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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Acrosin' and Ligand = 'BDBM50018992'   
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
Acrosin


(Homo sapiens (Human))
BDBM50018992
PNG
(CHEMBL3287462)
Show SMILES Cl.Cc1cccc(NC(=O)c2cc(on2)-c2ccc(NC(N)=N)cc2)c1
Show InChI InChI=1S/C18H17N5O2.ClH/c1-11-3-2-4-14(9-11)21-17(24)15-10-16(25-23-15)12-5-7-13(8-6-12)22-18(19)20;/h2-10H,1H3,(H,21,24)(H4,19,20,22);1H
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Article
PubMed
n/an/a 9.40E+3n/an/an/an/an/an/a



Second Military Medical University

Curated by ChEMBL


Assay Description
Inhibition of human acrosin using N-alpha-benzoyl-L-arginine p-nitroanilide as substrate after 3 hrs by spectrophotometry


Bioorg Med Chem Lett 24: 2802-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.118
BindingDB Entry DOI: 10.7270/Q2J38V4S
More data for this
Ligand-Target Pair