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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Prothrombin' and Ligand = 'BDBM50293382'   
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
Prothrombin


(Homo sapiens (Human))
BDBM50293382
PNG
(2-[(3S)-7-(3-Aminophenyl)-3-[benzylsulfonylamino]-...)
Show SMILES NC(=N)c1ccc(CNC(=O)CN2c3cc(ccc3SC[C@@H](NS(=O)(=O)Cc3ccccc3)C2=O)-c2cccc(N)c2)cc1 |r|
Show InChI InChI=1S/C32H32N6O4S2/c33-26-8-4-7-24(15-26)25-13-14-29-28(16-25)38(18-30(39)36-17-21-9-11-23(12-10-21)31(34)35)32(40)27(19-43-29)37-44(41,42)20-22-5-2-1-3-6-22/h1-16,27,37H,17-20,33H2,(H3,34,35)(H,36,39)/t27-/m1/s1
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PC cid
PC sid
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Similars

Article
PubMed
n/an/a 1.00E+4n/an/an/an/an/an/a



Universit£ Montpellier 1

Curated by ChEMBL


Assay Description
Inhibition of human factor 2a by spectrophotometry


Bioorg Med Chem Lett 19: 1386-91 (2009)


Article DOI: 10.1016/j.bmcl.2009.01.039
BindingDB Entry DOI: 10.7270/Q2G73DRB
More data for this
Ligand-Target Pair