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SMILES: CC(C)C(CCN1C(=O)c2ccccc2C1=O)c1ccco1

InChI Key: InChIKey=QPVNLIQYNOWGTK-UHFFFAOYSA-N

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 3 hits for monomerid = 66109   
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


(Pseudomonas aeruginosa)
BDBM66109
PNG
(2-(3-Furan-2-yl-4-methyl-pentyl)-isoindole-1,3-dio...)
Show SMILES CC(C)C(CCN1C(=O)c2ccccc2C1=O)c1ccco1
Show InChI InChI=1S/C18H19NO3/c1-12(2)13(16-8-5-11-22-16)9-10-19-17(20)14-6-3-4-7-15(14)18(19)21/h3-8,11-13H,9-10H2,1-2H3
PDB
MMDB

KEGG

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
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PC cid
PC sid
UniChem
PCBioAssay
n/an/a 1.34E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2S75DSB
More data for this
Ligand-Target Pair
Beta-lactamase


(Pseudomonas aeruginosa)
BDBM66109
PNG
(2-(3-Furan-2-yl-4-methyl-pentyl)-isoindole-1,3-dio...)
Show SMILES CC(C)C(CCN1C(=O)c2ccccc2C1=O)c1ccco1
Show InChI InChI=1S/C18H19NO3/c1-12(2)13(16-8-5-11-22-16)9-10-19-17(20)14-6-3-4-7-15(14)18(19)21/h3-8,11-13H,9-10H2,1-2H3
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a 3.68E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2HT2MRM
More data for this
Ligand-Target Pair
Beta-lactamase


(Salmonella enterica subsp. enterica serovar Choler...)
BDBM66109
PNG
(2-(3-Furan-2-yl-4-methyl-pentyl)-isoindole-1,3-dio...)
Show SMILES CC(C)C(CCN1C(=O)c2ccccc2C1=O)c1ccco1
Show InChI InChI=1S/C18H19NO3/c1-12(2)13(16-8-5-11-22-16)9-10-19-17(20)14-6-3-4-7-15(14)18(19)21/h3-8,11-13H,9-10H2,1-2H3
PDB
MMDB

KEGG

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a>5.96E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2NG4P3G
More data for this
Ligand-Target Pair