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GLASS

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Go to the GPCR, ligand, or experimental data tables.
Go to the experimental data table for text mining information in PubMed ID column.
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GPCR

Name	Neuropeptide Y receptor type 1
Species	Homo sapiens (Human)
Gene	NPY1R
Synonym	neuropeptide Y receptor type 1 NPY-Y1 receptor NPY1-R FC5 Y1 receptor Y1-R [ Show all ]
Disease	Hypertension; Obesity; Heart disease Obesity Eating disorders reduction in food intake obesity anxiety Eating disorders reduction in food intake Eating disorder Cardiovascular disorder Hypertension [ Show all ]
Length	384
Amino acid sequence	MNSTLFSQVENHSVHSNFSEKNAQLLAFENDDCHLPLAMIFTLALAYGAVIILGVSGNLALIIIILKQKEMRNVTNILIVNLSFSDLLVAIMCLPFTFVYTLMDHWVFGEAMCKLNPFVQCVSITVSIFSLVLIAVERHQLIINPRGWRPNNRHAYVGIAVIWVLAVASSLPFLIYQVMTDEPFQNVTLDAYKDKYVCFDQFPSDSHRLSYTTLLLVLQYFGPLCFIFICYFKIYIRLKRRNNMMDKMRDNKYRSSETKRINIMLLSIVVAFAVCWLPLTIFNTVFDWNHQIIATCNHNLLFLLCHLTAMISTCVNPIFYGFLNKNFQRDLQFFFNFCDFRSRDDDYETIAMSTMHTDVSKTSLKQASPVAFKKINNNDDNEKI
UniProt	P25929
Protein Data Bank	5zbh
GPCR-HGmod model	P25929
3D structure model	This structure is from PDB ID 5zbh.
BioLiP	BL0411971
Therapeutic Target Database	T89213
ChEMBL	CHEMBL4777
IUPHAR	305
DrugBank	N/A

Ligand

Name	CHEMBL314637
Molecular formula	C28H30N4O4
IUPAC name	[2-oxo-1-[[3-(propan-2-ylcarbamoylamino)phenyl]methyl]-4,5-dihydro-3H-1-benzazepin-3-yl] N-phenylcarbamate
Molecular weight	486.572
Hydrogen bond acceptor	4
Hydrogen bond donor	3
XlogP	4.3
Synonyms	BDBM50079005 Phenyl-carbamic acid 1-[3-(3-isopropyl-ureido)-benzyl]-2-oxo-2,3,4,5-tetrahydro-1H-benzo[b]azepin-3-yl ester 1-[3-(3-Isopropylureido)benzyl]-3-(phenylcarbamoyloxy)-4,5-dihydro-1H-1-benzazepine-2(3H)-one
Inchi Key	AYSJIAXODNEOQL-UHFFFAOYSA-N
Inchi ID	InChI=1S/C28H30N4O4/c1-19(2)29-27(34)30-23-13-8-9-20(17-23)18-32-24-14-7-6-10-21(24)15-16-25(26(32)33)36-28(35)31-22-11-4-3-5-12-22/h3-14,17,19,25H,15-16,18H2,1-2H3,(H,31,35)(H2,29,30,34)
PubChem CID	10552954
ChEMBL	CHEMBL314637
IUPHAR	N/A
BindingDB	50079005
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
Ki	450.0 nM	PMID10411482	BindingDB,ChEMBL

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