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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	Rattus norvegicus (Rat)
Gene	Npy1r
Synonym	FC5 neuropeptide Y receptor type 1 NPY-Y1 receptor NPY1-R Y1 receptor Y1-R [ Show all ]
Disease	N/A for non-human GPCRs
Length	382
Amino acid sequence	MNSTLFSRVENYSVHYNVSENSPFLAFENDDCHLPLAVIFTLALAYGAVIILGVSGNLALIIIILKQKEMRNVTNILIVNLSFSDLLVAVMCLPFTFVYTLMDHWVFGETMCKLNPFVQCVSITVSIFSLVLIAVERHQLIINPRGWRPNNRHAYIGITVIWVLAVASSLPFVIYQILTDEPFQNVSLAAFKDKYVCFDKFPSDSHRLSYTTLLLVLQYFGPLCFIFICYFKIYIRLKRRNNMMDKIRDSKYRSSETKRINVMLLSIVVAFAVCWLPLTIFNTVFDWNHQIIATCNHNLLFLLCHLTAMISTCVNPIFYGFLNKNFQRDLQFFFNFCDFRSRDDDYETIAMSTMHTDVSKTSLKQASPVAFKKISMNDNEKI
UniProt	P21555
Protein Data Bank	N/A
GPCR-HGmod model	N/A
3D structure model	No available structures or models
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL2587
IUPHAR	305
DrugBank	N/A

Ligand

Name	UNII-QKC82E736Q
Molecular formula	C29H35N7O3
IUPAC name	(2R)-N-[[4-[(carbamoylamino)methyl]phenyl]methyl]-5-(diaminomethylideneamino)-2-[(2,2-diphenylacetyl)amino]pentanamide
Molecular weight	529.645
Hydrogen bond acceptor	4
Hydrogen bond donor	6
XlogP	1.4
Synonyms	(r)-N-[[4-(aminocarbonylaminomethyl)-phenyl]methyl]-n2-(diphen ylacetyl)-argininamide Benzeneacetamide, N-((1R)-1-((((4-(((aminocarbonyl)amino)methyl)phenyl)methyl)amino)carbonyl)-4-((aminoiminomethyl)amino)butyl)-alpha-phenyl- CTK8E9767 ZINC3952359 191868-14-1 BIBO-3304 KB-271535 (2R)-N-[[4-[(carbamoylamino)methyl]phenyl]methyl]-5-(diaminomethylideneamino)-2-[[2,2-di(phenyl)acetyl]amino]pentanamide AKOS024457083 SCHEMBL6899864 Benzeneacetamide, N-(1-((((4-(((aminocarbonyl)amino)methyl)phenyl)methyl)amino)carbonyl)-4-((aminoiminomethyl)amino)butyl)-alpha-phenyl-, (R)- D0U5TK BIBO-3304 free base QKC82E736Q (R)-N-alpha-(2,2-Diphenylacetyl)-N-(4-ureidomethylbenzyl)argininamide BDBM50343731 CHEMBL1774204 191868-13-0 BIBO 3304 TRIFLUOROACETATE GTPL1528 (2R)-N-[[4-[(carbamoylamino)methyl]phenyl]methyl]-5-(diaminomethylideneamino)-2-[(2,2-diphenylacetyl)amino]pentanamide AC1NSJUH BIBO3304 RT-011503 [ Show all ]
Inchi Key	TVMJSGGZULFVCZ-XMMPIXPASA-N
Inchi ID	InChI=1S/C29H35N7O3/c30-28(31)33-17-7-12-24(26(37)34-18-20-13-15-21(16-14-20)19-35-29(32)39)36-27(38)25(22-8-3-1-4-9-22)23-10-5-2-6-11-23/h1-6,8-11,13-16,24-25H,7,12,17-19H2,(H,34,37)(H,36,38)(H4,30,31,33)(H3,32,35,39)/t24-/m1/s1
PubChem CID	5311022
ChEMBL	CHEMBL1774204
IUPHAR	1528
BindingDB	50343731
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
IC50	0.199526 nM	PMID10694200	IUPHAR

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