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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.
Go to the ligand page and check other GPCRs which it interacts with.
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GPCR

Name	Type-1B angiotensin II receptor
Species	Rattus norvegicus (Rat)
Gene	Agtr1b
Synonym	Angiotensin II type-1B receptor AT1B AT3
Disease	N/A for non-human GPCRs
Length	359
Amino acid sequence	MTLNSSTEDGIKRIQDDCPKAGRHNYIFVMIPTLYSIIFVVGIFGNSLVVIVIYFYMKLKTVASVFLLNLALADLCFLLTLPLWAVYTAMEYRWPFGNHLCKIASASVSFNLYASVFLLTCLSIDRYLAIVHPMKSRLRRTMLVAKVTCIIIWLMAGLASLPAVIYRNVYFIENTNITVCAFHYESQNSTLPIGLGLTKNILGFVFPFLIILTSYTLIWKALKKAYKIQKNTPRNDDIFRIIMAIVLFFFFSWVPHQIFTFLDVLIQLGIIRDCEIADIVDTAMPITICIAYFNNCLNPLFYGFLGKKFKKYFLQLLKYIPPTAKSHAGLSTKMSTLSYRPSDNMSSSAKKSASFFEVE
UniProt	P29089
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	CHEMBL263
IUPHAR	N/A
DrugBank	N/A

Ligand

Name	UNII-A9T9WVAH03
Molecular formula	C27H26N2O4S
IUPAC name	4-[[2-butyl-5-[(E)-2-carboxy-3-thiophen-2-ylprop-1-enyl]imidazol-1-yl]methyl]naphthalene-1-carboxylic acid
Molecular weight	474.575
Hydrogen bond acceptor	6
Hydrogen bond donor	2
XlogP	5.8
Synonyms	a-((2-Butyl-1-((4-carboxynaphthyl)methyl)-1H-imidazole-5-yl)methylene)-2-thiophenepropanoic acid 4-[2-Butyl-5-((E)-2-carboxy-3-thiophen-2-yl-propenyl)-imidazol-1-ylmethyl]-naphthalene-1-carboxylic acid SCHEMBL6637138 A9T9WVAH03 144143-97-5 CHEMBL97533 SCHEMBL6639612 BDBM50282362 2-Thiophenepropanoic acid, alpha-((2-butyl-1-((4-carboxy-1-naphthalenyl)methyl)-1H-imidazol-5-yl)methylene)-, (E)- SB-203220 [ Show all ]
Inchi Key	FDCUUQDMGDDHFO-XMHGGMMESA-N
Inchi ID	InChI=1S/C27H26N2O4S/c1-2-3-10-25-28-16-20(14-19(26(30)31)15-21-7-6-13-34-21)29(25)17-18-11-12-24(27(32)33)23-9-5-4-8-22(18)23/h4-9,11-14,16H,2-3,10,15,17H2,1H3,(H,30,31)(H,32,33)/b19-14+
PubChem CID	9869504
ChEMBL	CHEMBL97533
IUPHAR	N/A
BindingDB	50282362
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has a partition coefficient log P greater than 5.

Experimental Data

Parameter	Value	Reference	Database source
IC50	11.8 nM	Bioorg. Med. Chem. Lett., (1994) 4:1:23	ChEMBL
IC50	12.0 nM	N/A	BindingDB

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