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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	4-chloro-1-ethyl-3-nitroquinolin-2(1H)-one
Molecular formula	C11H9ClN2O3
IUPAC name	4-chloro-1-ethyl-3-nitroquinolin-2-one
Molecular weight	252.654
Hydrogen bond acceptor	3
Hydrogen bond donor	0
XlogP	2.3
Synonyms	Cambridge id 6904460 MLS003370524 ST4100788 4-chloro-1-ethyl-3-nitro-1,2-dihydroquinolin-2-one AKOS000561603 CHEMBL1342053 Oprea1_142442 ZINC306418 4-chloro-1-ethyl-3-nitro-carbostyril 4-chloro-1-ethyl-3-nitroquinolin-2-one BRD-K08463963-001-08-5 MCULE-5629981413 SR-01000246066-1 A3391/0143850 CHEBI:92146 MolPort-000-434-905 STK104488 4-Chloro-1-ethyl-3-nitro-1H-quinolin-2-one BAS 08139291 cid_800048 SMR000290991 4-chloro-1-ethyl-3-nitrohydroquinolin-2-one 433310-26-0 BRD-K08463963-001-10-1 MLS000718723 SR-01000246066-3 4-chloranyl-1-ethyl-3-nitro-quinolin-2-one AC1LFAW6 Oprea1_018714 Z57455247 4-chloro-1-ethyl-3-nitro-2-quinolinone BDBM67266 HMS2703O21 SR-01000246066 [ Show all ]
Inchi Key	FIUNXRLMZHVJPJ-UHFFFAOYSA-N
Inchi ID	InChI=1S/C11H9ClN2O3/c1-2-13-8-6-4-3-5-7(8)9(12)10(11(13)15)14(16)17/h3-6H,2H2,1H3
PubChem CID	800048
ChEMBL	CHEMBL1342053
IUPHAR	N/A
BindingDB	67266
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	10000.0 nM	PubChem BioAssay data set	ChEMBL

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