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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.
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GPCR

Name	Growth hormone secretagogue receptor type 1
Species	Homo sapiens (Human)
Gene	GHSR
Synonym	ghrelin receptor GH-releasing peptide receptor GHRP GHS-R growth hormone-releasing peptide receptor ghrelin receptor 1a [ Show all ]
Disease	N/A
Length	366
Amino acid sequence	MWNATPSEEPGFNLTLADLDWDASPGNDSLGDELLQLFPAPLLAGVTATCVALFVVGIAGNLLTMLVVSRFRELRTTTNLYLSSMAFSDLLIFLCMPLDLVRLWQYRPWNFGDLLCKLFQFVSESCTYATVLTITALSVERYFAICFPLRAKVVVTKGRVKLVIFVIWAVAFCSAGPIFVLVGVEHENGTDPWDTNECRPTEFAVRSGLLTVMVWVSSIFFFLPVFCLTVLYSLIGRKLWRRRRGDAVVGASLRDQNHKQTVKMLAVVVFAFILCWLPFHVGRYLFSKSFEPGSLEIAQISQYCNLVSFVLFYLSAAINPILYNIMSKKYRVAVFRLLGFEPFSQRKLSTLKDESSRAWTESSINT
UniProt	Q92847
Protein Data Bank	N/A
GPCR-HGmod model	Q92847
3D structure model	This predicted structure model is from GPCR-EXP Q92847.
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL4616
IUPHAR	246
DrugBank	BE0003383

Ligand

Name	CHEMBL222789
Molecular formula	C33H34BrN7O
IUPAC name	2-amino-N-[(1R)-1-[4-[(4-bromophenyl)methyl]-5-[2-(1H-indol-3-yl)ethyl]-1,2,4-triazol-3-yl]-2-(1H-indol-3-yl)ethyl]-2-methylpropanamide
Molecular weight	624.587
Hydrogen bond acceptor	4
Hydrogen bond donor	4
XlogP	5.0
Synonyms	BDBM50208672 SCHEMBL3631262 (R)-N-(1-(5-(2-(1H-indol-3-yl)ethyl)-4-(4-bromobenzyl)-4H-1,2,4-triazol-3-yl)-2-(1H-indol-3-yl)ethyl)-2-amino-2-methylpropanamide
Inchi Key	ARHSHAJHTRTUQE-GDLZYMKVSA-N
Inchi ID	InChI=1S/C33H34BrN7O/c1-33(2,35)32(42)38-29(17-23-19-37-28-10-6-4-8-26(23)28)31-40-39-30(41(31)20-21-11-14-24(34)15-12-21)16-13-22-18-36-27-9-5-3-7-25(22)27/h3-12,14-15,18-19,29,36-37H,13,16-17,20,35H2,1-2H3,(H,38,42)/t29-/m1/s1
PubChem CID	16113471
ChEMBL	CHEMBL222789
IUPHAR	N/A
BindingDB	50208672
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons.

Experimental Data

Parameter	Value	Reference	Database source
Activity	27.0 %	PMID17375904	ChEMBL
IC50	100.0 nM	PMID17375904	BindingDB,ChEMBL

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