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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	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	CHEMBL6310
Molecular formula	C12H14N2O
IUPAC name	7-methoxy-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
Molecular weight	202.257
Hydrogen bond acceptor	2
Hydrogen bond donor	2
XlogP	1.5
Synonyms	7-Methoxy-1,2,3,4-tetrahydro-beta-carboline 91566-22-2 SCIRNASYBOGBOO-UHFFFAOYSA-N BDBM50132097 7-Methoxy-2,3,4,9-tetrahydro-1H-beta-carboline D05GDP AC1LCCZT ZINC13587968 7-Methoxy-1,2,3,4-tetrahydro-9H-pyrido[3,4-b]indole 7-methoxy-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole Methyl 2,3,4,9-tetrahydro-1H-beta-carbolin-7-yl ether # AKOS004119616 [ Show all ]
Inchi Key	SCIRNASYBOGBOO-UHFFFAOYSA-N
Inchi ID	InChI=1S/C12H14N2O/c1-15-8-2-3-9-10-4-5-13-7-12(10)14-11(9)6-8/h2-3,6,13-14H,4-5,7H2,1H3
PubChem CID	599482
ChEMBL	CHEMBL6310
IUPHAR	N/A
BindingDB	50132097
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	<1000.0 nM	PMID15013009	BindingDB,ChEMBL
Ki	2200.0 nM	PMID14643338	BindingDB,ChEMBL
Ki	4620.0 nM	PMID14643338	BindingDB,ChEMBL

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