58-33(14-7-17-54-49(51)52)41(66)60-35(21-29-24-55-32-13-6-5-12-31(29)32)44(69)61-37(23-40(50)65)42(67)57-27/h2-6,10-13,24-27,33-39,55H,7-9,14-23H2,1H3,(H2,50,65)(H,53,56)(H,57,67)(H,58,68)(H,59,70)(H,60,66)(H,61,69)(H,62,71)(H4,51,52,54)/t27-,33-,34+,35-,36-,37-,38-,39+/m0/s1
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n/an/an/an/a 300n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse MC3R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocortin receptor 5


(Mus musculus (Mouse))		BDBM50232419
PNG
(CHEMBL4060767)
Show SMILES NC(=N)NCCC[C@@H]1NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O |r|
Show InChI InChI=1S/C42H52N12O6/c43-42(44)46-16-6-13-30-36(55)52-33(20-26-22-47-29-12-5-4-11-28(26)29)40(59)54-18-8-15-35(54)41(60)53-17-7-14-34(53)39(58)51-32(21-27-23-45-24-48-27)38(57)50-31(37(56)49-30)19-25-9-2-1-3-10-25/h1-5,9-12,22-24,30-35,47H,6-8,13-21H2,(H,45,48)(H,49,56)(H,50,57)(H,51,58)(H,52,55)(H4,43,44,46)/t30-,31+,32-,33-,34-,35+/m0/s1
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n/an/an/an/a 6.00E+3n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse MC5R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Mus musculus)		BDBM50232407
PNG
(CHEMBL4096678)
Show SMILES C[C@@H]1NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C1=O |r|
Show InChI InChI=1S/C49H63N15O9/c1-27-47(72)64-19-9-16-39(64)48(73)63-18-8-15-38(63)46(71)62-36(22-30-25-53-26-56-30)45(70)59-34(20-28-10-3-2-4-11-28)43(68)58-33(14-7-17-54-49(51)52)41(66)60-35(21-29-24-55-32-13-6-5-12-31(29)32)44(69)61-37(23-40(50)65)42(67)57-27/h2-6,10-13,24-27,33-39,55H,7-9,14-23H2,1H3,(H2,50,65)(H,53,56)(H,57,67)(H,58,68)(H,59,70)(H,60,66)(H,61,69)(H,62,71)(H4,51,52,54)/t27-,33-,34+,35-,36-,37-,38-,39+/m0/s1
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n/an/an/an/a 29n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse MC4R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Mus musculus)		BDBM50232406
PNG
(CHEMBL4071283)
Show SMILES C[C@@H]1NC(=O)[C@H](CN)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O |r|
Show InChI InChI=1S/C51H65N13O8/c1-30-43(65)61-39(26-32-15-6-3-7-16-32)49(71)64-24-12-21-42(64)50(72)63-23-11-20-41(63)48(70)60-37(25-31-13-4-2-5-14-31)45(67)58-36(19-10-22-55-51(53)54)44(66)59-38(46(68)62-40(28-52)47(69)57-30)27-33-29-56-35-18-9-8-17-34(33)35/h2-9,13-18,29-30,36-42,56H,10-12,19-28,52H2,1H3,(H,57,69)(H,58,67)(H,59,66)(H,60,70)(H,61,65)(H,62,68)(H4,53,54,55)/t30-,36-,37+,38-,39-,40-,41-,42+/m0/s1
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n/an/an/an/a 100n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse MC4R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Mus musculus)		BDBM50232412
PNG
(CHEMBL4085584)
Show SMILES NC(=O)C[C@@H]1NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C1=O |r|
Show InChI InChI=1S/C40H51N11O7/c41-33(52)21-30-38(57)51-18-8-15-32(51)39(58)50-17-7-14-31(50)37(56)48-28(19-23-9-2-1-3-10-23)35(54)46-27(13-6-16-44-40(42)43)34(53)47-29(36(55)49-30)20-24-22-45-26-12-5-4-11-25(24)26/h1-5,9-12,22,27-32,45H,6-8,13-21H2,(H2,41,52)(H,46,54)(H,47,53)(H,48,56)(H,49,55)(H4,42,43,44)/t27-,28+,29-,30-,31-,32+/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 MC3R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Mus musculus)		BDBM50232409
PNG
(CHEMBL4104402)
Show SMILES C[C@@H]1NC(=O)[C@H](CN)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O |r|
Show InChI InChI=1S/C57H72N16O9/c1-33-48(74)70-44(26-35-15-6-3-7-16-35)55(81)73-24-12-21-47(73)56(82)72-23-11-20-46(72)54(80)69-43(28-37-31-61-32-64-37)52(78)67-41(25-34-13-4-2-5-14-34)50(76)66-40(19-10-22-62-57(59)60)49(75)68-42(51(77)71-45(29-58)53(79)65-33)27-36-30-63-39-18-9-8-17-38(36)39/h2-9,13-18,30-33,40-47,63H,10-12,19-29,58H2,1H3,(H,61,64)(H,65,79)(H,66,76)(H,67,78)(H,68,75)(H,69,80)(H,70,74)(H,71,77)(H4,59,60,62)/t33-,40-,41+,42-,43-,44-,45-,46-,47+/m0/s1
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n/an/an/an/a 260n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse MC3R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Mus musculus)		BDBM50232405
PNG
(CHEMBL4099127)
Show SMILES C[C@@H]1NC(=O)[C@H](CN)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C1=O |r|
Show InChI InChI=1S/C48H63N15O8/c1-27-46(70)63-19-9-16-39(63)47(71)62-18-8-15-38(62)45(69)60-36(22-30-25-52-26-55-30)43(67)58-34(20-28-10-3-2-4-11-28)41(65)57-33(14-7-17-53-48(50)51)40(64)59-35(42(66)61-37(23-49)44(68)56-27)21-29-24-54-32-13-6-5-12-31(29)32/h2-6,10-13,24-27,33-39,54H,7-9,14-23,49H2,1H3,(H,52,55)(H,56,68)(H,57,65)(H,58,67)(H,59,64)(H,60,69)(H,61,66)(H4,50,51,53)/t27-,33-,34+,35-,36-,37-,38-,39+/m0/s1
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n/an/an/an/a 1.60n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse MC4R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocortin receptor 5


(Mus musculus (Mouse))		BDBM50232409
PNG
(CHEMBL4104402)
Show SMILES C[C@@H]1NC(=O)[C@H](CN)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O |r|
Show InChI InChI=1S/C57H72N16O9/c1-33-48(74)70-44(26-35-15-6-3-7-16-35)55(81)73-24-12-21-47(73)56(82)72-23-11-20-46(72)54(80)69-43(28-37-31-61-32-64-37)52(78)67-41(25-34-13-4-2-5-14-34)50(76)66-40(19-10-22-62-57(59)60)49(75)68-42(51(77)71-45(29-58)53(79)65-33)27-36-30-63-39-18-9-8-17-38(36)39/h2-9,13-18,30-33,40-47,63H,10-12,19-29,58H2,1H3,(H,61,64)(H,65,79)(H,66,76)(H,67,78)(H,68,75)(H,69,80)(H,70,74)(H,71,77)(H4,59,60,62)/t33-,40-,41+,42-,43-,44-,45-,46-,47+/m0/s1
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n/an/an/an/a 18n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse MC5R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Mus musculus)		BDBM50232411
PNG
(CHEMBL4088980)
Show SMILES C[C@@H]1NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O |r|
Show InChI InChI=1S/C52H65N13O9/c1-30-44(67)63-40(26-32-15-6-3-7-16-32)50(73)65-24-12-21-42(65)51(74)64-23-11-20-41(64)49(72)62-37(25-31-13-4-2-5-14-31)47(70)59-36(19-10-22-56-52(54)55)45(68)60-38(27-33-29-57-35-18-9-8-17-34(33)35)48(71)61-39(28-43(53)66)46(69)58-30/h2-9,13-18,29-30,36-42,57H,10-12,19-28H2,1H3,(H2,53,66)(H,58,69)(H,59,70)(H,60,68)(H,61,71)(H,62,72)(H,63,67)(H4,54,55,56)/t30-,36-,37+,38-,39-,40-,41-,42+/m0/s1
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n/an/an/an/a 130n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse MC4R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50232416
PNG
(CHEMBL4061566)
Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C1=O)C(N)=O |r|
Show InChI InChI=1S/C49H69N13O9/c1-3-4-17-35(56-29(2)63)43(66)61-39-27-41(64)53-22-11-10-19-34(42(50)65)57-46(69)38(26-31-28-55-33-18-9-8-16-32(31)33)59-44(67)36(20-12-23-54-49(51)52)58-45(68)37(25-30-14-6-5-7-15-30)60-47(70)40-21-13-24-62(40)48(39)71/h5-9,14-16,18,28,34-40,55H,3-4,10-13,17,19-27H2,1-2H3,(H2,50,65)(H,53,64)(H,56,63)(H,57,69)(H,58,68)(H,59,67)(H,60,70)(H,61,66)(H4,51,52,54)/t34-,35-,36-,37+,38-,39-,40-/m0/s1
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n/an/an/an/a 0.340n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at human MC4R expressed in CHO cells assessed as increase in IBMX-induced cAMP accumulation after 40 mins

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocyte-stimulating hormone receptor


(Mus musculus)		BDBM50232414
PNG
(CHEMBL4069451)
Show SMILES C[C@@H]1NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O |r|
Show InChI InChI=1S/C58H72N16O10/c1-33-49(76)72-45(26-35-15-6-3-7-16-35)56(83)74-24-12-21-47(74)57(84)73-23-11-20-46(73)55(82)71-43(28-37-31-62-32-65-37)54(81)68-41(25-34-13-4-2-5-14-34)52(79)67-40(19-10-22-63-58(60)61)50(77)69-42(27-36-30-64-39-18-9-8-17-38(36)39)53(80)70-44(29-48(59)75)51(78)66-33/h2-9,13-18,30-33,40-47,64H,10-12,19-29H2,1H3,(H2,59,75)(H,62,65)(H,66,78)(H,67,79)(H,68,81)(H,69,77)(H,70,80)(H,71,82)(H,72,76)(H4,60,61,63)/t33-,40-,41+,42-,43-,44-,45-,46-,47+/m0/s1
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n/an/an/an/a 0.350n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse MC1R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocyte-stimulating hormone receptor


(Mus musculus)		BDBM50232418
PNG
(CHEMBL4084327)
Show SMILES NC(=N)NCCC[C@@H]1NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O |r|
Show InChI InChI=1S/C36H45N9O5/c37-36(38)39-16-6-13-26-31(46)43-28(20-23-21-40-25-12-5-4-11-24(23)25)34(49)45-18-8-15-30(45)35(50)44-17-7-14-29(44)33(48)42-27(32(47)41-26)19-22-9-2-1-3-10-22/h1-5,9-12,21,26-30,40H,6-8,13-20H2,(H,41,47)(H,42,48)(H,43,46)(H4,37,38,39)/t26-,27+,28-,29-,30+/m0/s1
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n/an/an/an/a 1.80E+3n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse MC1R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocyte-stimulating hormone receptor


(Mus musculus)		BDBM50232405
PNG
(CHEMBL4099127)
Show SMILES C[C@@H]1NC(=O)[C@H](CN)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C1=O |r|
Show InChI InChI=1S/C48H63N15O8/c1-27-46(70)63-19-9-16-39(63)47(71)62-18-8-15-38(62)45(69)60-36(22-30-25-52-26-55-30)43(67)58-34(20-28-10-3-2-4-11-28)41(65)57-33(14-7-17-53-48(50)51)40(64)59-35(42(66)61-37(23-49)44(68)56-27)21-29-24-54-32-13-6-5-12-31(29)32/h2-6,10-13,24-27,33-39,54H,7-9,14-23,49H2,1H3,(H,52,55)(H,56,68)(H,57,65)(H,58,67)(H,59,64)(H,60,69)(H,61,66)(H4,50,51,53)/t27-,33-,34+,35-,36-,37-,38-,39+/m0/s1
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n/an/an/an/a 1.10n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse MC1R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocyte-stimulating hormone receptor


(Mus musculus)		BDBM50232413
PNG
(CHEMBL4092082)
Show SMILES C[C@@H]1NC(=O)[C@H](CN)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C1=O |r|
Show InChI InChI=1S/C42H56N12O7/c1-24-40(60)54-19-9-16-34(54)41(61)53-18-8-15-33(53)39(59)51-30(20-25-10-3-2-4-11-25)36(56)49-29(14-7-17-46-42(44)45)35(55)50-31(37(57)52-32(22-43)38(58)48-24)21-26-23-47-28-13-6-5-12-27(26)28/h2-6,10-13,23-24,29-34,47H,7-9,14-22,43H2,1H3,(H,48,58)(H,49,56)(H,50,55)(H,51,59)(H,52,57)(H4,44,45,46)/t24-,29-,30+,31-,32-,33-,34+/m0/s1
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n/an/an/an/a 600n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse MC1R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50232420
PNG
(CHEMBL4089689)
Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C1=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C(C)C)C(N)=O |r|
Show InChI InChI=1S/C59H85N15O11/c1-5-6-20-40(66-35(4)75)51(78)71-45-32-48(76)63-26-13-12-22-42(57(84)73-28-16-25-47(73)56(83)72-49(34(2)3)50(60)77)68-54(81)44(31-37-33-65-39-21-11-10-19-38(37)39)69-52(79)41(23-14-27-64-59(61)62)67-53(80)43(30-36-17-8-7-9-18-36)70-55(82)46-24-15-29-74(46)58(45)85/h7-11,17-19,21,33-34,40-47,49,65H,5-6,12-16,20,22-32H2,1-4H3,(H2,60,77)(H,63,76)(H,66,75)(H,67,80)(H,68,81)(H,69,79)(H,70,82)(H,71,78)(H,72,83)(H4,61,62,64)/t40-,41-,42-,43+,44-,45-,46-,47-,49-/m0/s1
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n/an/an/an/a 29n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at human MC4R expressed in CHO cells assessed as increase in IBMX-induced cAMP accumulation after 45 mins by [125I]cAMP flash plate ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocortin receptor 5


(Mus musculus (Mouse))		BDBM50232413
PNG
(CHEMBL4092082)
Show SMILES C[C@@H]1NC(=O)[C@H](CN)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C1=O |r|
Show InChI InChI=1S/C42H56N12O7/c1-24-40(60)54-19-9-16-34(54)41(61)53-18-8-15-33(53)39(59)51-30(20-25-10-3-2-4-11-25)36(56)49-29(14-7-17-46-42(44)45)35(55)50-31(37(57)52-32(22-43)38(58)48-24)21-26-23-47-28-13-6-5-12-27(26)28/h2-6,10-13,23-24,29-34,47H,7-9,14-22,43H2,1H3,(H,48,58)(H,49,56)(H,50,55)(H,51,59)(H,52,57)(H4,44,45,46)/t24-,29-,30+,31-,32-,33-,34+/m0/s1
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n/an/an/an/a 48n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse MC5R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(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 0.390n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse MC4R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Mus musculus)		BDBM50232408
PNG
(CHEMBL4080169)
Show SMILES NC(=O)C[C@@H]1NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C1=O |r|
Show InChI InChI=1S/C46H58N14O8/c47-38(61)22-35-44(67)60-18-8-15-37(60)45(68)59-17-7-14-36(59)43(66)57-34(21-28-24-50-25-53-28)42(65)55-32(19-26-9-2-1-3-10-26)40(63)54-31(13-6-16-51-46(48)49)39(62)56-33(41(64)58-35)20-27-23-52-30-12-5-4-11-29(27)30/h1-5,9-12,23-25,31-37,52H,6-8,13-22H2,(H2,47,61)(H,50,53)(H,54,63)(H,55,65)(H,56,62)(H,57,66)(H,58,64)(H4,48,49,51)/t31-,32+,33-,34-,35-,36-,37+/m0/s1
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n/an/an/an/a 170n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse MC4R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocortin receptor 5


(Mus musculus (Mouse))		BDBM50232414
PNG
(CHEMBL4069451)
Show SMILES C[C@@H]1NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O |r|
Show InChI InChI=1S/C58H72N16O10/c1-33-49(76)72-45(26-35-15-6-3-7-16-35)56(83)74-24-12-21-47(74)57(84)73-23-11-20-46(73)55(82)71-43(28-37-31-62-32-65-37)54(81)68-41(25-34-13-4-2-5-14-34)52(79)67-40(19-10-22-63-58(60)61)50(77)69-42(27-36-30-64-39-18-9-8-17-38(36)39)53(80)70-44(29-48(59)75)51(78)66-33/h2-9,13-18,30-33,40-47,64H,10-12,19-29H2,1H3,(H2,59,75)(H,62,65)(H,66,78)(H,67,79)(H,68,81)(H,69,77)(H,70,80)(H,71,82)(H,72,76)(H4,60,61,63)/t33-,40-,41+,42-,43-,44-,45-,46-,47+/m0/s1
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n/an/an/an/a 0.450n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse MC5R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocortin receptor 5


(Mus musculus (Mouse))		BDBM50232405
PNG
(CHEMBL4099127)
Show SMILES C[C@@H]1NC(=O)[C@H](CN)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C1=O |r|
Show InChI InChI=1S/C48H63N15O8/c1-27-46(70)63-19-9-16-39(63)47(71)62-18-8-15-38(62)45(69)60-36(22-30-25-52-26-55-30)43(67)58-34(20-28-10-3-2-4-11-28)41(65)57-33(14-7-17-53-48(50)51)40(64)59-35(42(66)61-37(23-49)44(68)56-27)21-29-24-54-32-13-6-5-12-31(29)32/h2-6,10-13,24-27,33-39,54H,7-9,14-23,49H2,1H3,(H,52,55)(H,56,68)(H,57,65)(H,58,67)(H,59,64)(H,60,69)(H,61,66)(H4,50,51,53)/t27-,33-,34+,35-,36-,37-,38-,39+/m0/s1
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n/an/an/an/a 0.300n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse MC5R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocortin receptor 5


(Mus musculus (Mouse))		BDBM50232415
PNG
(CHEMBL4103508)
Show SMILES C[C@@H]1NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C1=O |r|
Show InChI InChI=1S/C43H56N12O8/c1-24-41(62)55-19-9-16-34(55)42(63)54-18-8-15-33(54)40(61)53-30(20-25-10-3-2-4-11-25)38(59)50-29(14-7-17-47-43(45)46)36(57)51-31(21-26-23-48-28-13-6-5-12-27(26)28)39(60)52-32(22-35(44)56)37(58)49-24/h2-6,10-13,23-24,29-34,48H,7-9,14-22H2,1H3,(H2,44,56)(H,49,58)(H,50,59)(H,51,57)(H,52,60)(H,53,61)(H4,45,46,47)/t24-,29-,30+,31-,32-,33-,34+/m0/s1
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n/an/an/an/a 70n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse MC5R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Mus musculus)		BDBM50232418
PNG
(CHEMBL4084327)
Show SMILES NC(=N)NCCC[C@@H]1NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O |r|
Show InChI InChI=1S/C36H45N9O5/c37-36(38)39-16-6-13-26-31(46)43-28(20-23-21-40-25-12-5-4-11-24(23)25)34(49)45-18-8-15-30(45)35(50)44-17-7-14-29(44)33(48)42-27(32(47)41-26)19-22-9-2-1-3-10-22/h1-5,9-12,21,26-30,40H,6-8,13-20H2,(H,41,47)(H,42,48)(H,43,46)(H4,37,38,39)/t26-,27+,28-,29-,30+/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 MC3R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocyte-stimulating hormone receptor


(Mus musculus)		BDBM50232412
PNG
(CHEMBL4085584)
Show SMILES NC(=O)C[C@@H]1NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C1=O |r|
Show InChI InChI=1S/C40H51N11O7/c41-33(52)21-30-38(57)51-18-8-15-32(51)39(58)50-17-7-14-31(50)37(56)48-28(19-23-9-2-1-3-10-23)35(54)46-27(13-6-16-44-40(42)43)34(53)47-29(36(55)49-30)20-24-22-45-26-12-5-4-11-25(24)26/h1-5,9-12,22,27-32,45H,6-8,13-21H2,(H2,41,52)(H,46,54)(H,47,53)(H,48,56)(H,49,55)(H4,42,43,44)/t27-,28+,29-,30-,31-,32+/m0/s1
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n/an/an/an/a 40n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse MC1R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocyte-stimulating hormone receptor


(Mus musculus)		BDBM50232406
PNG
(CHEMBL4071283)
Show SMILES C[C@@H]1NC(=O)[C@H](CN)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O |r|
Show InChI InChI=1S/C51H65N13O8/c1-30-43(65)61-39(26-32-15-6-3-7-16-32)49(71)64-24-12-21-42(64)50(72)63-23-11-20-41(63)48(70)60-37(25-31-13-4-2-5-14-31)45(67)58-36(19-10-22-55-51(53)54)44(66)59-38(46(68)62-40(28-52)47(69)57-30)27-33-29-56-35-18-9-8-17-34(33)35/h2-9,13-18,29-30,36-42,56H,10-12,19-28,52H2,1H3,(H,57,69)(H,58,67)(H,59,66)(H,60,70)(H,61,65)(H,62,68)(H4,53,54,55)/t30-,36-,37+,38-,39-,40-,41-,42+/m0/s1
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n/an/an/an/a 190n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse MC1R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocyte-stimulating hormone receptor


(Mus musculus)		BDBM50232415
PNG
(CHEMBL4103508)
Show SMILES C[C@@H]1NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C1=O |r|
Show InChI InChI=1S/C43H56N12O8/c1-24-41(62)55-19-9-16-34(55)42(63)54-18-8-15-33(54)40(61)53-30(20-25-10-3-2-4-11-25)38(59)50-29(14-7-17-47-43(45)46)36(57)51-31(21-26-23-48-28-13-6-5-12-27(26)28)39(60)52-32(22-35(44)56)37(58)49-24/h2-6,10-13,23-24,29-34,48H,7-9,14-22H2,1H3,(H2,44,56)(H,49,58)(H,50,59)(H,51,57)(H,52,60)(H,53,61)(H4,45,46,47)/t24-,29-,30+,31-,32-,33-,34+/m0/s1
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n/an/an/an/a 500n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse MC1R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Mus musculus)		BDBM50232412
PNG
(CHEMBL4085584)
Show SMILES NC(=O)C[C@@H]1NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C1=O |r|
Show InChI InChI=1S/C40H51N11O7/c41-33(52)21-30-38(57)51-18-8-15-32(51)39(58)50-17-7-14-31(50)37(56)48-28(19-23-9-2-1-3-10-23)35(54)46-27(13-6-16-44-40(42)43)34(53)47-29(36(55)49-30)20-24-22-45-26-12-5-4-11-25(24)26/h1-5,9-12,22,27-32,45H,6-8,13-21H2,(H2,41,52)(H,46,54)(H,47,53)(H,48,56)(H,49,55)(H4,42,43,44)/t27-,28+,29-,30-,31-,32+/m0/s1
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n/an/an/an/a 1.10E+3n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse MC4R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Mus musculus)		BDBM50232413
PNG
(CHEMBL4092082)
Show SMILES C[C@@H]1NC(=O)[C@H](CN)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C1=O |r|
Show InChI InChI=1S/C42H56N12O7/c1-24-40(60)54-19-9-16-34(54)41(61)53-18-8-15-33(53)39(59)51-30(20-25-10-3-2-4-11-25)36(56)49-29(14-7-17-46-42(44)45)35(55)50-31(37(57)52-32(22-43)38(58)48-24)21-26-23-47-28-13-6-5-12-27(26)28/h2-6,10-13,23-24,29-34,47H,7-9,14-22,43H2,1H3,(H,48,58)(H,49,56)(H,50,55)(H,51,59)(H,52,57)(H4,44,45,46)/t24-,29-,30+,31-,32-,33-,34+/m0/s1
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n/an/an/an/a 150n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse MC4R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocortin receptor 5


(Mus musculus (Mouse))		BDBM50232410
PNG
(CHEMBL4081092)
Show SMILES NC[C@@H]1NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C1=O |r|
Show InChI InChI=1S/C45H58N14O7/c46-22-35-43(65)59-18-8-15-37(59)44(66)58-17-7-14-36(58)42(64)56-34(21-28-24-49-25-52-28)41(63)54-32(19-26-9-2-1-3-10-26)39(61)53-31(13-6-16-50-45(47)48)38(60)55-33(40(62)57-35)20-27-23-51-30-12-5-4-11-29(27)30/h1-5,9-12,23-25,31-37,51H,6-8,13-22,46H2,(H,49,52)(H,53,61)(H,54,63)(H,55,60)(H,56,64)(H,57,62)(H4,47,48,50)/t31-,32+,33-,34-,35-,36-,37+/m0/s1
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n/an/an/an/a 330n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse MC5R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocyte-stimulating hormone receptor


(Mus musculus)		BDBM50232410
PNG
(CHEMBL4081092)
Show SMILES NC[C@@H]1NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C1=O |r|
Show InChI InChI=1S/C45H58N14O7/c46-22-35-43(65)59-18-8-15-37(59)44(66)58-17-7-14-36(58)42(64)56-34(21-28-24-49-25-52-28)41(63)54-32(19-26-9-2-1-3-10-26)39(61)53-31(13-6-16-50-45(47)48)38(60)55-33(40(62)57-35)20-27-23-51-30-12-5-4-11-29(27)30/h1-5,9-12,23-25,31-37,51H,6-8,13-22,46H2,(H,49,52)(H,53,61)(H,54,63)(H,55,60)(H,56,64)(H,57,62)(H4,47,48,50)/t31-,32+,33-,34-,35-,36-,37+/m0/s1
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n/an/an/an/a 460n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse MC1R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Mus musculus)		BDBM50232405
PNG
(CHEMBL4099127)
Show SMILES C[C@@H]1NC(=O)[C@H](CN)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C1=O |r|
Show InChI InChI=1S/C48H63N15O8/c1-27-46(70)63-19-9-16-39(63)47(71)62-18-8-15-38(62)45(69)60-36(22-30-25-52-26-55-30)43(67)58-34(20-28-10-3-2-4-11-28)41(65)57-33(14-7-17-53-48(50)51)40(64)59-35(42(66)61-37(23-49)44(68)56-27)21-29-24-54-32-13-6-5-12-31(29)32/h2-6,10-13,24-27,33-39,54H,7-9,14-23,49H2,1H3,(H,52,55)(H,56,68)(H,57,65)(H,58,67)(H,59,64)(H,60,69)(H,61,66)(H4,50,51,53)/t27-,33-,34+,35-,36-,37-,38-,39+/m0/s1
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n/an/an/an/a 40n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse MC3R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocyte-stimulating hormone receptor


(Mus musculus)		BDBM50232419
PNG
(CHEMBL4060767)
Show SMILES NC(=N)NCCC[C@@H]1NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O |r|
Show InChI InChI=1S/C42H52N12O6/c43-42(44)46-16-6-13-30-36(55)52-33(20-26-22-47-29-12-5-4-11-28(26)29)40(59)54-18-8-15-35(54)41(60)53-17-7-14-34(53)39(58)51-32(21-27-23-45-24-48-27)38(57)50-31(37(56)49-30)19-25-9-2-1-3-10-25/h1-5,9-12,22-24,30-35,47H,6-8,13-21H2,(H,45,48)(H,49,56)(H,50,57)(H,51,58)(H,52,55)(H4,43,44,46)/t30-,31+,32-,33-,34-,35+/m0/s1
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n/an/an/an/a 900n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse MC1R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocyte-stimulating hormone receptor


(Mus musculus)		BDBM50232411
PNG
(CHEMBL4088980)
Show SMILES C[C@@H]1NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O |r|
Show InChI InChI=1S/C52H65N13O9/c1-30-44(67)63-40(26-32-15-6-3-7-16-32)50(73)65-24-12-21-42(65)51(74)64-23-11-20-41(64)49(72)62-37(25-31-13-4-2-5-14-31)47(70)59-36(19-10-22-56-52(54)55)45(68)60-38(27-33-29-57-35-18-9-8-17-34(33)35)48(71)61-39(28-43(53)66)46(69)58-30/h2-9,13-18,29-30,36-42,57H,10-12,19-28H2,1H3,(H2,53,66)(H,58,69)(H,59,70)(H,60,68)(H,61,71)(H,62,72)(H,63,67)(H4,54,55,56)/t30-,36-,37+,38-,39-,40-,41-,42+/m0/s1
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n/an/an/an/a 400n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse MC1R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocyte-stimulating hormone receptor


(Mus musculus)		BDBM50232407
PNG
(CHEMBL4096678)
Show SMILES C[C@@H]1NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C1=O |r|
Show InChI InChI=1S/C49H63N15O9/c1-27-47(72)64-19-9-16-39(64)48(73)63-18-8-15-38(63)46(71)62-36(22-30-25-53-26-56-30)45(70)59-34(20-28-10-3-2-4-11-28)43(68)58-33(14-7-17-54-49(51)52)41(66)60-35(21-29-24-55-32-13-6-5-12-31(29)32)44(69)61-37(23-40(50)65)42(67)57-27/h2-6,10-13,24-27,33-39,55H,7-9,14-23H2,1H3,(H2,50,65)(H,53,56)(H,57,67)(H,58,68)(H,59,70)(H,60,66)(H,61,69)(H,62,71)(H4,51,52,54)/t27-,33-,34+,35-,36-,37-,38-,39+/m0/s1
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n/an/an/an/a 12n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse MC1R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocortin receptor 5


(Homo sapiens (Human))		BDBM50232416
PNG
(CHEMBL4061566)
Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C1=O)C(N)=O |r|
Show InChI InChI=1S/C49H69N13O9/c1-3-4-17-35(56-29(2)63)43(66)61-39-27-41(64)53-22-11-10-19-34(42(50)65)57-46(69)38(26-31-28-55-33-18-9-8-16-32(31)33)59-44(67)36(20-12-23-54-49(51)52)58-45(68)37(25-30-14-6-5-7-15-30)60-47(70)40-21-13-24-62(40)48(39)71/h5-9,14-16,18,28,34-40,55H,3-4,10-13,17,19-27H2,1-2H3,(H2,50,65)(H,53,64)(H,56,63)(H,57,69)(H,58,68)(H,59,67)(H,60,70)(H,61,66)(H4,51,52,54)/t34-,35-,36-,37+,38-,39-,40-/m0/s1
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n/an/an/an/a 0.930n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at human MC5R expressed in CHO cells assessed as increase in IBMX-induced cAMP accumulation after 40 mins

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Mus musculus)		BDBM50232414
PNG
(CHEMBL4069451)
Show SMILES C[C@@H]1NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O |r|
Show InChI InChI=1S/C58H72N16O10/c1-33-49(76)72-45(26-35-15-6-3-7-16-35)56(83)74-24-12-21-47(74)57(84)73-23-11-20-46(73)55(82)71-43(28-37-31-62-32-65-37)54(81)68-41(25-34-13-4-2-5-14-34)52(79)67-40(19-10-22-63-58(60)61)50(77)69-42(27-36-30-64-39-18-9-8-17-38(36)39)53(80)70-44(29-48(59)75)51(78)66-33/h2-9,13-18,30-33,40-47,64H,10-12,19-29H2,1H3,(H2,59,75)(H,62,65)(H,66,78)(H,67,79)(H,68,81)(H,69,77)(H,70,80)(H,71,82)(H,72,76)(H4,60,61,63)/t33-,40-,41+,42-,43-,44-,45-,46-,47+/m0/s1
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n/an/an/an/a 1.40n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse MC4R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Mus musculus)		BDBM50232410
PNG
(CHEMBL4081092)
Show SMILES NC[C@@H]1NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C1=O |r|
Show InChI InChI=1S/C45H58N14O7/c46-22-35-43(65)59-18-8-15-37(59)44(66)58-17-7-14-36(58)42(64)56-34(21-28-24-49-25-52-28)41(63)54-32(19-26-9-2-1-3-10-26)39(61)53-31(13-6-16-50-45(47)48)38(60)55-33(40(62)57-35)20-27-23-51-30-12-5-4-11-29(27)30/h1-5,9-12,23-25,31-37,51H,6-8,13-22,46H2,(H,49,52)(H,53,61)(H,54,63)(H,55,60)(H,56,64)(H,57,62)(H4,47,48,50)/t31-,32+,33-,34-,35-,36-,37+/m0/s1
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n/an/an/an/a 950n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse MC4R expressed in HEK293 cells assessed as increase in forskolin-induced cAMP accumulation preincubated for 2 hrs followed ...

J Med Chem 60: 805-813 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01707
BindingDB Entry DOI: 10.7270/Q2R213MT
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%