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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	Parathyroid hormone/parathyroid hormone-related peptide receptor
Species	Homo sapiens (Human)
Gene	PTH1R
Synonym	PTH1 receptor PTHR PTH/PTHrP type I receptor PTH/PTHr receptor PPR Parathyroid hormone 1 receptor PTHR1 [ Show all ]
Disease	N/A
Length	593
Amino acid sequence	MGTARIAPGLALLLCCPVLSSAYALVDADDVMTKEEQIFLLHRAQAQCEKRLKEVLQRPASIMESDKGWTSASTSGKPRKDKASGKLYPESEEDKEAPTGSRYRGRPCLPEWDHILCWPLGAPGEVVAVPCPDYIYDFNHKGHAYRRCDRNGSWELVPGHNRTWANYSECVKFLTNETREREVFDRLGMIYTVGYSVSLASLTVAVLILAYFRRLHCTRNYIHMHLFLSFMLRAVSIFVKDAVLYSGATLDEAERLTEEELRAIAQAPPPPATAAAGYAGCRVAVTFFLYFLATNYYWILVEGLYLHSLIFMAFFSEKKYLWGFTVFGWGLPAVFVAVWVSVRATLANTGCWDLSSGNKKWIIQVPILASIVLNFILFINIVRVLATKLRETNAGRCDTRQQYRKLLKSTLVLMPLFGVHYIVFMATPYTEVSGTLWQVQMHYEMLFNSFQGFFVAIIYCFCNGEVQAEIKKSWSRWTLALDFKRKARSGSSSYSYGPMVSHTSVTNVGPRVGLGLPLSPRLLPTATTNGHPQLPGHAKPGTPALETLETTPPAMAAPKDDGFLNGSCSGLDEEASGPERPPALLQEEWETVM
UniProt	Q03431
Protein Data Bank	6fj3, 3h3g, 3c4m
GPCR-HGmod model	N/A
3D structure model	This structure is from PDB ID 6fj3.
BioLiP	BL0161387, BL0433539,BL0433540, BL0161388, BL0143680,BL0143682, BL0143681,BL0143683
Therapeutic Target Database	N/A
ChEMBL	CHEMBL1793
IUPHAR	N/A
DrugBank	N/A

Ligand

Name	CHEMBL118595
Molecular formula	C23H20N2O2
IUPAC name	N-[3-(3,4-dihydro-2H-quinoline-1-carbonyl)phenyl]benzamide
Molecular weight	356.425
Hydrogen bond acceptor	2
Hydrogen bond donor	1
XlogP	4.2
Synonyms	N~1~-{3-[3,4-dihydro-1(2H)-quinolinylcarbonyl]phenyl}benzamide MLS001183905 ST50631373 N-[3-(3,4-dihydro-2H-quinoline-1-carbonyl)phenyl]benzamide BDBM50052905 HMS2840F12 phenyl-N-[3-(1,2,3,4-tetrahydroquinolylcarbonyl)phenyl]carboxamide MolPort-001-634-755 STK117611 AC1LPI1B N-[3-(3,4-dihydroquinolin-1(2H)-ylcarbonyl)phenyl]benzamide MCULE-1057599461 SMR000502306 N-[3-(3,4-Dihydro-2H-quinoline-1-carbonyl)-phenyl]-benzamide ZINC1132687 AKOS003299477 [ Show all ]
Inchi Key	FMHUWDDFCIGSCN-UHFFFAOYSA-N
Inchi ID	InChI=1S/C23H20N2O2/c26-22(18-9-2-1-3-10-18)24-20-13-6-11-19(16-20)23(27)25-15-7-12-17-8-4-5-14-21(17)25/h1-6,8-11,13-14,16H,7,12,15H2,(H,24,26)
PubChem CID	1307424
ChEMBL	CHEMBL118595
IUPHAR	N/A
BindingDB	50052905
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
Potency	100000.0 nM	PubChem BioAssay data set	ChEMBL

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