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GLASS

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Go to the GPCR, ligand, or experimental data tables.
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GPCR

Name	Melanocortin receptor 4
Species	Rattus norvegicus (Rat)
Gene	Mc4r
Synonym	MC4 receptor MC4-R
Disease	N/A for non-human GPCRs
Length	332
Amino acid sequence	MNSTHHHGMYTSLHLWNRSSHGLHGNASESLGKGHSDGGCYEQLFVSPEVFVTLGVISLLENILVIVAIAKNKNLHSPMYFFICSLAVADMLVSVSNGSETIVITLLNSTDTDAQSFTVNIDNVIDSVICSSLLASICSLLSIAVDRYFTIFYALQYHNIMTVRRVGIIISCIWAACTVSGVLFIIYSDSSAVIICLITMFFTMLVLMASLYVHMFLMARLHIKRIAVLPGTGTIRQGANMKGAITLTILIGVFVVCWAPFFLHLLFYISCPQNPYCVCFMSHFNLYLILIMCNAVIDPLIYALRSQELRKTFKEIICFYPLGGICELPGRY
UniProt	P70596
Protein Data Bank	N/A
GPCR-HGmod model	N/A
3D structure model	No available structures or models
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL2700
IUPHAR	285
DrugBank	N/A

Ligand

Name	RY-764
Molecular formula	C34H51FN4O3
IUPAC name	(1R,4S,6R)-N-[(2R)-1-[4-(tert-butylcarbamoyl)-4-cyclohexylpiperidin-1-yl]-3-(4-fluorophenyl)-1-oxopropan-2-yl]-2-methyl-2-azabicyclo[2.2.2]octane-6-carboxamide
Molecular weight	582.805
Hydrogen bond acceptor	5
Hydrogen bond donor	2
XlogP	5.4
Synonyms	MC4 receptor agonists (obesity) BDBM50169442 MZ-767 (1S,4R,5R)-N-[(2R)-1-[4-(tert-butylcarbamoyl)-4-cyclohexylpiperidin-1-yl]-3-(4-fluorophenyl)-1-oxopropan-2-yl]-3-methyl-3-azabicyclo[2.2.2]octane-5-carboxamide D0N6KO RY764 AC1OCFYT MC4 receptor agonists (obesity), Merck & Co (1R,4S,6R)-2-Methyl-2-aza-bicyclo[2.2.2]octane-6-carboxylic acid [(R)-2-(4-tert-butylcarbamoyl-4-cyclohexyl-piperidin-1-yl)-1-(4-fluoro-benzyl)-2-oxo-ethyl]-amide RY 764 GTPL1337 SCHEMBL14040521 Anti-obesity therapy, Merck &Co Melanocortin agonists (obesity/erectile dysfunction), Merck & Co (1R,4S,6R)-N-[(2R)-1-[4-(tert-butylcarbamoyl)-4-cyclohexylpiperidin-1-yl]-3-(4-fluorophenyl)-1-oxopropan-2-yl]-7-methyl-7-azabicyclo[2.2.2]octane-6-carboxamide CHEMBL364346 [ Show all ]
Inchi Key	ARFBDECCXOFCBN-HOLBEBDISA-N
Inchi ID	InChI=1S/C34H51FN4O3/c1-33(2,3)37-32(42)34(25-8-6-5-7-9-25)16-18-39(19-17-34)31(41)28(21-23-10-13-26(35)14-11-23)36-30(40)27-20-24-12-15-29(27)38(4)22-24/h10-11,13-14,24-25,27-29H,5-9,12,15-22H2,1-4H3,(H,36,40)(H,37,42)/t24-,27+,28+,29+/m0/s1
PubChem CID	6918851
ChEMBL	CHEMBL364346
IUPHAR	1337
BindingDB	50169442
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5.

Experimental Data

Parameter	Value	Reference	Database source
EC50	5000.0 nM	PMID15982875	BindingDB,ChEMBL
IC50	3000.0 nM	PMID15982875	BindingDB,ChEMBL

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