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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	MLS000709291
Molecular formula	C17H25N5O3
IUPAC name	N-[(E)-1-(4-hexoxy-3-nitrophenyl)ethylideneamino]-4,5-dihydro-1H-imidazol-2-amine
Molecular weight	347.419
Hydrogen bond acceptor	5
Hydrogen bond donor	2
XlogP	3.0
Synonyms	[(1E)-2-(4-hexyloxy-3-nitrophenyl)-1-azaprop-1-enyl]-2-imidazolin-2-ylamine BAS 00297129 N-[1-(4-hexoxy-3-nitrophenyl)ethylideneamino]-4,5-dihydro-1H-imidazol-2-amine CHEMBL3207463 SR-01000367424-1 [1-(4-hexoxy-3-nitro-phenyl)ethylideneamino]-(2-imidazolin-2-yl)amine MolPort-019-766-111 BDBM51841 SMR000289958 cid_3098372 ST50221950 AKOS000506246 N-[1-(4-hexoxy-3-nitro-phenyl)ethylideneamino]-4,5-dihydro-1H-imidazol-2-amine SR-01000367424 [ Show all ]
Inchi Key	AKJVZFLOSQWOMV-DEDYPNTBSA-N
Inchi ID	InChI=1S/C17H25N5O3/c1-3-4-5-6-11-25-16-8-7-14(12-15(16)22(23)24)13(2)20-21-17-18-9-10-19-17/h7-8,12H,3-6,9-11H2,1-2H3,(H2,18,19,21)/b20-13+
PubChem CID	9590748
ChEMBL	CHEMBL3207463
IUPHAR	N/A
BindingDB	N/A
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
EC50	18900.0 nM	PubChem BioAssay data set	ChEMBL

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