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Name | Probable G-protein coupled receptor 139 |
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Species | Homo sapiens (Human) |
Gene | GPR139 |
Synonym | G(q)-coupled orphan receptor GPRg1 G-protein-coupled receptor PGR3 GPR139 GPRG1 |
Disease | N/A |
Length | 353 |
Amino acid sequence | MEHTHAHLAANSSLSWWSPGSACGLGFVPVVYYSLLLCLGLPANILTVIILSQLVARRQKSSYNYLLALAAADILVLFFIVFVDFLLEDFILNMQMPQVPDKIIEVLEFSSIHTSIWITVPLTIDRYIAVCHPLKYHTVSYPARTRKVIVSVYITCFLTSIPYYWWPNIWTEDYISTSVHHVLIWIHCFTVYLVPCSIFFILNSIIVYKLRRKSNFRLRGYSTGKTTAILFTITSIFATLWAPRIIMILYHLYGAPIQNRWLVHIMSDIANMLALLNTAINFFLYCFISKRFRTMAAATLKAFFKCQKQPVQFYTNHNFSITSSPWISPANSHCIKMLVYQYDKNGKPIKVSP |
UniProt | Q6DWJ6 |
Protein Data Bank | N/A |
GPCR-HGmod model | Q6DWJ6 |
3D structure model | This predicted structure model is from GPCR-EXP Q6DWJ6. |
BioLiP | N/A |
Therapeutic Target Database | N/A |
ChEMBL | CHEMBL3632455 |
IUPHAR | 130 |
DrugBank | N/A |
Name | CHEMBL3633894 |
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Molecular formula | C17H17NO2S |
IUPAC name | S-[2-oxo-2-(1-phenylethylamino)ethyl] benzenecarbothioate |
Molecular weight | 299.388 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 1 |
XlogP | 3.6 |
Synonyms | AC1MEKRZ MolPort-002-159-743 BIM-0026719.P001 ST45097267 2-(phenylcarbonylthio)-N-(phenylethyl)acetamide [ Show all ] |
Inchi Key | NYTPJIOIBBIUIK-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C17H17NO2S/c1-13(14-8-4-2-5-9-14)18-16(19)12-21-17(20)15-10-6-3-7-11-15/h2-11,13H,12H2,1H3,(H,18,19) |
PubChem CID | 2856847 |
ChEMBL | CHEMBL3633894 |
IUPHAR | N/A |
BindingDB | 50131897 |
DrugBank | N/A |
Structure | ![]() |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
EC50 | 670.0 nM | PMID26396690 | BindingDB,ChEMBL |
zhanglabzhanggroup.org | +65-6601-1241 | Computing 1, 13 Computing Drive, Singapore 117417