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GLASS

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Go to the GPCR, ligand, or experimental data tables.
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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	Abbott-81988
Molecular formula	C23H22N6O2
IUPAC name	2-[propyl-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]amino]pyridine-3-carboxylic acid
Molecular weight	414.469
Hydrogen bond acceptor	7
Hydrogen bond donor	2
XlogP	4.1
Synonyms	2-(N-Propyl-N-((2'-(1H-tetrazol-5-yl)biphenyl-4-yl)methyl)amino)pyridine-3-carboxylic acid A 81988 CHEMBL416477 L007227 2-{Propyl-[2''-(2H-tetrazol-5-yl)-biphenyl-4-ylmethyl]-amino}-nicotinic acid D06MUI [3H]-A81988 BDBM50003154 GTPL3938 2-[propyl-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]amino]pyridine-3-carboxylic acid A-81988 CS-7281 Oprea1_714523 3-Pyridinecarboxylic acid, 2-(propyl((2'-(1H-tetrazol-5-yl)(1,1'-biphenyl)-4-yl)methyl)amino)- AC1L30WD D0XK7K [3H]A81988 141887-34-5 HY-U00188 2-{Propyl-[2''-(1H-tetrazol-5-yl)-biphenyl-4-ylmethyl]-amino}-nicotinic acid A81988 CTK0H8555 SCHEMBL7048946 3-Pyridinecarboxylicacid, 2-[propyl[[2'-(2H-tetrazol-5-yl)[1,1'-biphenyl]-4-yl]methyl]amino]- ACMC-20n0yv DTXSID40161846 [ Show all ]
Inchi Key	DLMNZGAILMQDHA-UHFFFAOYSA-N
Inchi ID	InChI=1S/C23H22N6O2/c1-2-14-29(22-20(23(30)31)8-5-13-24-22)15-16-9-11-17(12-10-16)18-6-3-4-7-19(18)21-25-27-28-26-21/h3-13H,2,14-15H2,1H3,(H,30,31)(H,25,26,27,28)
PubChem CID	132387
ChEMBL	CHEMBL416477
IUPHAR	3938
BindingDB	50003154
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
Kd	0.0501 nM	N/A	BindingDB
Kd	0.05012 nM	Bioorg. Med. Chem. Lett., (1994) 4:1:173	ChEMBL
Kd	0.0794 nM	PMID1433184, PMID21071232	BindingDB
Kd	0.07943 nM	PMID1433184, PMID21071232	ChEMBL

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