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BDBM135573 US8853258, 226

SMILES: CC(CCc1ccc(cc1)C1=CCSCC1)(C(=O)NO)S(C)(=O)=O

InChI Key: InChIKey=SBVIWCQJOMDZSC-UHFFFAOYSA-N

Data: 1 IC50

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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 = 135573   
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
UDP-3-O-acyl-GlcNAc deacetylase (LpxC)


(Pseudomonas aeruginosa)
BDBM135573
PNG
(US8853258, 226)
Show SMILES CC(CCc1ccc(cc1)C1=CCSCC1)(C(=O)NO)S(C)(=O)=O |t:11|
Show InChI InChI=1S/C17H23NO4S2/c1-17(16(19)18-20,24(2,21)22)10-7-13-3-5-14(6-4-13)15-8-11-23-12-9-15/h3-6,8,20H,7,9-12H2,1-2H3,(H,18,19)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 0.320n/an/an/an/a8.0n/a



Pfizer Inc.

US Patent


Assay Description
IC50 determination in the LpxC enzyme assay was carried out in a similar manner to that described by Malikzay et al in the 2006 Poster, Screening Lpx...


US Patent US8853258 (2014)


BindingDB Entry DOI: 10.7270/Q25M64DP
More data for this
Ligand-Target Pair