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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	MLS000535841
Molecular formula	C21H15ClN2O3S2
IUPAC name	(NE)-N-[3-(5-chloro-2-methylanilino)-4-oxonaphthalen-1-ylidene]thiophene-2-sulfonamide
Molecular weight	442.932
Hydrogen bond acceptor	6
Hydrogen bond donor	1
XlogP	5.6
Synonyms	(NE)-N-[3-(5-chloro-2-methylanilino)-4-oxo-1-naphthalenylidene]-2-thiophenesulfonamide HMS3091O05 BDBM41036 SMR000151319 cid_11834461 (NE)-N-[3-(5-chloro-2-methylanilino)-4-oxonaphthalen-1-ylidene]thiophene-2-sulfonamide SMR001544598 (NE)-N-[3-(5-chloro-2-methyl-anilino)-4-keto-1-naphthylidene]thiophene-2-sulfonamide HMS2400G07 (NE)-N-[3-[(5-chloranyl-2-methyl-phenyl)amino]-4-oxidanylidene-naphthalen-1-ylidene]thiophene-2-sulfonamide MLS002636663 CHEMBL2006503 [ Show all ]
Inchi Key	BGOWMRGDUSUEFJ-HKOYGPOVSA-N
Inchi ID	InChI=1S/C21H15ClN2O3S2/c1-13-8-9-14(22)11-17(13)23-19-12-18(15-5-2-3-6-16(15)21(19)25)24-29(26,27)20-7-4-10-28-20/h2-12,23H,1H3/b24-18+
PubChem CID	11834461
ChEMBL	CHEMBL2006503
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	10000.0 nM	PubChem BioAssay data set	ChEMBL

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