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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	LEVISOPRENALINE
Molecular formula	C11H17NO3
IUPAC name	4-[(1R)-1-hydroxy-2-(propan-2-ylamino)ethyl]benzene-1,2-diol
Molecular weight	211.261
Hydrogen bond acceptor	4
Hydrogen bond donor	4
XlogP	-0.6
Synonyms	Isoproterenol, L- Levisoprenalina [INN-Spanish] Lopac0_000672 PDSP1_001116 ZINC56652 (R)-(-)-Isoproterenol, crystalline 4-[(1R)-1-hydroxy-2-(propan-2-ylamino)ethyl]benzene-1,2-diol AC1Q1Q9T C11703 CHEBI:6257 l-Isopropylnoradrenaline Levisoprenalinum NCGC00015558-03 Proternol L (-)-Isoprenaline 1,2-Benzenediol, 4-((1R)-1-hydroxy-2-((1-methylethyl)amino)ethyl)- 588N0603CT Benzyl alcohol, 3,4-dihydroxy-alpha-((isopropylamin)methyl)-, (-)- DTXSID2043878 Levisoprenalin Lopac-I-5627 NCGC00016665-04 UNII-588N0603CT (-)-N-Isopropylnoradrenaline 137-95-1 AC1L9EJH BRN 3203136 CAS-5984-95-2 L-(-)-Isoproterenol NCGC00015558-01 PDSP2_001100 (R)-Isoprenaline ACM51310 L-Isopropylnorepinephrine Levisoprenalinum [INN-Latin] NCGC00016665-01 SCHEMBL250806 (-)-Isoproterenol 1,2-Benzenediol, 4-(1-hydroxy-2-((1-methylethyl)amino)ethyl)-, (R)- 5FW Benzyl alcohol, 3,4-dihydroxy-alpha-((isopropylamino)methyl)-, (-)- Isopropyl norepinephrine Levisoprenalina Lopac-I-6504 NCGC00025274-01 UNII-L628TT009W component JWZZKOKVBUJMES-NSHDSACASA-N (R)-(-)-Isoproterenol 4-[(1R)-1-hydroxy-2-(isopropylamino)ethyl]benzene-1,2-diol AC1Q1Q9S BSPBio_001174 CCG-204758 l-Isoprenaline Levisoprenaline [INN:DCF] NCGC00015558-02 Prestwick3_001097 (-)-alpha-(Isopropylaminomethyl)protocatechuyl alcohol (R)-Isoproterenol 51-31-0 BDBM50407517 CHEMBL1160723 l-Isoproterenol Levoisoproterenol NCGC00016665-03 Tocris-1747 (-)-Isoproterenol hydrochloride 110537-43-4 AB00514693 BPBio1_001292 [ Show all ]
Inchi Key	JWZZKOKVBUJMES-NSHDSACASA-N
Inchi ID	InChI=1S/C11H17NO3/c1-7(2)12-6-11(15)8-3-4-9(13)10(14)5-8/h3-5,7,11-15H,6H2,1-2H3/t11-/m0/s1
PubChem CID	443372
ChEMBL	CHEMBL1160723
IUPHAR	N/A
BindingDB	50407517
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	63.1 nM	PubChem BioAssay data set	ChEMBL
Potency	199.5 nM	PubChem BioAssay data set	ChEMBL
Potency	316.2 nM	PubChem BioAssay data set	ChEMBL

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