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 | SCHEMBL15597046 |
---|---|
Molecular formula | C31H29F2N5O3S |
IUPAC name | 1-[2-[4-(2-tert-butyl-1,3-oxazol-4-yl)-5-fluoro-7-hydroxy-3,3-dimethyl-2H-indol-1-yl]phenyl]-3-(6-fluoro-1,3-benzothiazol-2-yl)urea |
Molecular weight | 589.662 |
Hydrogen bond acceptor | 9 |
Hydrogen bond donor | 3 |
XlogP | 7.5 |
Synonyms | US9540323, 254 |
Inchi Key | BRHYZZPVWGYGKV-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C31H29F2N5O3S/c1-30(2,3)27-34-20(14-41-27)24-17(33)13-22(39)26-25(24)31(4,5)15-38(26)21-9-7-6-8-18(21)35-28(40)37-29-36-19-11-10-16(32)12-23(19)42-29/h6-14,39H,15H2,1-5H3,(H2,35,36,37,40) |
PubChem CID | 90063045 |
ChEMBL | N/A |
IUPHAR | N/A |
BindingDB | 261033 |
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 | 13.7 nM | N/A | BindingDB |
Ki | 14.0 nM | N/A | BindingDB |
zhanglabzhanggroup.org | +65-6601-1241 | Computing 1, 13 Computing Drive, Singapore 117417