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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	Thyrotropin receptor
Species	Homo sapiens (Human)
Gene	TSHR
Synonym	LGR3 Thyroid-stimulating hormone receptor Thyrotropin Receptor TSH receptor TSH-R
Disease	Thyroid cancer diagnosis Diagnostic test to differentiate primary and secondary hypothyroidism Thyroid cancer
Length	764
Amino acid sequence	MRPADLLQLVLLLDLPRDLGGMGCSSPPCECHQEEDFRVTCKDIQRIPSLPPSTQTLKLIETHLRTIPSHAFSNLPNISRIYVSIDVTLQQLESHSFYNLSKVTHIEIRNTRNLTYIDPDALKELPLLKFLGIFNTGLKMFPDLTKVYSTDIFFILEITDNPYMTSIPVNAFQGLCNETLTLKLYNNGFTSVQGYAFNGTKLDAVYLNKNKYLTVIDKDAFGGVYSGPSLLDVSQTSVTALPSKGLEHLKELIARNTWTLKKLPLSLSFLHLTRADLSYPSHCCAFKNQKKIRGILESLMCNESSMQSLRQRKSVNALNSPLHQEYEENLGDSIVGYKEKSKFQDTHNNAHYYVFFEEQEDEIIGFGQELKNPQEETLQAFDSHYDYTICGDSEDMVCTPKSDEFNPCEDIMGYKFLRIVVWFVSLLALLGNVFVLLILLTSHYKLNVPRFLMCNLAFADFCMGMYLLLIASVDLYTHSEYYNHAIDWQTGPGCNTAGFFTVFASELSVYTLTVITLERWYAITFAMRLDRKIRLRHACAIMVGGWVCCFLLALLPLVGISSYAKVSICLPMDTETPLALAYIVFVLTLNIVAFVIVCCCYVKIYITVRNPQYNPGDKDTKIAKRMAVLIFTDFICMAPISFYALSAILNKPLITVSNSKILLVLFYPLNSCANPFLYAIFTKAFQRDVFILLSKFGICKRQAQAYRGQRVPPKNSTDIQVQKVTHDMRQGLHNMEDVYELIENSHLTPKKQGQISEEYMQTVL
UniProt	P16473
Protein Data Bank	N/A
GPCR-HGmod model	N/A
3D structure model	No available structures or models
BioLiP	N/A
Therapeutic Target Database	T60606
ChEMBL	CHEMBL1963
IUPHAR	255
DrugBank	N/A

Ligand

Name	luzindole
Molecular formula	C19H20N2O
IUPAC name	N-[2-(2-benzyl-1H-indol-3-yl)ethyl]acetamide
Molecular weight	292.382
Hydrogen bond acceptor	1
Hydrogen bond donor	2
XlogP	3.6
Synonyms	CTK8E7069 L0316 N-Acetyl-2-benzyl-tryptamine PDSP1_001788 TRA0042414 BDBM85065 GTPL1363 MFCD00672498 N-[2-[2-(Phenylmethyl)-1H-indol-3-yl]ethyl]acetamide SCHEMBL4869000 AKOS024458674 CAS_117946-91-5 KS-00001828 N-(2-(2-benzyl-1H-indol-3-yl)ethyl)acetamide NCGC00024838-02 ST50405851 2-Benzyl-N-acetyltryptamine AN-25006 DTXSID40151969 N-Acetyl-2-benzyltryptamine PDSP2_001771 ZB000552 AC1L3U3V BN0311 CHEBI:131788 HMS3266N04 MolPort-003-848-430 N-{2-[2-benzylindol-3-yl]ethyl}acetamide SR-01000597433 117946-91-5 AM20020263 CHEMBL286615 L000360 N-0774 NSC_122162 Tocris-0877 7354AH B6483 FT-0628053 Luzindole, >=90% N-[2-(2-benzyl-1H-indol-3-yl)ethyl]acetamide RT-013606 ZINC3941 Acetamide, N-(2-(2-(phenylmethyl)-1H-indol-3-yl)ethyl)- BRD-K67013324-001-01-5 CHEBI:93173 J-003685 N 0774 NCGC00024838-01 SR-01000597433-1 AMOT0032 [ Show all ]
Inchi Key	WVVXBPKOIZGVNS-UHFFFAOYSA-N
Inchi ID	InChI=1S/C19H20N2O/c1-14(22)20-12-11-17-16-9-5-6-10-18(16)21-19(17)13-15-7-3-2-4-8-15/h2-10,21H,11-13H2,1H3,(H,20,22)
PubChem CID	122162
ChEMBL	CHEMBL286615
IUPHAR	1363
BindingDB	85065
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	39810.7 nM	PubChem BioAssay data set	ChEMBL

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