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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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Go to the ligand page and check other GPCRs which it interacts with.
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GPCR

Name	Adenosine receptor A3
Species	Homo sapiens (Human)
Gene	ADORA3
Synonym	ARA3 Adenosine receptor A3 A3AR A3 receptor TGPCR1
Disease	Cerebrovascular ischaemia Malaria Ischemia Inflammation Hepatocellular carcinoma; Hepatitis C virus infection Glaucoma Cancer [ Show all ]
Length	318
Amino acid sequence	MPNNSTALSLANVTYITMEIFIGLCAIVGNVLVICVVKLNPSLQTTTFYFIVSLALADIAVGVLVMPLAIVVSLGITIHFYSCLFMTCLLLIFTHASIMSLLAIAVDRYLRVKLTVRYKRVTTHRRIWLALGLCWLVSFLVGLTPMFGWNMKLTSEYHRNVTFLSCQFVSVMRMDYMVYFSFLTWIFIPLVVMCAIYLDIFYIIRNKLSLNLSNSKETGAFYGREFKTAKSLFLVLFLFALSWLPLSIINCIIYFNGEVPQLVLYMGILLSHANSMMNPIVYAYKIKKFKETYLLILKACVVCHPSDSLDTSIEKNSE
UniProt	P0DMS8
Protein Data Bank	N/A
GPCR-HGmod model	N/A
3D structure model	No available structures or models
BioLiP	N/A
Therapeutic Target Database	T36059
ChEMBL	CHEMBL256
IUPHAR	21
DrugBank	BE0000354

Ligand

Name	CHEMBL106040
Molecular formula	C17H13N3O
IUPAC name	5-methyl-2-phenylpyrazolo[3,4-c]quinolin-4-one
Molecular weight	275.311
Hydrogen bond acceptor	2
Hydrogen bond donor	0
XlogP	2.9
Synonyms	2-Phenyl-5-methyl-2H-pyrazolo[3,4-c]quinolin-4(5H)-one BDBM50091134 SCHEMBL5503114 5-Methyl-2-phenyl-2,5-dihydro-pyrazolo[3,4-c]quinolin-4-one
Inchi Key	BWHJBMVFOYHLHQ-UHFFFAOYSA-N
Inchi ID	InChI=1S/C17H13N3O/c1-19-15-10-6-5-9-13(15)14-11-20(18-16(14)17(19)21)12-7-3-2-4-8-12/h2-11H,1H3
PubChem CID	10826247
ChEMBL	CHEMBL106040
IUPHAR	N/A
BindingDB	50091134
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	118.0 nM	PMID10956220	BindingDB,ChEMBL

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