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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	MLS000089771
Molecular formula	C23H30N2O2
IUPAC name	1-[4-(4-methylphenyl)piperazin-1-yl]-3-(2-prop-2-enylphenoxy)propan-2-ol
Molecular weight	366.505
Hydrogen bond acceptor	4
Hydrogen bond donor	1
XlogP	4.3
Synonyms	AKOS001644934 1-(2-allylphenoxy)-3-[4-(p-tolyl)piperazino]propan-2-ol Oprea1_031090 HMS2471N17 SR-01000460024-1 AKOS021994733 MLS002585143 1-[4-(4-methylphenyl)-1-piperazinyl]-3-(2-prop-2-enylphenoxy)-2-propanol CHEMBL1548605 SMR000024389 AC1MME82 MCULE-3891300974 1-(2-allylphenoxy)-3-[4-(4-methylphenyl)piperazin-1-yl]propan-2-ol BDBM61795 MolPort-007-560-794 1-[4-(4-methylphenyl)piperazin-1-yl]-3-(2-prop-2-enylphenoxy)propan-2-ol cid_3237370 SR-01000460024 [ Show all ]
Inchi Key	BEYGANIWMHXXHZ-UHFFFAOYSA-N
Inchi ID	InChI=1S/C23H30N2O2/c1-3-6-20-7-4-5-8-23(20)27-18-22(26)17-24-13-15-25(16-14-24)21-11-9-19(2)10-12-21/h3-5,7-12,22,26H,1,6,13-18H2,2H3
PubChem CID	3237370
ChEMBL	CHEMBL1548605
IUPHAR	N/A
BindingDB	61795
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
EC50	8504.0 nM	, PubChem BioAssay data set	BindingDB,ChEMBL

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