Reaction Details Report a problem with these data
Target
Coagulation factor X
Ligand
BDBM50111676
Substrate
n/a
Meas. Tech.
ChEBML_209063
Ki
5±n/a nM
Citation
 St-Denis, Y; Lévesque, S; Bachand, B; Edmunds, JJ; Leblond, L; Préville, P; Tarazi, M; Winocour, PD; Siddiqui, MA Novel bicyclic lactam inhibitors of thrombin: highly potent and selective inhibitors. Bioorg Med Chem Lett 12:1181-4 (2002) [PubMed]  Article 
Target
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:
MGRPLHLVLLSASLAGLLLLGESLFIRREQANNILARVTRANSFLEEMKKGHLERECMEETCSYEEAREVFEDSDKTNEFWNKYKDGDQCETSPCQNQGKCKDGLGEYTCTCLEGFEGKNCELFTRKLCSLDNGDCDQFCHEEQNSVVCSCARGYTLADNGKACIPTGPYPCGKQTLERRKRSVAQATSSSGEAPDSITWKPYDAADLDPTENPFDLLDFNQTQPERGDNNLTRIVGGQECKDGECPWQALLINEENEGFCGGTILSEFYILTAAHCLYQAKRFKVRVGDRNTEQEEGGEAVHEVEVVIKHNRFTKETYDFDIAVLRLKTPITFRMNVAPACLPERDWAESTLMTQKTGIVSGFGRTHEKGRQSTRLKMLEVPYVDRNSCKLSSSFIITQNMFCAGYDTKQEDACQGDSGGPHVTRFKDTYFVTGIVSWGEGCARKGKYGIYTKVTAFLKWIDRSMKTRGLPKAKSHAPEVITSSPLK
  
Inhibitor
Name:
BDBM50111676
Synonyms:
(6S,8aS)-2-(Diphenyl-methanesulfonyl)-4-oxo-octahydro-pyrrolo[1,2-a]pyrazine-6-carboxylic acid (4-amino-cyclohexylmethyl)-amide | CHEMBL415990
Type:
Small organic molecule
Emp. Form.:
C28H36N4O4S
Mol. Mass.:
524.675
SMILES:
N[C@H]1CC[C@H](CNC(=O)[C@@H]2CC[C@H]3CN(CC(=O)N23)S(=O)(=O)C(c2ccccc2)c2ccccc2)CC1 |wU:9.8,1.0,wD:12.19,4.4,(18.74,-9.34,;17.24,-9.01,;16.19,-10.16,;14.69,-9.83,;14.22,-8.38,;12.73,-8.07,;12.26,-6.59,;10.74,-6.27,;9.71,-7.42,;10.27,-4.8,;11.16,-3.56,;10.25,-2.31,;8.8,-2.79,;7.44,-2.02,;6.13,-2.79,;6.11,-4.33,;7.44,-5.11,;7.44,-6.65,;8.8,-4.33,;4.78,-2.02,;3.68,-.92,;5.88,-.92,;3.44,-2.81,;3.54,-4.33,;4.92,-5.03,;4.99,-6.58,;3.68,-7.42,;2.32,-6.72,;2.23,-5.18,;2.09,-2.09,;2,-.56,;.64,.16,;-.67,-.69,;-.58,-2.24,;.78,-2.93,;15.25,-7.23,;16.75,-7.55,)|
Structure:
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