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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	Homo sapiens (Human)
Gene	MC4R
Synonym	MC4-R MC4 receptor
Disease	Obesity; Sexual dysfunction Obesity; Diabetes Obesity Metabolic disorders Sexual dysfunction Sexual dysfunction; Obesity Female sexual dysfunction Erectile dysfunction Cachexia Anorexia nervosa cachexia [ Show all ]
Length	332
Amino acid sequence	MVNSTHRGMHTSLHLWNRSSYRLHSNASESLGKGYSDGGCYEQLFVSPEVFVTLGVISLLENILVIVAIAKNKNLHSPMYFFICSLAVADMLVSVSNGSETIVITLLNSTDTDAQSFTVNIDNVIDSVICSSLLASICSLLSIAVDRYFTIFYALQYHNIMTVKRVGIIISCIWAACTVSGILFIIYSDSSAVIICLITMFFTMLALMASLYVHMFLMARLHIKRIAVLPGTGAIRQGANMKGAITLTILIGVFVVCWAPFFLHLIFYISCPQNPYCVCFMSHFNLYLILIMCNSIIDPLIYALRSQELRKTFKEIICCYPLGGLCDLSSRY
UniProt	P32245
Protein Data Bank	N/A
GPCR-HGmod model	P32245
3D structure model	This predicted structure model is from GPCR-EXP P32245.
BioLiP	N/A
Therapeutic Target Database	T72458
ChEMBL	CHEMBL259
IUPHAR	285
DrugBank	N/A

Ligand

Name	MLS003120640
Molecular formula	C23H19N3O5S
IUPAC name	3-(3-carbamoylphenyl)-N-[3-(methanesulfonamido)phenyl]-1-benzofuran-7-carboxamide
Molecular weight	449.481
Hydrogen bond acceptor	6
Hydrogen bond donor	3
XlogP	2.6
Synonyms	SMR001290036 CHEMBL1863528
Inchi Key	AGHSZCLKXBSJEX-UHFFFAOYSA-N
Inchi ID	InChI=1S/C23H19N3O5S/c1-32(29,30)26-17-8-3-7-16(12-17)25-23(28)19-10-4-9-18-20(13-31-21(18)19)14-5-2-6-15(11-14)22(24)27/h2-13,26H,1H3,(H2,24,27)(H,25,28)
PubChem CID	49791160
ChEMBL	CHEMBL1863528
IUPHAR	N/A
BindingDB	N/A
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
IC50	<64575.0 nM	PubChem BioAssay data set	ChEMBL

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