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GLASS

You can:

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	Type-1 angiotensin II receptor
Species	Oryctolagus cuniculus (Rabbit)
Gene	AGTR1
Synonym	Angiotensin II type-1 receptor AT1
Disease	N/A for non-human GPCRs
Length	359
Amino acid sequence	MMLNSSTEDGIKRIQDDCPKAGRHNYIFVMIPTLYSIIFVVGIFGNSLAVIVIYFYMKLKTVASVFLLNLALADLCFLLTLPLWAVYTAMEYRWPFGNYLCKIASASVSFNLYASVFLLTCLSIDRYLAIVHPMKSRLRRTMLVAKVTCIIIWLLAGLASLPAIIHRNVFFIENTNITVCAFHYESQNSTLPIGLGLTKNILGFLFPFLIILTSYTLIWKALKKAYEIQKNKPRNDDIFKIIMAIVLFFFFSWVPHQIFTFLDVLIQLGVIHDCRIADIVDTAMPITICIAYFNNCLNPLFYGFLGKKFKKYFLQLLKYIPPKAKSHSNLSTKMSTLSYRPSDNVSSSSKKPVPCFEVE
UniProt	P34976
Protein Data Bank	N/A
GPCR-HGmod model	N/A
3D structure model	No available structures or models
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL3948
IUPHAR	N/A
DrugBank	N/A

Ligand

Name	CHEMBL140619
Molecular formula	C37H38ClN5O5S
IUPAC name	N-[2-[4-[[3-butyl-5-oxo-1-[3-(pentanoylamino)phenyl]-1,2,4-triazol-4-yl]methyl]phenyl]phenyl]sulfonyl-2-chlorobenzamide
Molecular weight	700.251
Hydrogen bond acceptor	6
Hydrogen bond donor	2
XlogP	7.2
Synonyms	SCHEMBL9141159 BDBM50035433 5-n-Butyl-4-[[2'-[N-(2-chlorobenzoyl)sulfamoyl]biphenyl-4-yl]methyl]-2,4-dihydro-2-[3-(valerylamino)phenyl]-3H-1,2,4-triazol-3-one BJEMGANDAVKDDB-UHFFFAOYSA-N Pentanoic acid (3-{3-butyl-4-[2''-(2-chloro-benzoylsulfamoyl)-biphenyl-4-ylmethyl]-5-oxo-4,5-dihydro-[1,2,4]triazol-1-yl}-phenyl)-amide
Inchi Key	BJEMGANDAVKDDB-UHFFFAOYSA-N
Inchi ID	InChI=1S/C37H38ClN5O5S/c1-3-5-18-34-40-43(29-13-11-12-28(24-29)39-35(44)19-6-4-2)37(46)42(34)25-26-20-22-27(23-21-26)30-14-8-10-17-33(30)49(47,48)41-36(45)31-15-7-9-16-32(31)38/h7-17,20-24H,3-6,18-19,25H2,1-2H3,(H,39,44)(H,41,45)
PubChem CID	10484866
ChEMBL	CHEMBL140619
IUPHAR	N/A
BindingDB	50035433
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5.

Experimental Data

Parameter	Value	Reference	Database source
IC50	0.9 nM	, PMID7799397	BindingDB
IC50	0.9 nM	Med Chem Res, (2013) None:None:1, PMID7799397	ChEMBL

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