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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	Sakuranetin
Molecular formula	C16H14O5
IUPAC name	(2S)-5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-2,3-dihydrochromen-4-one
Molecular weight	286.283
Hydrogen bond acceptor	5
Hydrogen bond donor	2
XlogP	2.7
Synonyms	D0B7OW MolPort-039-052-519 ZINC338284 (2S)-5,4'-dihydroxy-7-methoxyflavan-4-one (S)-5-hydroxy-2-(4-hydroxyphenyl)-7-methoxychroman-4-one 4h-1-benzopyran-4-one, 2,3-dihydro-5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-,(2s)- AJ-19903 Flavanone, 4',5-dihydroxy-7-methoxy-, (S)-(-)- (8CI) (2S)-5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-chroman-4-one 3O38P61299 5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-chroman-4-one C09833 CHEMBL448297 GTPL412 UNII-3O38P61299 (2S)--5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-2,3-dihydrochromen-4-one (S)-(-)-4',5-dihydroxy-7-methoxyflavanone 4H-1-Benzopyran-4-one, 2,3-dihydro-5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-, (2S)- AC1L2K3P DB08517 Naringenin 7-methyl ether (2S)-5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-2,3-dihydro-4H-chromen-4-one 2957-21-3 5,4''-dihydroxy-7-methoxyflavanone AKOS027321114 FT-0081262 Sakuranetin, analytical standard (2S)-5-hydroxy-2-(4-hydroxyphenyl)-7-methoxychroman-4-one 4',5-Dihydroxy-7-methoxyflavanone CHEBI:28927 D07IYH LMPK12140571 ZB010902 (2S)-4',5-dihydroxy-7-methoxyflavanone (S)-2,3-dihydro-5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-4H-1-benzopyran-4-one 4H-1-Benzopyran-4-one, 2,3-dihydro-5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-, (S)- (9CI) AC1Q6KIJ EINECS 220-980-5 NSC 407228 (2S)-5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-2,3-dihydrochromen-4-one 3d04 5,4'-Dihydroxy-7-methoxyflavanone BDBM50312648 FT-0650767 SCHEMBL555542 (2S)-sakuranetin 7-O-Methylnaringenin [ Show all ]
Inchi Key	DJOJDHGQRNZXQQ-AWEZNQCLSA-N
Inchi ID	InChI=1S/C16H14O5/c1-20-11-6-12(18)16-13(19)8-14(21-15(16)7-11)9-2-4-10(17)5-3-9/h2-7,14,17-18H,8H2,1H3/t14-/m0/s1
PubChem CID	73571
ChEMBL	CHEMBL448297
IUPHAR	412
BindingDB	50312648
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	3600.0 nM	PMID21650152	BindingDB,ChEMBL

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