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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Coagulation factor X' and Ligand = 'BDBM50113603'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Coagulation factor X


(Homo sapiens (Human))
BDBM50113603
PNG
((E)-3-(3-Carbamimidoyl-phenyl)-2,4,4,4-tetrafluoro...)
Show SMILES NC(=N)c1cccc(c1)C(=C(\F)C(=O)Nc1ccc(cc1)-c1ccccc1S(N)(=O)=O)\C(F)(F)F
Show InChI InChI=1S/C23H18F4N4O3S/c24-20(19(23(25,26)27)14-4-3-5-15(12-14)21(28)29)22(32)31-16-10-8-13(9-11-16)17-6-1-2-7-18(17)35(30,33)34/h1-12H,(H3,28,29)(H,31,32)(H2,30,33,34)/b20-19-
PDB
MMDB

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PubMed
n/an/a 3n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against factor Xa


Bioorg Med Chem Lett 12: 1511-5 (2002)


BindingDB Entry DOI: 10.7270/Q2P84B6X
More data for this
Ligand-Target Pair