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Name | Neurotensin receptor type 1 |
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Species | Homo sapiens (Human) |
Gene | NTSR1 |
Synonym | NTSR1 NTS1 receptor NTRH NTR1 NTR [ 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 |
Name | MLS000109200 |
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Molecular formula | C21H24N2O6S |
IUPAC name | ethyl 4-[(4-methyl-3-morpholin-4-ylsulfonylbenzoyl)amino]benzoate |
Molecular weight | 432.491 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 1 |
XlogP | 2.1 |
Synonyms | AC1LLBXY ethyl 4-[(4-methyl-3-morpholin-4-ylsulfonylbenzoyl)amino]benzoate SCHEMBL13532180 BDBM79523 MolPort-001-895-598 [ Show all ] |
Inchi Key | CJIYULUIIQBLAZ-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C21H24N2O6S/c1-3-29-21(25)16-6-8-18(9-7-16)22-20(24)17-5-4-15(2)19(14-17)30(26,27)23-10-12-28-13-11-23/h4-9,14H,3,10-13H2,1-2H3,(H,22,24) |
PubChem CID | 1081942 |
ChEMBL | CHEMBL1390986 |
IUPHAR | N/A |
BindingDB | 79523 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
EC50 | 17300.0 nM | , PubChem BioAssay data set | BindingDB,ChEMBL |
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