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Name | Thromboxane A2 receptor |
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Species | Homo sapiens (Human) |
Gene | TBXA2R |
Synonym | TP receptor TXA2-R prostanoid TP receptor |
Disease | Diabetic neuropathy Cardiovascular disorder Erectile dysfunction Perennial allergic rhinitis Peripheral vascular disease [ Show all ] |
Length | 343 |
Amino acid sequence | MWPNGSSLGPCFRPTNITLEERRLIASPWFAASFCVVGLASNLLALSVLAGARQGGSHTRSSFLTFLCGLVLTDFLGLLVTGTIVVSQHAALFEWHAVDPGCRLCRFMGVVMIFFGLSPLLLGAAMASERYLGITRPFSRPAVASQRRAWATVGLVWAAALALGLLPLLGVGRYTVQYPGSWCFLTLGAESGDVAFGLLFSMLGGLSVGLSFLLNTVSVATLCHVYHGQEAAQQRPRDSEVEMMAQLLGIMVVASVCWLPLLVFIAQTVLRNPPAMSPAGQLSRTTEKELLIYLRVATWNQILDPWVYILFRRAVLRRLQPRLSTRPRSLSLQPQLTQRSGLQ |
UniProt | P21731 |
Protein Data Bank | 6iiv, 6iiu |
GPCR-HGmod model | P21731 |
3D structure model | This structure is from PDB ID 6iiv. |
BioLiP | BL0436518, BL0436517, BL0436516, BL0436515, BL0436514, BL0436513 |
Therapeutic Target Database | T76198 |
ChEMBL | CHEMBL2069 |
IUPHAR | 346 |
DrugBank | BE0000759 |
Name | CHEMBL1079732 |
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Molecular formula | C22H13Cl4FN4O3S2 |
IUPAC name | 4,5-dichloro-N-[5-[1-[(2,4-dichlorophenyl)methyl]-5-fluoro-3-methylindol-7-yl]-1,2,4-oxadiazol-3-yl]thiophene-2-sulfonamide |
Molecular weight | 606.289 |
Hydrogen bond acceptor | 8 |
Hydrogen bond donor | 1 |
XlogP | 7.7 |
Synonyms | BDBM50311612 4,5-dichloro-N-(5-(1-(2,4-dichlorobenzyl)-5-fluoro-3-methyl-1H-indol-7-yl)-1,2,4-oxadiazol-3-yl)thiophene-2-sulfonamide |
Inchi Key | FKSFUQRGCQKPTK-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C22H13Cl4FN4O3S2/c1-10-8-31(9-11-2-3-12(23)4-16(11)24)19-14(10)5-13(27)6-15(19)21-28-22(29-34-21)30-36(32,33)18-7-17(25)20(26)35-18/h2-8H,9H2,1H3,(H,29,30) |
PubChem CID | 46879719 |
ChEMBL | CHEMBL1079732 |
IUPHAR | N/A |
BindingDB | 50311612 |
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 |
---|---|---|---|
Activity | 2.0 % | PMID19836233 | ChEMBL |
Activity | 5.0 % | PMID19836233 | ChEMBL |
Activity | 98.0 % | PMID19836233 | ChEMBL |
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