Target
Coagulation factor VII
Ligand
BDBM14527
Substrate
BDBM14496
Meas. Tech.
TF-VIIa Assay
IC50
400±n/a nM
Citation
 Parlow, JJCase, BLDice, TAFenton, RLHayes, MJJones, DENeumann, WLWood, RSLachance, RMGirard, TJNicholson, NSClare, MStegeman, RAStevens, AMStallings, WCKurumbail, RGSouth, MS Design, parallel synthesis, and crystal structures of pyrazinone antithrombotics as selective inhibitors of the tissue factor VIIa complex. J Med Chem 46:4050-62 (2003) [PubMed]  Article 
Target
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:
MVSQALRLLCLLLGLQGCLAAGGVAKASGGETRDMPWKPGPHRVFVTQEEAHGVLHRRRRANAFLEELRPGSLERECKEEQCSFEEAREIFKDAERTKLFWISYSDGDQCASSPCQNGGSCKDQLQSYICFCLPAFEGRNCETHKDDQLICVNENGGCEQYCSDHTGTKRSCRCHEGYSLLADGVSCTPTVEYPCGKIPILEKRNASKPQGRIVGGKVCPKGECPWQVLLLVNGAQLCGGTLINTIWVVSAAHCFDKIKNWRNLIAVLGEHDLSEHDGDEQSRRVAQVIIPSTYVPGTTNHDIALLRLHQPVVLTDHVVPLCLPERTFSERTLAFVRFSLVSGWGQLLDRGATALELMVLNVPRLMTQDCLQQSRKVGDSPNITEYMFCAGYSDGSKDSCKGDSGGPHATHYRGTWYLTGIVSWGQGCATVGHFGVYTRVSQYIEWLQKLMRSEPRPGVLLRAPFP
  
Inhibitor
Name:
BDBM14527
Synonyms:
N-[(4-carbamimidoylphenyl)methyl]-2-[5-chloro-3-(ethylamino)-2-oxo-6-phenyl-1,2-dihydropyrazin-1-yl]acetamide | Pyrazinone Analog 28b
Type:
Small organic molecule
Emp. Form.:
C22H23ClN6O2
Mol. Mass.:
438.91
SMILES:
CCNc1nc(Cl)c(-c2ccccc2)n(CC(=O)NCc2ccc(cc2)C(N)=N)c1=O
Structure:
Search PDB for entries with ligand similarity:
Substrate
Name:
BDBM14496
Synonyms:
Factor VII Chromogenic Substrate | N-Methylsulfonyl-D-Phe-Gly-Arg-4-nitranilide acetate
Type:
Small organic molecule
Emp. Form.:
C24H32N8O7S
Mol. Mass.:
576.625
SMILES:
[#6]S(=O)(=O)[#7]-[#6@H](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6]-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#6](=O)-[#7]-c1ccc(cc1)-[#7+](-[#8-])=O
Structure:
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