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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Coagulation factor XI | ||
| Ligand | BDBM339914 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | Inhibition Assay | ||
| IC50 | 916±n/a nM | ||
| Citation |  Ikuma, Y; Fukuda, N; Iwata, M; Kimura, H; Suzuki, K 1-(cycloalkyl-carbonyl)proline derivative US Patent US9758480 Publication Date 9/12/2017 | ||
| 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: |
| ||
| BDBM339914 | |||
| n/a | |||
| Name | BDBM339914 | ||
| Synonyms: | US9758480, 146 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C29H37F2N3O5 | ||
| Mol. Mass. | 545.618 | ||
| SMILES | N[C@H](C(F)F)[C@H]1CC[C@@H](CC1)C(=O)N1CC[C@H]([C@H]1C(=O)Nc1ccc2oc(cc2c1)C(O)=O)C1CCCCC1 |r,wU:8.11,16.36,17.19,1.0,wD:5.4,(-27.02,-11.64,;-25.69,-12.41,;-25.69,-13.95,;-27.02,-14.72,;-24.36,-14.72,;-24.36,-11.64,;-23.02,-12.41,;-21.69,-11.64,;-21.69,-10.1,;-23.02,-9.33,;-24.36,-10.1,;-20.36,-9.33,;-19.02,-10.1,;-20.36,-7.79,;-21.6,-6.89,;-21.13,-5.42,;-19.59,-5.42,;-19.11,-6.89,;-17.78,-7.66,;-17.78,-9.2,;-16.44,-6.89,;-15.11,-7.66,;-15.11,-9.2,;-13.77,-9.97,;-12.44,-9.2,;-10.98,-9.67,;-10.07,-8.43,;-10.98,-7.18,;-12.44,-7.66,;-13.77,-6.89,;-8.53,-8.43,;-7.76,-9.76,;-7.76,-7.09,;-18.82,-4.09,;-17.28,-4.09,;-16.51,-2.75,;-17.28,-1.42,;-18.82,-1.42,;-19.59,-2.75,)| | ||
| Structure | 
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