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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	Bombesin receptor subtype-3
Species	Homo sapiens (Human)
Gene	BRS3
Synonym	bombesin receptor subtype-3 BRS-3 bombesin like receptor 3 BB3 receptor bb3
Disease	Breast cancer Cancer
Length	399
Amino acid sequence	MAQRQPHSPNQTLISITNDTESSSSVVSNDNTNKGWSGDNSPGIEALCAIYITYAVIISVGILGNAILIKVFFKTKSMQTVPNIFITSLAFGDLLLLLTCVPVDATHYLAEGWLFGRIGCKVLSFIRLTSVGVSVFTLTILSADRYKAVVKPLERQPSNAILKTCVKAGCVWIVSMIFALPEAIFSNVYTFRDPNKNMTFESCTSYPVSKKLLQEIHSLLCFLVFYIIPLSIISVYYSLIARTLYKSTLNIPTEEQSHARKQIESRKRIARTVLVLVALFALCWLPNHLLYLYHSFTSQTYVDPSAMHFIFTIFSRVLAFSNSCVNPFALYWLSKSFQKHFKAQLFCCKAERPEPPVADTSLTTLAVMGTVPGTGSIQMSEISVTSFTGCSVKQAEDRF
UniProt	P32247
Protein Data Bank	N/A
GPCR-HGmod model	P32247
3D structure model	This predicted structure model is from GPCR-EXP P32247.
BioLiP	N/A
Therapeutic Target Database	T68887
ChEMBL	CHEMBL4080
IUPHAR	40
DrugBank	N/A

Ligand

Name	CHEMBL1672353
Molecular formula	C20H26N4O
IUPAC name	1-[5-(2,2-dimethylpropyl)-1H-imidazol-2-yl]-2-(4-pyrazol-1-ylphenyl)propan-2-ol
Molecular weight	338.455
Hydrogen bond acceptor	3
Hydrogen bond donor	2
XlogP	3.4
Synonyms	BDBM50336887 SCHEMBL3500939 1-[4-(2,2-dimethylpropyl)-1h-imidazol-2-yl]-2-[4-(1h-pyrazol-1-yl)phenyl]propan-2-ol
Inchi Key	DLQVEFMBHFLTJU-UHFFFAOYSA-N
Inchi ID	InChI=1S/C20H26N4O/c1-19(2,3)12-16-14-21-18(23-16)13-20(4,25)15-6-8-17(9-7-15)24-11-5-10-22-24/h5-11,14,25H,12-13H2,1-4H3,(H,21,23)
PubChem CID	25026446
ChEMBL	CHEMBL1672353
IUPHAR	N/A
BindingDB	50336887
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	16.0 nM	PMID24900253	BindingDB,ChEMBL
Emax	94.0 %	PMID24900253	ChEMBL
IC50	5.0 nM	PMID24900253	BindingDB,ChEMBL

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