BindingDB logo
myBDB logout

2 similar compounds to monomer 46942

Compile data set for download or QSAR
Wt: 269.3
BDBM59366
Purchase
Wt: 311.4
BDBM62747
Purchase

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 59366,62747   
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
Hsf1 protein


(Mus musculus)
BDBM62747
PNG
(MLS000051345 | N-cyclohexyl-4-ethoxy-2,5-dimethyl-...)
Show SMILES CCOc1cc(C)c(cc1C)S(=O)(=O)NC1CCCCC1
Show InChI InChI=1S/C16H25NO3S/c1-4-20-15-10-13(3)16(11-12(15)2)21(18,19)17-14-8-6-5-7-9-14/h10-11,14,17H,4-9H2,1-3H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
GoogleScholar
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a>1.95E+5n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
X-linked inhibitor of apoptosis protein (XIAP)


(Homo sapiens (Human))
BDBM59366
PNG
(1-(4-methoxy-2,3-dimethyl-phenyl)sulfonylpyrrolidi...)
Show SMILES COc1ccc(c(C)c1C)S(=O)(=O)N1CCCC1
Show InChI InChI=1S/C13H19NO3S/c1-10-11(2)13(7-6-12(10)17-3)18(15,16)14-8-4-5-9-14/h6-7H,4-5,8-9H2,1-3H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
Purchase

PC cid
PC sid
UniChem

Similars

Article
PCBioAssay
n/an/a 1.00E+5n/an/an/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)


Article DOI: 10.1016/j.bioorg.2014.02.002
BindingDB Entry DOI: 10.7270/Q2HD7T4S
More data for this
Ligand-Target Pair