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Name | Uracil nucleotide/cysteinyl leukotriene receptor |
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Species | Homo sapiens (Human) |
Gene | GPR17 |
Synonym | GPR17 P2Y-like receptor G-protein coupled receptor 17 R12 UDP/CysLT receptor [ Show all ] |
Disease | N/A |
Length | 367 |
Amino acid sequence | MSKRSWWAGSRKPPREMLKLSGSDSSQSMNGLEVAPPGLITNFSLATAEQCGQETPLENMLFASFYLLDFILALVGNTLALWLFIRDHKSGTPANVFLMHLAVADLSCVLVLPTRLVYHFSGNHWPFGEIACRLTGFLFYLNMYASIYFLTCISADRFLAIVHPVKSLKLRRPLYAHLACAFLWVVVAVAMAPLLVSPQTVQTNHTVVCLQLYREKASHHALVSLAVAFTFPFITTVTCYLLIIRSLRQGLRVEKRLKTKAVRMIAIVLAIFLVCFVPYHVNRSVYVLHYRSHGASCATQRILALANRITSCLTSLNGALDPIMYFFVAEKFRHALCNLLCGKRLKGPPPSFEGKTNESSLSAKSEL |
UniProt | Q13304 |
Protein Data Bank | N/A |
GPCR-HGmod model | Q13304 |
3D structure model | This predicted structure model is from GPCR-EXP Q13304. |
BioLiP | N/A |
Therapeutic Target Database | N/A |
ChEMBL | CHEMBL1075162 |
IUPHAR | 88 |
DrugBank | N/A |
Name | CHEMBL129841 |
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Molecular formula | C11H17N5O9P2 |
IUPAC name | [(2R,3S,5R)-5-[6-(methylamino)purin-9-yl]-2-(phosphonooxymethyl)oxolan-3-yl] dihydrogen phosphate |
Molecular weight | 425.231 |
Hydrogen bond acceptor | 13 |
Hydrogen bond donor | 5 |
XlogP | -2.9 |
Synonyms | n6-methyl-2'-deoxyadenosine-3',5'-bisphosphate [(2R,3S,5R)-5-[6-(methylamino)purin-9-yl]-2-(phosphonooxymethyl)oxolan-3-yl] dihydrogen phosphate J-000339 MRS 2179 BDBM50318029 [ Show all ] |
Inchi Key | CCPLITQNIFLYQB-XLPZGREQSA-N |
Inchi ID | InChI=1S/C11H17N5O9P2/c1-12-10-9-11(14-4-13-10)16(5-15-9)8-2-6(25-27(20,21)22)7(24-8)3-23-26(17,18)19/h4-8H,2-3H2,1H3,(H,12,13,14)(H2,17,18,19)(H2,20,21,22)/t6-,7+,8+/m0/s1 |
PubChem CID | 5311303 |
ChEMBL | CHEMBL129841 |
IUPHAR | N/A |
BindingDB | 50318029, 50118229 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has more than 10 hydrogen bond acceptor. |
Parameter | Value | Reference | Database source |
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IC50 | 508.0 nM | PMID20394377 | BindingDB |
zhanglabzhanggroup.org | +65-6601-1241 | Computing 1, 13 Computing Drive, Singapore 117417