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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 | TCMDC-123910 |
---|---|
Molecular formula | C25H26N4O3 |
IUPAC name | 5-[(1,3-benzodioxol-5-ylmethylamino)methyl]-3-tert-butyl-1-phenyl-7H-pyrazolo[3,4-b]pyridin-6-one |
Molecular weight | 430.508 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 2 |
XlogP | 4.6 |
Synonyms | AC1LT2IS MLS000067286 CHEBI:117021 5-{[(Benzo[1,3]dioxol-5-ylmethyl)-amino]-methyl}-3-tert-butyl-1-phenyl-1,7-dihydro-pyrazolo[3,4-b]pyridin-6-one cid_1449937 [ Show all ] |
Inchi Key | BFNFGKQFSSNIEE-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C25H26N4O3/c1-25(2,3)22-19-12-17(14-26-13-16-9-10-20-21(11-16)32-15-31-20)24(30)27-23(19)29(28-22)18-7-5-4-6-8-18/h4-12,26H,13-15H2,1-3H3,(H,27,30) |
PubChem CID | 135417938 |
ChEMBL | CHEMBL528068 |
IUPHAR | N/A |
BindingDB | 61425 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
IC50 | 2670.91 nM | N/A | BindingDB |
IC50 | 2670.91 nM | PubChem BioAssay data set | ChEMBL |
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