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2 similar compounds to monomer 26139

Compile data set for download or QSAR
Wt: 194.0
BDBM50225392
Wt: 192.0
BDBM50225371
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50225392,50225371   
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
Beta-lactamase (TEM-1)


(Escherichia coli)
BDBM50225371
PNG
(5-methyl-benzo[b]thiophen-2-ylboronic acid | CHEMB...)
Show SMILES Cc1ccc2sc(cc2c1)B(O)O
Show InChI InChI=1S/C9H9BO2S/c1-6-2-3-8-7(4-6)5-9(13-8)10(11)12/h2-5,11-12H,1H3
PDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
30n/an/an/an/an/an/an/an/a



Università degli Studi di Modena e Reggio Emilia

Curated by ChEMBL


Assay Description
Inhibition of Escherichia coli beta-lactamase


J Med Chem 50: 5644-54 (2007)


Article DOI: 10.1021/jm070643q
BindingDB Entry DOI: 10.7270/Q21N80W5
More data for this
Ligand-Target Pair
Beta-lactamase (TEM-1)


(Escherichia coli)
BDBM50225392
PNG
(5-hydroxymethylbenzo[b]thiophen-2-ylboronic acid |...)
Show SMILES OB(O)c1cc2cc(O)ccc2s1
Show InChI InChI=1S/C8H7BO3S/c10-6-1-2-7-5(3-6)4-8(13-7)9(11)12/h1-4,10-12H
PDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
43n/an/an/an/an/an/an/an/a



Università degli Studi di Modena e Reggio Emilia

Curated by ChEMBL


Assay Description
Inhibition of Escherichia coli beta-lactamase


J Med Chem 50: 5644-54 (2007)


Article DOI: 10.1021/jm070643q
BindingDB Entry DOI: 10.7270/Q21N80W5
More data for this
Ligand-Target Pair