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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Coagulation factor XI | ||
| Ligand | BDBM304210 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | Factor XIa Assay | ||
| IC50 | 1.80±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: |
| ||
| BDBM304210 | |||
| n/a | |||
| Name | BDBM304210 | ||
| Synonyms: | 2-(1-((4- carboxyphenyl)amino)-3-(3- fluorocyclobutyl)-1- oxopropan-2-yl)-5-(3- chloro-6-(difluoromethoxy)- 2-fluorophenyl)pyridine 1- oxide | BDBM304211 | US10143681, Example 101 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C26H21ClF4N2O5 | ||
| Mol. Mass. | 552.902 | ||
| SMILES | OC(=O)c1ccc(NC(=O)C(CC2CC(F)C2)c2ccc(c[n+]2[O-])-c2c(F)c(Cl)ccc2OC(F)F)cc1 |$;;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$,(8,-3.24,;8,-1.7,;9.34,-.93,;6.67,-.93,;5.33,-1.7,;4,-.93,;4,.61,;2.67,1.38,;1.33,.61,;1.33,-.93,;,1.38,;,2.92,;-1.33,3.69,;-2.82,3.29,;-3.22,4.78,;-4.55,5.55,;-1.73,5.18,;-1.33,.61,;-2.67,1.38,;-4,.61,;-4,-.93,;-2.67,-1.7,;-1.33,-.93,;,-1.7,;-5.33,-1.7,;-5.33,-3.24,;-4,-4.01,;-6.67,-4.01,;-6.67,-5.55,;-8,-3.24,;-8,-1.7,;-6.67,-.93,;-6.67,.61,;-8,1.38,;-8,2.92,;-9.34,.61,;5.33,1.38,;6.67,.61,)| | ||
| Structure | 
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