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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 = 'BDBM50069166'   
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))
BDBM50069166
PNG
(CHEMBL2373475 | N-[(R)-5-Amino-1-((1S,2S,6R,8S)-2,...)
Show SMILES [H][C@@]12C[C@@]([H])(C1(C)C)[C@]1(C)OB(O[C@]1([H])C2)[C@H](CCCCN)NC(=O)Cn1nc(C[S+](C)[O-])nc1Cc1ccccc1
Show InChI InChI=1S/C28H42BN5O4S/c1-27(2)20-15-21(27)28(3)22(16-20)37-29(38-28)23(12-8-9-13-30)31-26(35)17-34-25(14-19-10-6-5-7-11-19)32-24(33-34)18-39(4)36/h5-7,10-11,20-23H,8-9,12-18,30H2,1-4H3,(H,31,35)/t20-,21-,22+,23-,28-,39?/m0/s1
PDB
MMDB

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PC cid
PC sid
UniChem
PubMed
2.10E+3n/an/an/an/an/an/an/an/a



DuPont Merck Pharmaceutical Company

Curated by ChEMBL


Assay Description
Inhibition against human Coagulation factor VII


Bioorg Med Chem Lett 8: 775-80 (1999)


BindingDB Entry DOI: 10.7270/Q2P84B1P
More data for this
Ligand-Target Pair