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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.
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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	UPCMLD08ADHK001121
Molecular formula	C26H26F4N2O2
IUPAC name	1-benzoyl-N-[[3-fluoro-5-(trifluoromethyl)phenyl]methyl]-2-methyl-1-azaspiro[4.5]dec-3-ene-2-carboxamide
Molecular weight	474.5
Hydrogen bond acceptor	6
Hydrogen bond donor	1
XlogP	5.4
Synonyms	CMLD4_000598 MLS000563564 SDCCGMLS-0091318.P001 HMS2205I16 4-benzoyl-N-[[3-fluoro-5-(trifluoromethyl)phenyl]methyl]-3-methyl-4-azaspiro[4.5]dec-1-ene-3-carboxamide MLS003180920 CHEMBL1334016 SMR000389117 HMS3358J22 AC1NUS8D NCGC00092239-01 [ Show all ]
Inchi Key	ABSNQHHXHGUWOE-UHFFFAOYSA-N
Inchi ID	InChI=1S/C26H26F4N2O2/c1-24(23(34)31-17-18-14-20(26(28,29)30)16-21(27)15-18)12-13-25(10-6-3-7-11-25)32(24)22(33)19-8-4-2-5-9-19/h2,4-5,8-9,12-16H,3,6-7,10-11,17H2,1H3,(H,31,34)
PubChem CID	5459723
ChEMBL	CHEMBL1334016
IUPHAR	N/A
BindingDB	N/A
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
Potency	89125.1 nM	PubChem BioAssay data set	ChEMBL

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