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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Acrosin' and Ligand = 'BDBM50436615'   
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))
BDBM50436615
PNG
(CHEMBL2397930)
Show SMILES OCCN(CCO)C(=O)c1cc(n[nH]1)-c1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C14H16N4O5/c19-7-5-17(6-8-20)14(21)13-9-12(15-16-13)10-1-3-11(4-2-10)18(22)23/h1-4,9,19-20H,5-8H2,(H,15,16)
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Article
PubMed
n/an/a 5.60E+6n/an/an/an/an/an/a



Second Military Medical University

Curated by ChEMBL


Assay Description
Inhibition of human sperm acrosin using BAPNA as substrate after 3 hrs by spectrophotometric analysis


Bioorg Med Chem Lett 23: 4177-84 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.031
BindingDB Entry DOI: 10.7270/Q25Q4XHT
More data for this
Ligand-Target Pair