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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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GPCR

Name	G-protein coupled receptor homolog US28
Species	Human cytomegalovirus (strain AD169) (HHV-5)
Gene	US28
Synonym	HHRF3
Disease	N/A for non-human GPCRs
Length	354
Amino acid sequence	MTPTTTTAELTTEFDYDEDATPCVFTDVLNQSKPVTLFLYGVVFLFGSIGNFLVIFTITWRRRIQCSGDVYFINLAAADLLFVCTLPLWMQYLLDHNSLASVPCTLLTACFYVAMFASLCFITEIALDRYYAIVYMRYRPVKQACLFSIFWWIFAVIIAIPHFMVVTKKDNQCMTDYDYLEVSYPIILNVELMLGAFVIPLSVISYCYYRISRIVAVSQSRHKGRIVRVLIAVVLVFIIFWLPYHLTLFVDTLKLLKWISSSCEFERSLKRALILTESLAFCHCCLNPLLYVFVGTKFRQELHCLLAEFRQRLFSRDVSWYHSMSFSRRSSPSRRETSSDTLSDEVCRVSQIIP
UniProt	P69332
Protein Data Bank	4xt1
GPCR-HGmod model	N/A
3D structure model	This structure is from PDB ID 4xt1.
BioLiP	BL0309402,BL0309403
Therapeutic Target Database	N/A
ChEMBL	CHEMBL4259
IUPHAR	N/A
DrugBank	N/A

Ligand

Name	CHEMBL195943
Molecular formula	C28H30N2O
IUPAC name	5-(4-hydroxy-4-phenylpiperidin-1-yl)-2,2-diphenylpentanenitrile
Molecular weight	410.561
Hydrogen bond acceptor	3
Hydrogen bond donor	1
XlogP	5.0
Synonyms	2,2-Diphenyl-5-(4-hydroxy-4-phenylpiperidino)valeronitrile BDBM50027219 SCHEMBL9107132 5-(4-Hydroxy-4-phenyl-piperidin-1-yl)-2,2-diphenyl-pentanenitrile
Inchi Key	LTPMFZAZIBOVMM-UHFFFAOYSA-N
Inchi ID	InChI=1S/C28H30N2O/c29-23-27(24-11-4-1-5-12-24,25-13-6-2-7-14-25)17-10-20-30-21-18-28(31,19-22-30)26-15-8-3-9-16-26/h1-9,11-16,31H,10,17-22H2
PubChem CID	10811537
ChEMBL	CHEMBL195943
IUPHAR	N/A
BindingDB	50027219
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
EC50	28200.0 nM	PMID16190772	BindingDB,ChEMBL
IC50	35500.0 nM	PMID16190772	BindingDB,ChEMBL

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