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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.
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GPCR

Name	Neurotensin receptor type 1
Species	Homo sapiens (Human)
Gene	NTSR1
Synonym	NTSR1 NTS1 receptor NTRH NTR1 NTR NT-R-1 NT-1R neurotensin receptor type 1 neurotensin receptor 1 (high affinity) Levocabastin-insensitive neurotensin receptor High-affinity levocabastine-insensitive neurotensin receptor [ Show all ]
Disease	Acute or chronic pain Alcohol use disorders Pain Inflammatory bowel disease Neurological disease
Length	418
Amino acid sequence	MRLNSSAPGTPGTPAADPFQRAQAGLEEALLAPGFGNASGNASERVLAAPSSELDVNTDIYSKVLVTAVYLALFVVGTVGNTVTAFTLARKKSLQSLQSTVHYHLGSLALSDLLTLLLAMPVELYNFIWVHHPWAFGDAGCRGYYFLRDACTYATALNVASLSVERYLAICHPFKAKTLMSRSRTKKFISAIWLASALLAVPMLFTMGEQNRSADGQHAGGLVCTPTIHTATVKVVIQVNTFMSFIFPMVVISVLNTIIANKLTVMVRQAAEQGQVCTVGGEHSTFSMAIEPGRVQALRHGVRVLRAVVIAFVVCWLPYHVRRLMFCYISDEQWTPFLYDFYHYFYMVTNALFYVSSTINPILYNLVSANFRHIFLATLACLCPVWRRRRKRPAFSRKADSVSSNHTLSSNATRETLY
UniProt	P30989
Protein Data Bank	N/A
GPCR-HGmod model	P30989
3D structure model	This predicted structure model is from GPCR-EXP P30989.
BioLiP	N/A
Therapeutic Target Database	T02728
ChEMBL	CHEMBL4123
IUPHAR	309
DrugBank	N/A

Ligand

Name	SMR000221222
Molecular formula	C34H29N3O3
IUPAC name	None
Molecular weight	527.624
Hydrogen bond acceptor	4
Hydrogen bond donor	2
XlogP	4.9
Synonyms	AC1NL2K7 MLS000331108 1005072-60-5 HMS2568C12 AKOS032395645 MLS003904059 CHEMBL1461508 MCULE-2488468941 BDBM79541 MolPort-002-645-906 cid_4898241 [ Show all ]
Inchi Key	DEXFPUZLJYSAEO-UHFFFAOYSA-N
Inchi ID	InChI=1S/C34H29N3O3/c1-2-20-13-16-27-25(18-20)34(32(40)36-27)33(24-10-5-6-11-26(24)35-31(33)39)29(28-12-7-17-37(28)34)30(38)23-15-14-21-8-3-4-9-22(21)19-23/h3-6,8-11,13-16,18-19,28-29H,2,7,12,17H2,1H3,(H,35,39)(H,36,40)
PubChem CID	4898241
ChEMBL	CHEMBL1461508
IUPHAR	N/A
BindingDB	79541
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons.

Experimental Data

Parameter	Value	Reference	Database source
EC50	9780.0 nM	, PubChem BioAssay data set	BindingDB,ChEMBL

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