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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Prothrombin | ||
| Ligand | BDBM50110390 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEBML_208524 | ||
| Ki | 195±n/a nM | ||
| Citation |  Ho, JZ; Gibson, TS; Semple, JE Novel, potent non-covalent thrombin inhibitors incorporating p(3)-lactam scaffolds. Bioorg Med Chem Lett12:743-8 (2002) [PubMed] | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Prothrombin | |||
| Name: | Prothrombin | ||
| Synonyms: | Activation peptide fragment 1 | Activation peptide fragment 2 | Coagulation factor II | F2 | Prothrombin precursor | THRB_HUMAN | Thrombin heavy chain | Thrombin light chain | ||
| Type: | Protein | ||
| Mol. Mass.: | 70029.57 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | P00734 | ||
| Residue: | 622 | ||
| Sequence: |
| ||
| BDBM50110390 | |||
| n/a | |||
| Name | BDBM50110390 | ||
| Synonyms: | CHEMBL350117 | N-{(S)-1-[3-(4-Amino-cyclohexyl)-2-oxo-propyl]-2-oxo-azepan-3-yl}-C-phenyl-methanesulfonamide | ||
| Type | Small organic molecule | ||
| Emp. Form. | C22H33N3O4S | ||
| Mol. Mass. | 435.58 | ||
| SMILES | N[C@H]1CC[C@H](CC(=O)CN2CCCC[C@H](NS(=O)(=O)Cc3ccccc3)C2=O)CC1 |wU:14.14,4.4,wD:1.0,(19.47,-16.06,;18.32,-15.03,;18.32,-13.49,;16.97,-12.72,;15.64,-13.49,;14.31,-12.72,;14.31,-11.18,;15.2,-9.92,;12.77,-11.06,;12.12,-9.66,;13.1,-8.47,;12.77,-6.98,;11.39,-6.28,;9.99,-6.93,;9.64,-8.43,;8.13,-8.76,;6.68,-9.32,;6.14,-7.86,;7.24,-10.76,;5.35,-8.54,;4.02,-9.29,;4,-10.83,;2.67,-11.6,;1.34,-10.83,;1.36,-9.29,;2.69,-8.52,;10.58,-9.64,;9.9,-11.04,;15.64,-15.03,;16.97,-15.82,)| | ||
| Structure | 
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