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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	Taste receptor type 2 member 31
Species	Homo sapiens (Human)
Gene	TAS2R31
Synonym	taste receptor, type 2, member 31 Taste receptor type 2 member 53 Taste receptor type 2 member 44 TAS2R44 TAS2R31 T2R53 T2R44 T2R31 taste receptor, type 2, member 44 [ Show all ]
Disease	N/A
Length	309
Amino acid sequence	MTTFIPIIFSSVVVVLFVIGNFANGFIALVNSIERVKRQKISFADQILTALAVSRVGLLWVLLLNWYSTVFNPAFYSVEVRTTAYNVWAVTGHFSNWLATSLSIFYLLKIANFSNLIFLHLKRRVKSVILVMLLGPLLFLACQLFVINMKEIVRTKEYEGNLTWKIKLRSAVYLSDATVTTLGNLVPFTLTLLCFLLLICSLCKHLKKMQLHGKGSQDPSTKVHIKALQTVIFFLLLCAVYFLSIMISVWSFGSLENKPVFMFCKAIRFSYPSIHPFILIWGNKKLKQTFLSVLRQVRYWVKGEKPSSP
UniProt	P59538
Protein Data Bank	N/A
GPCR-HGmod model	P59538
3D structure model	This predicted structure model is from GPCR-EXP P59538.
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL2034804
IUPHAR	674
DrugBank	N/A

Ligand

Name	Jaceosidin
Molecular formula	C17H14O7
IUPAC name	5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-6-methoxychromen-4-one
Molecular weight	330.292
Hydrogen bond acceptor	7
Hydrogen bond donor	3
XlogP	1.7
Synonyms	TC-151306 4',5,7-Trihydroxy-3',6-dimethoxyflavone 5,7-Dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-6-methoxy-4H-chromen-4-one # AK101903 CHEMBL487601 KB-187977 4H-1-Benzopyran-4-one, 5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-6-methoxy- 9484AA AX8233442 FT-0686647 N2160 SCHEMBL3960077 085T977 5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-6-methoxy-4H-1-Benzopyran-4-one AC1NTE3G CHEBI:66103 TL80090009 4,5,7-Trihydroxy-3,6-dimethoxyflavone 5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-6-methoxychromen-4-one AKOS015917411 CTK4D7727 LMPK12111235 4H-1-Benzopyran-4-one,5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-6-methoxy- AB0088285 BCP10203 GLAAQZFBFGEBPS-UHFFFAOYSA-N Q-100215 ST24044114 18085-97-7 5,7-Dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-6-methoxy-4H-chromen-4-one AJ-65365 JACEOSIDINE ZINC14779854 4CN-3058 ANW-62561 DTXSID00171022 MolPort-006-668-410 5,7-dihydroxy-2-(4-hydroxy-3-methoxy-phenyl)-6-methoxy-chromen-4-one AC-7927 BDBM84984 I14-9712 SC3961 [ Show all ]
Inchi Key	GLAAQZFBFGEBPS-UHFFFAOYSA-N
Inchi ID	InChI=1S/C17H14O7/c1-22-13-5-8(3-4-9(13)18)12-6-10(19)15-14(24-12)7-11(20)17(23-2)16(15)21/h3-7,18,20-21H,1-2H3
PubChem CID	5379096
ChEMBL	CHEMBL487601
IUPHAR	N/A
BindingDB	84984
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
IC50	11300.0 nM	PMID21650152	BindingDB,ChEMBL

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