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GLASS

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Go to the GPCR, ligand, or experimental data tables.
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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	ethyl {3-[(3,5-dimethoxybenzoyl)amino]phenyl}carbamate
Molecular formula	C18H20N2O5
IUPAC name	ethyl N-[3-[(3,5-dimethoxybenzoyl)amino]phenyl]carbamate
Molecular weight	344.367
Hydrogen bond acceptor	5
Hydrogen bond donor	2
XlogP	2.6
Synonyms	MLS000064907 BRD-K74840245-001-05-9 SMR000077910 CHEMBL1305554 AC1LJFDI HMS2459N22 MLS002546977 CHEBI:94232 ZINC613864 ethyl N-[3-[(3,5-dimethoxybenzoyl)amino]phenyl]carbamate MCULE-5343198603 AKOS003387323 MolPort-002-094-610 [ Show all ]
Inchi Key	AGJGVJQIJQWBAK-UHFFFAOYSA-N
Inchi ID	InChI=1S/C18H20N2O5/c1-4-25-18(22)20-14-7-5-6-13(10-14)19-17(21)12-8-15(23-2)11-16(9-12)24-3/h5-11H,4H2,1-3H3,(H,19,21)(H,20,22)
PubChem CID	973303
ChEMBL	CHEMBL1305554
IUPHAR	N/A
BindingDB	N/A
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	79432.8 nM	PubChem BioAssay data set	ChEMBL

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