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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Coagulation factor XI | ||
| Ligand | BDBM304179 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | Factor XIa Assay | ||
| IC50 | 0.470±n/a nM | ||
| Citation |  Shen, D; Kuang, R; Kumar, P; Duffy, JL; Zhu, C; Ali, A; Yang, M; Debenham, JS Factor XIa inhibitors US Patent US10143681 Publication Date 12/4/2018 | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Coagulation factor XI | |||
| Name: | Coagulation factor XI | ||
| Synonyms: | Coagulation factor XIa | Coagulation factor XIa heavy chain | Coagulation factor XIa light chain | F11 | FA11_HUMAN | FXI | Factor XIa | Factor XIa (fXIa) | PTA | Plasma thromboplastin antecedent | ||
| Type: | Enzyme | ||
| Mol. Mass.: | 70130.58 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | P03951 | ||
| Residue: | 625 | ||
| Sequence: |
| ||
| BDBM304179 | |||
| n/a | |||
| Name | BDBM304179 | ||
| Synonyms: | 2-(1-((4-carboxyphenyl)amino)- 3-cyclopropyl-1-oxopropan-2- yl)-5-(3-chloro-6- (difluoromethoxy)-2- fluorophenyl)-4-methoxypyridine 1-oxide | BDBM304180 | US10143681, Example 70 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C26H22ClF3N2O6 | ||
| Mol. Mass. | 550.911 | ||
| SMILES | COc1cc(C(CC2CC2)C(=O)Nc2ccc(cc2)C(O)=O)[n+]([O-])cc1-c1c(F)c(Cl)ccc1OC(F)F |$;;;;;;;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;$,(-5.33,3.18,;-5.33,1.64,;-4,.87,;-2.67,1.64,;-1.33,.87,;,1.64,;,3.18,;1.33,3.95,;2.87,3.95,;2.1,5.29,;1.33,.87,;1.33,-.67,;2.67,1.64,;4,.87,;4,-.67,;5.33,-1.44,;6.67,-.67,;6.67,.87,;5.33,1.64,;8,-1.44,;8,-2.98,;9.34,-.67,;-1.33,-.67,;,-1.44,;-2.67,-1.44,;-4,-.67,;-5.33,-1.44,;-5.33,-2.98,;-4,-3.75,;-6.67,-3.75,;-6.67,-5.29,;-8,-2.98,;-8,-1.44,;-6.67,-.67,;-6.67,.87,;-8,1.64,;-8,3.18,;-9.34,.87,)| | ||
| Structure | 
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