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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Streptokinase A' and Ligand = 'BDBM54859'   
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
Streptokinase A


(Streptococcus pyogenes M1 GAS)
BDBM54859
PNG
(5-ethyl-2-(2-thenoylamino)-4-(2-thienyl)thiophene-...)
Show SMILES CCOC(=O)c1c(NC(=O)c2cccs2)sc(CC)c1-c1cccs1
Show InChI InChI=1S/C18H17NO3S3/c1-3-11-14(12-7-5-9-23-12)15(18(21)22-4-2)17(25-11)19-16(20)13-8-6-10-24-13/h5-10H,3-4H2,1-2H3,(H,19,20)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a 9.89E+3n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Group A streptococcus, GAS, streptokinase, expression, virulence, inhibition, dose response, EC50 Assay Overview: The goal of this assa...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q2736PBV
More data for this
Ligand-Target Pair
Streptokinase A


(Streptococcus pyogenes M1 GAS)
BDBM54859
PNG
(5-ethyl-2-(2-thenoylamino)-4-(2-thienyl)thiophene-...)
Show SMILES CCOC(=O)c1c(NC(=O)c2cccs2)sc(CC)c1-c1cccs1
Show InChI InChI=1S/C18H17NO3S3/c1-3-11-14(12-7-5-9-23-12)15(18(21)22-4-2)17(25-11)19-16(20)13-8-6-10-24-13/h5-10H,3-4H2,1-2H3,(H,19,20)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a 2.18E+4n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Group A streptococcus, GAS, streptokinase, expression, virulence, inhibition, dose response, EC50 Assay Overview: The goal of this assa...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q23F4N1V
More data for this
Ligand-Target Pair