Target
Coagulation factor IX
Ligand
BDBM50125972
Substrate
n/a
Meas. Tech.
ChEMBL_1522950 (CHEMBL3630982)
Ki
2.9±n/a nM
Citation
 Zhang, TAndre, PBateman, TJChen, YHDesai, KEllsworth, KGeissler, WMGuo, LHruza, AJian, TMeng, DParker, DLQian, XReichert, PSherer, ECShu, MSmith, CJSonatore, LMTschirret-Guth, RNolting, AFOrr, RCampeau, LCAraki, KNishimura, TSakurada, IWood, HB Development of a novel class of potent and selective FIXa inhibitors. Bioorg Med Chem Lett 25:4945-9 (2015) [PubMed]  Article 
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:
BDBM50125972
Synonyms:
CHEMBL3627894
Type:
Small organic molecule
Emp. Form.:
C26H20Cl3FN6O2
Mol. Mass.:
573.833
SMILES:
COc1cc2nc([nH]c2cc1Cl)[C@@H](CNC(=O)c1c(Cl)cc(cc1Cl)-n1cnc(C)n1)c1cccc(F)c1 |r|
Structure:
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