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Compile Data Set for Download or QSAR

Found 4 hits of ec50 for monomerid = 50232405   
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 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
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
KEGG

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PubMed
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
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
PDB

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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 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
PDB

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Article
PubMed
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