Reaction Details | |||
---|---|---|---|
Report a problem with these data | |||
Target | Coagulation factor VII | ||
Ligand | BDBM50032864 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_1443464 (CHEMBL3377178) | ||
Ki | >10900±n/a nM | ||
Citation | Hangeland, JJ; Friends, TJ; Rossi, KA; Smallheer, JM; Wang, C; Sun, Z; Corte, JR; Fang, T; Wong, PC; Rendina, AR; Barbera, FA; Bozarth, JM; Luettgen, JM; Watson, CA; Zhang, G; Wei, A; Ramamurthy, V; Morin, PE; Bisacchi, GS; Subramaniam, S; Arunachalam, P; Mathur, A; Seiffert, DA; Wexler, RR; Quan, ML Phenylimidazoles as potent and selective inhibitors of coagulation factor XIa with in vivo antithrombotic activity. J Med Chem57:9915-32 (2014) [PubMed] Article | ||
More Info.: | Get all data from this article, Assay Method | ||
Coagulation factor VII | |||
Name: | Coagulation factor VII | ||
Synonyms: | Eptacog alfa | F7 | FA7_HUMAN | Factor VIIa | Factor VIIa (fVIIa) | Proconvertin | SPCA | Thrombin and coagulation factor VII | serum prothrombin conversion accelerator | ||
Type: | Enzyme | ||
Mol. Mass.: | 51599.89 | ||
Organism: | Homo sapiens (Human) | ||
Description: | n/a | ||
Residue: | 466 | ||
Sequence: |
| ||
BDBM50032864 | |||
n/a | |||
Name | BDBM50032864 | ||
Synonyms: | CHEMBL3355666 | ||
Type | Small organic molecule | ||
Emp. Form. | C29H33F3N4O5 | ||
Mol. Mass. | 574.5913 | ||
SMILES | OC(=O)C(F)(F)F.COC(=O)c1ccc(cc1)-c1c[nH]c(n1)[C@H](Cc1ccccc1)NC(=O)[C@H]1CC[C@H](CN)CC1 |r,wU:22.23,33.34,wD:36.38,(24.99,-5.26,;26.33,-6.03,;26.33,-7.58,;27.66,-5.26,;28.99,-6.03,;28.99,-4.47,;27.66,-3.72,;28.82,-13.82,;29.44,-12.41,;28.53,-11.17,;29.14,-9.77,;27,-11.34,;26.09,-10.1,;24.56,-10.26,;23.94,-11.67,;24.84,-12.91,;26.37,-12.75,;22.41,-11.82,;21.64,-13.16,;20.14,-12.84,;19.98,-11.31,;21.38,-10.68,;18.65,-10.54,;18.65,-9,;19.98,-8.23,;21.31,-9,;22.65,-8.23,;22.65,-6.69,;21.31,-5.92,;19.98,-6.69,;17.31,-11.31,;15.98,-10.54,;15.98,-9,;14.64,-11.31,;14.65,-12.85,;13.31,-13.62,;11.97,-12.84,;10.63,-13.61,;9.31,-12.83,;11.98,-11.3,;13.32,-10.54,)| | ||
Structure |