Reaction Details Report a problem with these data
Target
Coagulation factor IX
Ligand
BDBM352456
Substrate
n/a
Meas. Tech.
Factor XIa Assay
Ki
340±n/a nM
Citation
 Ogawa, A; Edmondson, S; Erion, M; Neelamkavil, S; Guo, Z; Mal, R; He, J; Liu, W; Vande Bunte, EK Factor XIa inhibitors US Patent  US9809545 Publication Date 11/7/2017 
Target
Name:
Coagulation factor IX
Synonyms:
Christmas factor | Coagulation factor IX precursor | Coagulation factor IX/VIII | Coagulation factor IXa | Coagulation factor IXa heavy chain | Coagulation factor IXa light chain | F9 | FA9_HUMAN | Factor IX | Factor IXa | Factor IXa (fIXa) | PTC | Plasma thromboplastin component
Type:
Enzyme
Mol. Mass.:
51768.83
Organism:
Homo sapiens (Human)
Description:
P00740
Residue:
461
Sequence:
MQRVNMIMAESPGLITICLLGYLLSAECTVFLDHENANKILNRPKRYNSGKLEEFVQGNLERECMEEKCSFEEAREVFENTERTTEFWKQYVDGDQCESNPCLNGGSCKDDINSYECWCPFGFEGKNCELDVTCNIKNGRCEQFCKNSADNKVVCSCTEGYRLAENQKSCEPAVPFPCGRVSVSQTSKLTRAETVFPDVDYVNSTEAETILDNITQSTQSFNDFTRVVGGEDAKPGQFPWQVVLNGKVDAFCGGSIVNEKWIVTAAHCVETGVKITVVAGEHNIEETEHTEQKRNVIRIIPHHNYNAAINKYNHDIALLELDEPLVLNSYVTPICIADKEYTNIFLKFGSGYVSGWGRVFHKGRSALVLQYLRVPLVDRATCLRSTKFTIYNNMFCAGFHEGGRDSCQGDSGGPHVTEVEGTSFLTGIISWGEECAMKGKYGIYTKVSRYVNWIKEKTKLT
  
Inhibitor
Name:
BDBM352456
Synonyms:
US9809545, 1Al | methyl (4-((2-(4-(5-chloro-2-nitrophenyl)-2-oxopyridin-1(2H)-yl)-3-phenylpropanamido)methyl)phenyl)carbamate
Type:
Small organic molecule
Emp. Form.:
C29H25ClN4O6
Mol. Mass.:
560.985
SMILES:
COC(=O)Nc1ccc(CNC(=O)C(Cc2ccccc2)n2ccc(cc2=O)-c2cc(Cl)ccc2[N+]([O-])=O)cc1
Structure:
Search PDB for entries with ligand similarity: