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Name | Kappa-type opioid receptor |
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Species | Homo sapiens (Human) |
Gene | OPRK1 |
Synonym | K-OR-1 KOPr OP2 KOP KOR-1 [ Show all ] |
Disease | Obesity Opiate dependence Inflammatory bowel disease Erythema Diarrhea-predominant IBS [ Show all ] |
Length | 380 |
Amino acid sequence | MDSPIQIFRGEPGPTCAPSACLPPNSSAWFPGWAEPDSNGSAGSEDAQLEPAHISPAIPVIITAVYSVVFVVGLVGNSLVMFVIIRYTKMKTATNIYIFNLALADALVTTTMPFQSTVYLMNSWPFGDVLCKIVISIDYYNMFTSIFTLTMMSVDRYIAVCHPVKALDFRTPLKAKIINICIWLLSSSVGISAIVLGGTKVREDVDVIECSLQFPDDDYSWWDLFMKICVFIFAFVIPVLIIIVCYTLMILRLKSVRLLSGSREKDRNLRRITRLVLVVVAVFVVCWTPIHIFILVEALGSTSHSTAALSSYYFCIALGYTNSSLNPILYAFLDENFKRCFRDFCFPLKMRMERQSTSRVRNTVQDPAYLRDIDGMNKPV |
UniProt | P41145 |
Protein Data Bank | 6b73, 4djh |
GPCR-HGmod model | P41145 |
3D structure model | This structure is from PDB ID 6b73. |
BioLiP | BL0402244,BL0402246, BL0224693,BL0224694, BL0402243,BL0402245 |
Therapeutic Target Database | T60693 |
ChEMBL | CHEMBL237 |
IUPHAR | 318 |
DrugBank | BE0000632 |
Name | 3-(5,6-dimethyl-1,3-benzothiazol-2-yl)-2-thioxoimidazolidin-4-one |
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Molecular formula | C12H11N3OS2 |
IUPAC name | 3-(5,6-dimethyl-1,3-benzothiazol-2-yl)-2-sulfanylideneimidazolidin-4-one |
Molecular weight | 277.36 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 1 |
XlogP | 2.8 |
Synonyms | CHEMBL1463088 STL361210 AKOS001662475 MCULE-9217624193 497249-13-5 [ Show all ] |
Inchi Key | BFZZHFNBZUIYAN-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C12H11N3OS2/c1-6-3-8-9(4-7(6)2)18-12(14-8)15-10(16)5-13-11(15)17/h3-4H,5H2,1-2H3,(H,13,17) |
PubChem CID | 2179291 |
ChEMBL | CHEMBL1463088 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
IC50 | <32000.0 nM | PubChem BioAssay data set | ChEMBL |
IC50 | 8550.0 nM | PubChem BioAssay data set | ChEMBL |
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