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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Acrosin' and Ligand = 'BDBM50018971'   
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))
BDBM50018971
PNG
(CHEMBL3287443)
Show SMILES Cl.NC(=N)Nc1ccc(cc1)-c1cc(no1)C(=O)Nc1ccccc1
Show InChI InChI=1S/C17H15N5O2.ClH/c18-17(19)21-13-8-6-11(7-9-13)15-10-14(22-24-15)16(23)20-12-4-2-1-3-5-12;/h1-10H,(H,20,23)(H4,18,19,21);1H
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Article
PubMed
n/an/a 2.46E+4n/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