You can:
Name | P2Y purinoceptor 1 |
---|---|
Species | Homo sapiens (Human) |
Gene | P2RY1 |
Synonym | ATP receptor Purinergic receptor P2Y1 purinergic receptor P2Y Purinergic receptor platelet ADP receptor [ Show all ] |
Disease | Thrombosis |
Length | 373 |
Amino acid sequence | MTEVLWPAVPNGTDAAFLAGPGSSWGNSTVASTAAVSSSFKCALTKTGFQFYYLPAVYILVFIIGFLGNSVAIWMFVFHMKPWSGISVYMFNLALADFLYVLTLPALIFYYFNKTDWIFGDAMCKLQRFIFHVNLYGSILFLTCISAHRYSGVVYPLKSLGRLKKKNAICISVLVWLIVVVAISPILFYSGTGVRKNKTITCYDTTSDEYLRSYFIYSMCTTVAMFCVPLVLILGCYGLIVRALIYKDLDNSPLRRKSIYLVIIVLTVFAVSYIPFHVMKTMNLRARLDFQTPAMCAFNDRVYATYQVTRGLASLNSCVDPILYFLAGDTFRRRLSRATRKASRRSEANLQSKSEDMTLNILPEFKQNGDTSL |
UniProt | P47900 |
Protein Data Bank | 4xnv, 4xnw |
GPCR-HGmod model | P47900 |
3D structure model | This structure is from PDB ID 4xnv. |
BioLiP | BL0311594,BL0311596, BL0311593, BL0311590,BL0311591,BL0311592, BL0311589, BL0311588, BL0311595,BL0311597 |
Therapeutic Target Database | T67818 |
ChEMBL | CHEMBL4315 |
IUPHAR | 323 |
DrugBank | N/A |
Name | CHEMBL255454 |
---|---|
Molecular formula | C27H25ClN4O4 |
IUPAC name | 2-[4-[[2-[2-(2-chlorophenyl)-5-methylpyrazol-3-yl]oxyphenyl]carbamoylamino]phenyl]-2-methylpropanoic acid |
Molecular weight | 504.971 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 3 |
XlogP | 5.7 |
Synonyms | 2-[4-(3-{2-[2-(2-Chloro-phenyl)-5-methyl-2H-pyrazol-3-yloxy]-phenyl}-ureido)-phenyl]-2-methyl-propionic acid BIWUWZRQAXMURN-UHFFFAOYSA-N SCHEMBL4915826 BDBM50373297 |
Inchi Key | BIWUWZRQAXMURN-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C27H25ClN4O4/c1-17-16-24(32(31-17)22-10-6-4-8-20(22)28)36-23-11-7-5-9-21(23)30-26(35)29-19-14-12-18(13-15-19)27(2,3)25(33)34/h4-16H,1-3H3,(H,33,34)(H2,29,30,35) |
PubChem CID | 44448870 |
ChEMBL | CHEMBL255454 |
IUPHAR | N/A |
BindingDB | 50373297 |
DrugBank | N/A |
Structure | ![]() |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5. |
Parameter | Value | Reference | Database source |
---|---|---|---|
Ki | <10000.0 nM | PMID18445527 | BindingDB,ChEMBL |
zhanglabzhanggroup.org | +65-6601-1241 | Computing 1, 13 Computing Drive, Singapore 117417