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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Acrosin' and Ligand = 'BDBM50382100'   
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))		BDBM50382100
PNG
(CHEMBL2023307)
Show SMILES COC(=O)Nc1nc2ccc(cc2[nH]1)S(=O)(=O)NCc1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C17H15F3N4O4S/c1-28-16(25)24-15-22-13-7-6-12(8-14(13)23-15)29(26,27)21-9-10-2-4-11(5-3-10)17(18,19)20/h2-8,21H,9H2,1H3,(H2,22,23,24,25)
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Article
PubMed
n/an/a 1.07E+7n/an/an/an/an/an/a



Second Military Medical University

Curated by ChEMBL


Assay Description
Inhibition of acrosin in human spermatozoa assessed as effect on amidase activity after 3 hrs incubation by spectrophotometry

Bioorg Med Chem Lett 22: 3554-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.042
BindingDB Entry DOI: 10.7270/Q2HT2QBG
More data for this
Ligand-Target Pair