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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 = 'BDBM50439478'   
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))
BDBM50439478
PNG
(CHEMBL2417902)
Show SMILES CNc1ccc(c(n1)C(=O)Nc1ccc2c(N)nccc2c1)-c1ccc(cc1C(O)=O)C(=O)NCC(C)(C)C
Show InChI InChI=1S/C29H30N6O4/c1-29(2,3)15-33-26(36)17-5-7-20(22(14-17)28(38)39)21-9-10-23(31-4)35-24(21)27(37)34-18-6-8-19-16(13-18)11-12-32-25(19)30/h5-14H,15H2,1-4H3,(H2,30,32)(H,31,35)(H,33,36)(H,34,37)(H,38,39)
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Article
PubMed
n/an/a 51n/an/an/an/an/an/a



Bristol-Myers Squibb Research& Development

Curated by ChEMBL


Assay Description
Inhibition of human F7a using D-Ile-Pro-Arg-AFC as substrate after 3 mins


Bioorg Med Chem Lett 23: 5239-43 (2013)


Article DOI: 10.1016/j.bmcl.2013.06.028
BindingDB Entry DOI: 10.7270/Q2CC123C
More data for this
Ligand-Target Pair