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GLASS

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

Name	Neuropeptide Y receptor type 4
Species	Homo sapiens (Human)
Gene	NPY4R
Synonym	NPY4-R neuropeptide Y receptor type 4 pancreatic polypeptide receptor 1 PP1 Y4 receptor
Disease	Obesity Diabetes Schizophrenia
Length	375
Amino acid sequence	MNTSHLLALLLPKSPQGENRSKPLGTPYNFSEHCQDSVDVMVFIVTSYSIETVVGVLGNLCLMCVTVRQKEKANVTNLLIANLAFSDFLMCLLCQPLTAVYTIMDYWIFGETLCKMSAFIQCMSVTVSILSLVLVALERHQLIINPTGWKPSISQAYLGIVLIWVIACVLSLPFLANSILENVFHKNHSKALEFLADKVVCTESWPLAHHRTIYTTFLLLFQYCLPLGFILVCYARIYRRLQRQGRVFHKGTYSLRAGHMKQVNVVLVVMVVAFAVLWLPLHVFNSLEDWHHEAIPICHGNLIFLVCHLLAMASTCVNPFIYGFLNTNFKKEIKALVLTCQQSAPLEESEHLPLSTVHTEVSKGSLRLSGRSNPI
UniProt	P50391
Protein Data Bank	N/A
GPCR-HGmod model	P50391
3D structure model	This predicted structure model is from GPCR-EXP P50391.
BioLiP	N/A
Therapeutic Target Database	T27944
ChEMBL	CHEMBL4877
IUPHAR	307
DrugBank	BE0002418

Ligand

Name	CHEMBL2440119
Molecular formula	C33H54N12O8
IUPAC name	(1R,2S)-2-[[(2S)-2-[[(2S,3R)-2-acetamido-3-hydroxybutanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-N-[(2S)-1-[[(2S)-1-amino-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]cyclopentane-1-carboxamide
Molecular weight	746.871
Hydrogen bond acceptor	10
Hydrogen bond donor	12
XlogP	-2.9
Synonyms	BDBM50441958
Inchi Key	DVFMZXMRSBGZSI-MPAKYALESA-N
Inchi ID	InChI=1S/C33H54N12O8/c1-17(46)26(41-18(2)47)31(53)44-24(9-5-15-40-33(37)38)29(51)42-22-7-3-6-21(22)28(50)43-23(8-4-14-39-32(35)36)30(52)45-25(27(34)49)16-19-10-12-20(48)13-11-19/h10-13,17,21-26,46,48H,3-9,14-16H2,1-2H3,(H2,34,49)(H,41,47)(H,42,51)(H,43,50)(H,44,53)(H,45,52)(H4,35,36,39)(H4,37,38,40)/t17-,21-,22+,23+,24+,25+,26+/m1/s1
PubChem CID	72711815
ChEMBL	CHEMBL2440119
IUPHAR	N/A
BindingDB	50441958
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has more than 5 hydrogen bond donor. This ligand is heavier than 500 daltons.

Experimental Data

Parameter	Value	Reference	Database source
EC50	451.0 nM	PMID24090364	BindingDB,ChEMBL
Emax	59.0 %	PMID24090364	ChEMBL
Ki	509.0 nM	PMID24090364	BindingDB,ChEMBL

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