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GLASS

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Go to the GPCR, ligand, or experimental data tables.
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GPCR

Name	G-protein coupled receptor 55
Species	Homo sapiens (Human)
Gene	GPR55
Synonym	GPR55
Disease	N/A
Length	319
Amino acid sequence	MSQQNTSGDCLFDGVNELMKTLQFAVHIPTFVLGLLLNLLAIHGFSTFLKNRWPDYAATSIYMINLAVFDLLLVLSLPFKMVLSQVQSPFPSLCTLVECLYFVSMYGSVFTICFISMDRFLAIRYPLLVSHLRSPRKIFGICCTIWVLVWTGSIPIYSFHGKVEKYMCFHNMSDDTWSAKVFFPLEVFGFLLPMGIMGFCCSRSIHILLGRRDHTQDWVQQKACIYSIAASLAVFVVSFLPVHLGFFLQFLVRNSFIVECRAKQSISFFLQLSMCFSNVNCCLDVFCYYFVIKEFRMNIRAHRPSRVQLVLQDTTISRG
UniProt	Q9Y2T6
Protein Data Bank	N/A
GPCR-HGmod model	Q9Y2T6
3D structure model	This predicted structure model is from GPCR-EXP Q9Y2T6.
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL1075322
IUPHAR	109
DrugBank	BE0005802

Ligand

Name	CHEMBL506746
Molecular formula	C14H16O2
IUPAC name	3,8-dimethyl-5-propan-2-ylchromen-2-one
Molecular weight	216.28
Hydrogen bond acceptor	2
Hydrogen bond donor	0
XlogP	3.8
Synonyms	BDBM50278476 5-Isopropyl-3,8-dimethylchromen-2-one
Inchi Key	FWQVSIMNEDPTRV-UHFFFAOYSA-N
Inchi ID	InChI=1S/C14H16O2/c1-8(2)11-6-5-9(3)13-12(11)7-10(4)14(15)16-13/h5-8H,1-4H3
PubChem CID	16067273
ChEMBL	CHEMBL506746
IUPHAR	N/A
BindingDB	50278476
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	3450.0 nM	PMID23679955	BindingDB,ChEMBL

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