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GLASS

You can:

Go to the GPCR, ligand, or experimental data tables.
Go to the experimental data table for text mining information in PubMed ID column.
Go to the GPCR page and check other ligands which interact with it.
Go to the ligand page and check other GPCRs which it interacts with.
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GPCR

Name	5-hydroxytryptamine receptor 2A
Species	Rattus norvegicus (Rat)
Gene	Htr2a
Synonym	serotonin 5HT-2 receptor 5Ht-2 'D' receptor 5-hydroxytryptamine (serotonin) receptor 2A, G protein-coupled 5-HT2A receptor 5-HT-2A 5-HT-2 serotonin receptor 2A [ Show all ]
Disease	N/A for non-human GPCRs
Length	471
Amino acid sequence	MEILCEDNISLSSIPNSLMQLGDGPRLYHNDFNSRDANTSEASNWTIDAENRTNLSCEGYLPPTCLSILHLQEKNWSALLTTVVIILTIAGNILVIMAVSLEKKLQNATNYFLMSLAIADMLLGFLVMPVSMLTILYGYRWPLPSKLCAIWIYLDVLFSTASIMHLCAISLDRYVAIQNPIHHSRFNSRTKAFLKIIAVWTISVGISMPIPVFGLQDDSKVFKEGSCLLADDNFVLIGSFVAFFIPLTIMVITYFLTIKSLQKEATLCVSDLSTRAKLASFSFLPQSSLSSEKLFQRSIHREPGSYAGRRTMQSISNEQKACKVLGIVFFLFVVMWCPFFITNIMAVICKESCNENVIGALLNVFVWIGYLSSAVNPLVYTLFNKTYRSAFSRYIQCQYKENRKPLQLILVNTIPALAYKSSQLQVGQKKNSQEDAEQTVDDCSMVTLGKQQSEENCTDNIETVNEKVSCV
UniProt	P14842
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	CHEMBL322
IUPHAR	6
DrugBank	N/A

Ligand

Name	CHEMBL43486
Molecular formula	C14H18N4O
IUPAC name	4-(furan-3-yl)-6-methyl-2-(4-methylpiperazin-1-yl)pyrimidine
Molecular weight	258.325
Hydrogen bond acceptor	5
Hydrogen bond donor	0
XlogP	1.6
Synonyms	6-Methyl-2-(4-methylpiperazine-1-yl)-4-(3-furanyl)pyrimidine 4-Furan-3-yl-6-methyl-2-(4-methyl-piperazin-1-yl)-pyrimidine BDBM50289601
Inchi Key	ATACEPLTGPMHEN-UHFFFAOYSA-N
Inchi ID	InChI=1S/C14H18N4O/c1-11-9-13(12-3-8-19-10-12)16-14(15-11)18-6-4-17(2)5-7-18/h3,8-10H,4-7H2,1-2H3
PubChem CID	44289415
ChEMBL	CHEMBL43486
IUPHAR	N/A
BindingDB	50289601
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	50.0 nM	, Bioorg. Med. Chem. Lett., (1997) 7:13:1635	BindingDB,ChEMBL
Ki	50.12 nM	PMID10821703	ChEMBL

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