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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 | CHEMBL3098249 |
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Molecular formula | C24H30F2N6O5S |
IUPAC name | (1S,2S,3R,5S)-3-[7-[[(1R,2S)-2-(3,4-difluorophenyl)cyclopropyl]amino]-5-propylsulfanyltriazolo[4,5-d]pyrimidin-3-yl]-5-(2,3-dihydroxypropoxy)cyclopentane-1,2-diol |
Molecular weight | 552.598 |
Hydrogen bond acceptor | 13 |
Hydrogen bond donor | 5 |
XlogP | 1.4 |
Synonyms | BDBM50445014 SCHEMBL14709154 |
Inchi Key | PDKXOVMOLXKMOG-HRXYOTLZSA-N |
Inchi ID | InChI=1S/C24H30F2N6O5S/c1-2-5-38-24-28-22(27-16-7-13(16)11-3-4-14(25)15(26)6-11)19-23(29-24)32(31-30-19)17-8-18(21(36)20(17)35)37-10-12(34)9-33/h3-4,6,12-13,16-18,20-21,33-36H,2,5,7-10H2,1H3,(H,27,28,29)/t12?,13-,16+,17+,18-,20-,21+/m0/s1 |
PubChem CID | 71264539 |
ChEMBL | CHEMBL3098249 |
IUPHAR | N/A |
BindingDB | 50445014 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has more than 10 hydrogen bond acceptor. This ligand is heavier than 500 daltons. |
Parameter | Value | Reference | Database source |
---|---|---|---|
IC50 | 148.0 nM | PMID24332627 | BindingDB,ChEMBL |
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