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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 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	CHEMBL564536
Molecular formula	C29H38ClN5O3S
IUPAC name	propan-2-yl N-[3-chloro-5-[1-[[6-[2-(5-ethyl-4-methyl-1,3-thiazol-2-yl)ethyl]-4-morpholin-4-ylpyridin-2-yl]amino]ethyl]phenyl]carbamate
Molecular weight	572.165
Hydrogen bond acceptor	8
Hydrogen bond donor	2
XlogP	6.4
Synonyms	Carbamic acid, (3-chloro-5-(1-((6-(2-(5-ethyl-4-methyl-2-thiazolyl)ethyl)-4-(4-morpholinyl)-2-pyridinyl)amino)ethyl)phenyl)-, 1-methylethyl ester SCHEMBL162002 J-115814 Carbamic acid, N-(3-chloro-5-(1-((6-(2-(5-ethyl-4-methyl-2-thiazolyl)ethyl)-4-(4-morpholinyl)-2-pyridinyl)amino)ethyl)phenyl)-, 1-methylethyl ester isopropyl 3-chloro-5-(1-(6-(2-(5-ethyl-4-methylthiazol-2-yl)ethyl)-4-morpholinopyridin-2-ylamino)ethyl)phenylcarbamate BDBM50296002 J-115814, (+/-)- 329716-61-2 J 115814 [ Show all ]
Inchi Key	AZGZXUZMWKHDDH-UHFFFAOYSA-N
Inchi ID	InChI=1S/C29H38ClN5O3S/c1-6-26-20(5)32-28(39-26)8-7-23-16-25(35-9-11-37-12-10-35)17-27(33-23)31-19(4)21-13-22(30)15-24(14-21)34-29(36)38-18(2)3/h13-19H,6-12H2,1-5H3,(H,31,33)(H,34,36)
PubChem CID	9959777
ChEMBL	CHEMBL564536
IUPHAR	N/A
BindingDB	50296002
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
IC50	1.4 nM	PMID19487123	BindingDB,ChEMBL

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