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BDBM50518887 CHEMBL4527309

SMILES: OB(O)[C@H](Cc1ccccc1)NC(=O)CCS

InChI Key: InChIKey=YJAUBKVHBZDGEC-JTQLQIEISA-N

Data: 1 KI

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50518887   
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
Bacterial beta-lactamase TEM


(Escherichia coli)
BDBM50518887
PNG
(CHEMBL4527309)
Show SMILES OB(O)[C@H](Cc1ccccc1)NC(=O)CCS |r|
Show InChI InChI=1S/C11H16BNO3S/c14-11(6-7-17)13-10(12(15)16)8-9-4-2-1-3-5-9/h1-5,10,15-17H,6-8H2,(H,13,14)/t10-/m0/s1
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
1.58E+4n/an/an/an/an/an/an/an/a



Sichuan University

Curated by ChEMBL


Assay Description
Inhibition of bacterial N-terminal His-tagged TEV protease site linked TEM-1 (24 to 286 amino acids) expressed in Escherichia coli Transetta (DE3) pr...


J Med Chem 62: 7160-7184 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00735
More data for this
Ligand-Target Pair