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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 | MLS001017764 |
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Molecular formula | C24H19N3O4S |
IUPAC name | [2-oxo-2-(2-phenylsulfanylanilino)ethyl] 4-[(2-cyanoacetyl)amino]benzoate |
Molecular weight | 445.493 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 2 |
XlogP | 4.4 |
Synonyms | Z18636765 4-[(2-cyanoacetyl)amino]benzoic acid [2-keto-2-[2-(phenylthio)anilino]ethyl] ester CHEMBL1302969 HMS3364A04 [2-oxo-2-(2-phenylsulfanylanilino)ethyl] 4-[(2-cyanoacetyl)amino]benzoate [ Show all ] |
Inchi Key | BKZKGGRNJUJESN-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C24H19N3O4S/c25-15-14-22(28)26-18-12-10-17(11-13-18)24(30)31-16-23(29)27-20-8-4-5-9-21(20)32-19-6-2-1-3-7-19/h1-13H,14,16H2,(H,26,28)(H,27,29) |
PubChem CID | 2400177 |
ChEMBL | CHEMBL1302969 |
IUPHAR | N/A |
BindingDB | 61544 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
IC50 | 2169.76 nM | PubChem BioAssay data set | ChEMBL |
IC50 | 2169.76 nM | N/A | BindingDB |
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