Reaction Details Report a problem with these data
Target
Coagulation factor X
Ligand
BDBM50112503
Substrate
n/a
Meas. Tech.
ChEBML_49302
Ki
0.080000±n/a nM
Citation
 Wu, S; Guilford, WJ; Chou, YL; Griedel, BD; Liang, A; Sakata, S; Shaw, KJ; Trinh, L; Xu, W; Zhao, Z; Morrissey, MM Design and synthesis of aminophenol-based factor Xa inhibitors. Bioorg Med Chem Lett 12:1307-10 (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:
BDBM50112503
Synonyms:
7-({4-[1-(1-Imino-ethyl)-piperidin-4-yloxy]-3-nitro-phenylamino}-methyl)-naphthalene-2-carboxamidine | CHEMBL25034
Type:
Small organic molecule
Emp. Form.:
C25H28N6O3
Mol. Mass.:
460.5282
SMILES:
CC([NH-])=[N+]1CCC(CC1)Oc1ccc(NCc2ccc3ccc(cc3c2)C(N)=N)cc1[N+]([O-])=O |(-2.07,-4.18,;-.74,-4.97,;-.74,-6.51,;.59,-4.2,;.61,-2.66,;1.94,-1.9,;3.27,-2.68,;3.27,-4.21,;1.94,-4.98,;4.6,-1.91,;5.93,-2.68,;5.93,-4.22,;7.26,-4.99,;8.61,-4.22,;9.95,-4.99,;9.95,-6.53,;11.28,-7.29,;11.28,-8.83,;12.61,-9.6,;13.94,-8.83,;15.28,-9.59,;16.62,-8.8,;16.6,-7.26,;15.27,-6.49,;13.94,-7.28,;12.61,-6.52,;17.93,-6.47,;17.92,-4.93,;19.27,-7.24,;8.61,-2.67,;7.26,-1.9,;7.26,-.36,;8.59,.41,;5.93,.4,)|
Structure:
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