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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	5-Bromo-N,N-dimethyltryptamine
Molecular formula	C12H15BrN2
IUPAC name	2-(5-bromo-1H-indol-3-yl)-N,N-dimethylethanamine
Molecular weight	267.17
Hydrogen bond acceptor	1
Hydrogen bond donor	1
XlogP	2.2
Synonyms	3161AJ 5-Bromodimethyltryptamine CTK4D4337 UNII-2F81I6UW8C 1H-Indole-3-ethanamine, 5-bromo-N,N-dimethyl- 5-Bromo-3-[2-(N,N-dimethylamino)ethyl]-1H-indole AM85630 FT-0620166 [2-(5-Bromo-1H-indol-3-yl)-ethyl]-dimethyl-amine 2-(5-bromo-1H-indol-3-yl)-N,N-dimethylethanamine 5-Bromo-N,N-dimethyl-tryptamine NSC622272 [2-(5-bromo-1H-indol-3-yl)ethyl]-dimethyl-amine (2-(5-Bromo-1H-indol-3-yl)ethyl)dimethylamine 5-bromo-3-[2-(dimethylamino)ethyl]-1h-indole AC1L7GAC DB-081193 Z-5543 1H-Indole-3-ethanamine,5-bromo-N,N-dimethyl- 5-bromo-dimethyltryptamin AMBZ0357 I14-33778 [2-(5-Bromo-1H-indol-3-yl)-ethyl]-dimethylamine 2F81I6UW8C CHEMBL403031 SCHEMBL517473 17274-65-6 5-Bromo-3-[2-(N,N-dimethylamino)ethyl]-1 H-indole AKOS015909321 DTXSID90326928 ZINC1616757 2-(5-bromo-1H-indol-3-yl)-N,N-dimethylethan-1-amine 5-Bromo-DMT ATEYZYQLBQUZJE-UHFFFAOYSA-N NSC-622272 [2-(5-bromo-1H-indol-3-yl)-ethyl]dimethyl-amine [ Show all ]
Inchi Key	ATEYZYQLBQUZJE-UHFFFAOYSA-N
Inchi ID	InChI=1S/C12H15BrN2/c1-15(2)6-5-9-8-14-12-4-3-10(13)7-11(9)12/h3-4,7-8,14H,5-6H2,1-2H3
PubChem CID	360252
ChEMBL	CHEMBL403031
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
Activity	76.0 %	PMID19916528	ChEMBL
Activity	100.0 %	PMID19916528	ChEMBL

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