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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Coagulation factor X | ||
| Ligand | BDBM12707 | ||
| Substrate/Competitor | BDBM12658 | ||
| Meas. Tech. | Enzyme Assay and Determination of the Inhibition Constants. | ||
| pH | 7±n/a | ||
| Temperature | 295.15±n/a K | ||
| Ki | 3.0±n/a nM | ||
| Citation |  Fevig, JM; Cacciola, J; Buriak, J; Rossi, KA; Knabb, RM; Luettgen, JM; Wong, PC; Bai, SA; Wexler, RR; Lam, PY Preparation of 1-(4-methoxyphenyl)-1H-pyrazolo[4,3-d]pyrimidin-7(6H)-ones as potent, selective and bioavailable inhibitors of coagulation factor Xa. Bioorg Med Chem Lett16:3755-60 (2006) [PubMed] Article | ||
| More Info.: | Get all data from this article, Inhibition_Run data, Solution Info, Assay Method | ||
| Coagulation factor X | |||
| Name: | Coagulation factor X | ||
| Synonyms: | Activated coagulation factor X (FXa) | Activated factor Xa heavy chain | Coagulation factor X precursor | Coagulation factor Xa | F10 | FA10_HUMAN | Factor X heavy chain | Factor X light chain | Factor Xa | Stuart factor | Stuart-Prower factor | ||
| Type: | Enzyme | ||
| Mol. Mass.: | 54726.60 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | n/a | ||
| Residue: | 488 | ||
| Sequence: |
| ||
| BDBM12707 | |||
| BDBM12658 | |||
| Name | BDBM12707 | ||
| Synonyms: | 6-[2-fluoro-4-(2-methanesulfonylphenyl)phenyl]-1-(4-methoxyphenyl)-5,7-dioxo-1H,4H,5H,6H,7H-pyrazolo[4,3-d]pyrimidine-3-carbonitrile | pyrazolo[4,3-d]pyrimidindione 13 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C26H18FN5O5S | ||
| Mol. Mass. | 531.515 | ||
| SMILES | COc1ccc(cc1)-n1nc(C#N)c2[nH]c(=O)n(-c3ccc(cc3F)-c3ccccc3S(C)(=O)=O)c(=O)c12 |(-7.99,-3.36,;-8.79,-2.04,;-8.05,-.69,;-8.85,.62,;-8.11,1.97,;-6.58,2.01,;-5.77,.7,;-6.51,-.66,;-5.67,3.26,;-6.15,4.72,;-4.9,5.63,;-4.9,7.17,;-4.9,8.71,;-3.65,4.72,;-2.15,5.04,;-1.12,3.9,;.39,4.22,;-1.59,2.43,;-.56,1.29,;-.89,-.22,;.24,-1.25,;1.71,-.79,;2.04,.71,;.91,1.75,;1.24,3.26,;2.85,-1.83,;2.48,-3.32,;3.6,-4.39,;5.07,-3.96,;5.44,-2.46,;4.33,-1.4,;4.69,.1,;5.09,1.59,;3.2,.5,;6.18,-.3,;-3.1,2.11,;-3.58,.65,;-4.13,3.26,)| | ||
| Structure | 
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