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BDBM50167950 3-(4-Chloro-phenylsulfamoyl)-thiophene-2-carboxylic acid::3-[(4-CHLOROANILINO)SULFONYL]THIOPHENE-2-CARBOXYLIC ACID::CHEMBL372227

SMILES: OC(=O)c1sccc1S(=O)(=O)Nc1ccc(Cl)cc1

InChI Key: InChIKey=YRWKEEDITQJPCZ-UHFFFAOYSA-N

Data: 1 KI

PDB links: 1 PDB ID matches this monomer.

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50167950   
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 AmpC


(Escherichia coli)
BDBM50167950
PNG
(3-(4-Chloro-phenylsulfamoyl)-thiophene-2-carboxyli...)
Show SMILES OC(=O)c1sccc1S(=O)(=O)Nc1ccc(Cl)cc1
Show InChI InChI=1S/C11H8ClNO4S2/c12-7-1-3-8(4-2-7)13-19(16,17)9-5-6-18-10(9)11(14)15/h1-6,13H,(H,14,15)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
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CHEMBL
DrugBank
MMDB
PC cid
PC sid
PDB
UniChem

Similars

PDB
Article
PubMed
2.60E+4n/an/an/an/an/an/an/an/a



University of California San Francisco

Curated by ChEMBL


Assay Description
Apparent inhibitory constant against beta-lactamase AmpC from Escherichia coli


J Med Chem 48: 3714-28 (2005)

More data for this
Ligand-Target Pair
3D
3D Structure (crystal)