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Name | G-protein coupled receptor 55 |
---|---|
Species | Homo sapiens (Human) |
Gene | GPR55 |
Synonym | GPR55 |
Disease | N/A |
Length | 319 |
Amino acid sequence | MSQQNTSGDCLFDGVNELMKTLQFAVHIPTFVLGLLLNLLAIHGFSTFLKNRWPDYAATSIYMINLAVFDLLLVLSLPFKMVLSQVQSPFPSLCTLVECLYFVSMYGSVFTICFISMDRFLAIRYPLLVSHLRSPRKIFGICCTIWVLVWTGSIPIYSFHGKVEKYMCFHNMSDDTWSAKVFFPLEVFGFLLPMGIMGFCCSRSIHILLGRRDHTQDWVQQKACIYSIAASLAVFVVSFLPVHLGFFLQFLVRNSFIVECRAKQSISFFLQLSMCFSNVNCCLDVFCYYFVIKEFRMNIRAHRPSRVQLVLQDTTISRG |
UniProt | Q9Y2T6 |
Protein Data Bank | N/A |
GPCR-HGmod model | Q9Y2T6 |
3D structure model | This predicted structure model is from GPCR-EXP Q9Y2T6. |
BioLiP | N/A |
Therapeutic Target Database | N/A |
ChEMBL | CHEMBL1075322 |
IUPHAR | 109 |
DrugBank | BE0005802 |
Name | CHEMBL3221200 |
---|---|
Molecular formula | C21H19ClN2O2S |
IUPAC name | (2Z)-2-[[3-[(2-chlorophenyl)methoxy]phenyl]methylidene]-5,6,7,8-tetrahydroimidazo[2,1-b][1,3]thiazepin-3-one |
Molecular weight | 398.905 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 0 |
XlogP | 5.0 |
Synonyms | N/A |
Inchi Key | NEHXBXHIBHJACX-UYRXBGFRSA-N |
Inchi ID | InChI=1S/C21H19ClN2O2S/c22-18-9-2-1-7-16(18)14-26-17-8-5-6-15(12-17)13-19-20(25)24-10-3-4-11-27-21(24)23-19/h1-2,5-9,12-13H,3-4,10-11,14H2/b19-13- |
PubChem CID | 90667662 |
ChEMBL | CHEMBL3221200 |
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 |
---|---|---|---|
Activity | 7.0 % | MedChemComm, (2014) 5:5:632 | ChEMBL |
IC50 | 10000.0 nM | MedChemComm, (2014) 5:5:632 | ChEMBL |
Inhibition | 43.0 % | MedChemComm, (2014) 5:5:632 | ChEMBL |
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