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1 similar compounds to monomer 80776

Compile data set for download or QSAR
Wt: 379.4
BDBM57277

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 57277   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
streptokinase A precursor


(Streptococcus pyogenes M1 GAS)
BDBM57277
PNG
(2-benzamido-5-benzoyl-4-methyl-3-thiophenecarboxyl...)
Show SMILES COC(=O)c1c(C)c(sc1NC(=O)c1ccccc1)C(=O)c1ccccc1
Show InChI InChI=1S/C21H17NO4S/c1-13-16(21(25)26-2)20(22-19(24)15-11-7-4-8-12-15)27-18(13)17(23)14-9-5-3-6-10-14/h3-12H,1-2H3,(H,22,24)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a 1.50E+5n/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
sentrin-specific protease 1


(Homo sapiens (Human))
BDBM57277
PNG
(2-benzamido-5-benzoyl-4-methyl-3-thiophenecarboxyl...)
Show SMILES COC(=O)c1c(C)c(sc1NC(=O)c1ccccc1)C(=O)c1ccccc1
Show InChI InChI=1S/C21H17NO4S/c1-13-16(21(25)26-2)20(22-19(24)15-11-7-4-8-12-15)27-18(13)17(23)14-9-5-3-6-10-14/h3-12H,1-2H3,(H,22,24)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.56E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2MC8XNQ
More data for this
Ligand-Target Pair
sentrin-specific protease 1


(Homo sapiens (Human))
BDBM57277
PNG
(2-benzamido-5-benzoyl-4-methyl-3-thiophenecarboxyl...)
Show SMILES COC(=O)c1c(C)c(sc1NC(=O)c1ccccc1)C(=O)c1ccccc1
Show InChI InChI=1S/C21H17NO4S/c1-13-16(21(25)26-2)20(22-19(24)15-11-7-4-8-12-15)27-18(13)17(23)14-9-5-3-6-10-14/h3-12H,1-2H3,(H,22,24)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 2.13E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2R49PCF
More data for this
Ligand-Target Pair