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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Coagulation factor VII' and Ligand = 'BDBM50126583'   
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 VII


(Homo sapiens (Human))
BDBM50126583
PNG
(2-[3-(4-Carbamimidoyl-phenyl)-ureido]-N-(4-dimethy...)
Show SMILES CN(C)c1ccc(CNC(=O)CNC(=O)Nc2ccc(cc2)C(N)=N)cc1
Show InChI InChI=1S/C19H24N6O2/c1-25(2)16-9-3-13(4-10-16)11-22-17(26)12-23-19(27)24-15-7-5-14(6-8-15)18(20)21/h3-10H,11-12H2,1-2H3,(H3,20,21)(H,22,26)(H2,23,24,27)
PDB
MMDB

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PubMed
1.94E+3n/an/an/an/an/an/an/an/a



Aventis Pharma Deutschland GmbH

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against coagulation factor VII (fVIIa)


Bioorg Med Chem Lett 13: 1463-7 (2003)


BindingDB Entry DOI: 10.7270/Q2Q52P1B
More data for this
Ligand-Target Pair