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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.
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	Adenosine receptor A1
Species	Rattus norvegicus (Rat)
Gene	Adora1
Synonym	A1 receptor A1-AR A1R adenosine receptor A1 RDC7
Disease	N/A for non-human GPCRs
Length	326
Amino acid sequence	MPPYISAFQAAYIGIEVLIALVSVPGNVLVIWAVKVNQALRDATFCFIVSLAVADVAVGALVIPLAILINIGPQTYFHTCLMVACPVLILTQSSILALLAIAVDRYLRVKIPLRYKTVVTQRRAAVAIAGCWILSLVVGLTPMFGWNNLSVVEQDWRANGSVGEPVIKCEFEKVISMEYMVYFNFFVWVLPPLLLMVLIYLEVFYLIRKQLNKKVSASSGDPQKYYGKELKIAKSLALILFLFALSWLPLHILNCITLFCPTCQKPSILIYIAIFLTHGNSAMNPIVYAFRIHKFRVTFLKIWNDHFRCQPKPPIDEDLPEEKAED
UniProt	P25099
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	CHEMBL318
IUPHAR	18
DrugBank	N/A

Ligand

Name	CHEMBL319356
Molecular formula	C9H12N4
IUPAC name	2,5,6-trimethyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine
Molecular weight	176.223
Hydrogen bond acceptor	3
Hydrogen bond donor	2
XlogP	1.5
Synonyms	111601-38-8 AKOS022473680 4-Amino-2,5,6-trimethyl-7H-pyrrolo[2,3-d]pyrimidine AC1Q2E1Q ZINC26719849 2,5,6-trimethyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine BDBM50014283 EN300-71590 AKOS009335754 2,5,6-Trimethyl-7H-pyrrolo[2,3-d]pyrimidin-4-ylamine 7H-Pyrrolo[2,3-d]pyrimidin-4-amine, 2,5,6-trimethyl- MolPort-013-273-589 [ Show all ]
Inchi Key	ABYSHPMNLZCWGY-UHFFFAOYSA-N
Inchi ID	InChI=1S/C9H12N4/c1-4-5(2)11-9-7(4)8(10)12-6(3)13-9/h1-3H3,(H3,10,11,12,13)
PubChem CID	13803176
ChEMBL	CHEMBL319356
IUPHAR	N/A
BindingDB	50014283
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	88000.0 nM	PMID2213835	BindingDB,ChEMBL

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