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BDBM50092267 5-[1-Phenyl-meth-(Z)-ylidene]-3-[(1H-tetrazol-5-ylamino)-methyl]-2-thioxo-thiazolidin-4-one::CHEMBL67876

SMILES: O=C1N(CNc2nnn[nH]2)C(=S)SC1=Cc1ccccc1

InChI Key: InChIKey=KOOVSKIHIUMQLM-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50092267   
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


(Enterobacter cloacae)
BDBM50092267
PNG
(5-[1-Phenyl-meth-(Z)-ylidene]-3-[(1H-tetrazol-5-yl...)
Show SMILES O=C1N(CNc2nnn[nH]2)C(=S)SC1=Cc1ccccc1 |w:14.16|
Show InChI InChI=1S/C12H10N6OS2/c19-10-9(6-8-4-2-1-3-5-8)21-12(20)18(10)7-13-11-14-16-17-15-11/h1-6H,7H2,(H2,13,14,15,16,17)
PDB
MMDB

KEGG

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a>7.00E+5n/an/an/an/an/an/a



The R. W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory activity against class A Beta-lactamase TEM isolated from Enterobacter coli


Bioorg Med Chem Lett 10: 2179-82 (2001)


BindingDB Entry DOI: 10.7270/Q2T15456
More data for this
Ligand-Target Pair
Beta-lactamase


(Enterobacter cloacae)
BDBM50092267
PNG
(5-[1-Phenyl-meth-(Z)-ylidene]-3-[(1H-tetrazol-5-yl...)
Show SMILES O=C1N(CNc2nnn[nH]2)C(=S)SC1=Cc1ccccc1 |w:14.16|
Show InChI InChI=1S/C12H10N6OS2/c19-10-9(6-8-4-2-1-3-5-8)21-12(20)18(10)7-13-11-14-16-17-15-11/h1-6H,7H2,(H2,13,14,15,16,17)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a 4.35E+5n/an/an/an/an/an/a



The R. W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory activity against class C Beta-lactamase isolated from Enterobacter cloacae


Bioorg Med Chem Lett 10: 2179-82 (2001)


BindingDB Entry DOI: 10.7270/Q2T15456
More data for this
Ligand-Target Pair