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Name | P2Y purinoceptor 12 |
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Species | Rattus norvegicus (Rat) |
Gene | P2ry12 |
Synonym | purinergic receptor P2Y P2YADP P2Y12 receptor P2Y12 platelet ADP receptor P2Y12 [ Show all ] |
Disease | N/A for non-human GPCRs |
Length | 343 |
Amino acid sequence | MEVPGANATSANTTSIPGTSTLCSRDYKITQVLFPLLYTVLFFAGLITNSLAMRIFFQIRSKSNFIIFLKNTVISDLLMILTFPFKILSDAKLGAGHLRTLVCQVTSVTFYFTMYISISFLGLITIDRYLKTTRPFKTSSPSNLLGAKILSVAIWAFMFLLSLPNMILTNRRPKDKDITKCSFLKSEFGLVWHEIVNYICQVIFWINFLIVIVCYSLITKELYRSYVRTRGSAKAPKKRVNIKVFIIIAVFFICFVPFHFARIPYTLSQTRAVFDCNAENTLFYVKESTLWLTSLNACLDPFIYFFLCKSFRNSLMSMLRCSTSGANKKKGQEGGDPSEETPM |
UniProt | Q9EPX4 |
Protein Data Bank | N/A |
GPCR-HGmod model | N/A |
3D structure model | No available structures or models |
BioLiP | N/A |
Therapeutic Target Database | N/A |
ChEMBL | CHEMBL2188 |
IUPHAR | N/A |
DrugBank | N/A |
Name | CHEMBL3098240 |
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Molecular formula | C21H24F2N6O4S |
IUPAC name | (1S,2S,3S,4S)-5-[7-[[(1R,2S)-2-(3,4-difluorophenyl)cyclopropyl]amino]-5-propylsulfanyltriazolo[4,5-d]pyrimidin-3-yl]cyclopentane-1,2,3,4-tetrol |
Molecular weight | 494.518 |
Hydrogen bond acceptor | 12 |
Hydrogen bond donor | 5 |
XlogP | 1.2 |
Synonyms | BDBM50445018 |
Inchi Key | JRAHGLNTLSHYGH-BMCBOHOYSA-N |
Inchi ID | InChI=1S/C21H24F2N6O4S/c1-2-5-34-21-25-19(24-12-7-9(12)8-3-4-10(22)11(23)6-8)13-20(26-21)29(28-27-13)14-15(30)17(32)18(33)16(14)31/h3-4,6,9,12,14-18,30-33H,2,5,7H2,1H3,(H,24,25,26)/t9-,12+,15-,16-,17-,18-/m0/s1 |
PubChem CID | 71607553 |
ChEMBL | CHEMBL3098240 |
IUPHAR | N/A |
BindingDB | 50445018 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has more than 10 hydrogen bond acceptor. |
Parameter | Value | Reference | Database source |
---|---|---|---|
IC50 | 1250.0 nM | PMID24332627 | BindingDB,ChEMBL |
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