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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Leukocyte elastase' and Ligand = 'BDBM50282870'   
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
Leukocyte elastase


(Homo sapiens (Human))
BDBM50282870
PNG
(1,1-Dioxo-4-phenyl-2-(1-phenyl-1H-tetrazol-5-ylsul...)
Show SMILES O=C1N(CSc2nnnn2-c2ccccc2)S(=O)(=O)c2cccc(c12)-c1ccccc1
Show InChI InChI=1S/C21H15N5O3S2/c27-20-19-17(15-8-3-1-4-9-15)12-7-13-18(19)31(28,29)25(20)14-30-21-22-23-24-26(21)16-10-5-2-6-11-16/h1-13H,14H2
PDB
MMDB

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Similars

Article
80n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Potency of Inhibition of human leukocyte elastase (HLE) expressed as apparent binding constant


Bioorg Med Chem Lett 4: 1801-1806 (1994)


Article DOI: 10.1016/S0960-894X(01)80374-7
BindingDB Entry DOI: 10.7270/Q25M65PP
More data for this
Ligand-Target Pair