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Compile Data Set for Download or QSAR

Found 2 hits of ki for monomerid = 50084228   
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
Neutrophil elastase


(Homo sapiens (Human))
BDBM50084228
PNG
(2-(diethylamino)-5-methyl-4H-thieno[2,3-d][1,3]oxa...)
Show SMILES CCN(CC)c1nc2scc(C)c2c(=O)o1
Show InChI InChI=1S/C11H14N2O2S/c1-4-13(5-2)11-12-9-8(10(14)15-11)7(3)6-16-9/h6H,4-5H2,1-3H3
PDB
MMDB

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PC cid
PC sid
UniChem

Similars

PubMed
450n/an/an/an/an/an/an/an/a



University of Leipzig

Curated by ChEMBL


Assay Description
Inhibitory activity of the compound was tested against human leukocyte elastase


J Med Chem 42: 5437-47 (2000)


BindingDB Entry DOI: 10.7270/Q2K936RG
More data for this
Ligand-Target Pair
Bile salt-activated lipase


(Bos taurus)
BDBM50084228
PNG
(2-(diethylamino)-5-methyl-4H-thieno[2,3-d][1,3]oxa...)
Show SMILES CCN(CC)c1nc2scc(C)c2c(=O)o1
Show InChI InChI=1S/C11H14N2O2S/c1-4-13(5-2)11-12-9-8(10(14)15-11)7(3)6-16-9/h6H,4-5H2,1-3H3
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
1.50E+4n/an/an/an/an/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreatic CEase in presence of pNPB chromogenic substrate by spectrophotometry


J Med Chem 48: 8270-88 (2005)


Article DOI: 10.1021/jm0508639
BindingDB Entry DOI: 10.7270/Q2GQ6XB4
More data for this
Ligand-Target Pair