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BDBM64181 4-(7-ethyl-1H-indol-3-yl)-N-(2-methoxyethyl)-1,3-thiazol-2-amine::4-(7-ethyl-1H-indol-3-yl)-N-(2-methoxyethyl)-2-thiazolamine::MLS001174721::SMR000591886::[4-(7-ethyl-1H-indol-3-yl)thiazol-2-yl]-(2-methoxyethyl)amine::cid_4826888

SMILES: CCc1cccc2c(c[nH]c12)-c1csc(NCCOC)n1

InChI Key: InChIKey=DBCHIJGLXLMNRL-UHFFFAOYSA-N

Data: 3 EC50

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 = 64181   
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)
BDBM64181
PNG
(4-(7-ethyl-1H-indol-3-yl)-N-(2-methoxyethyl)-1,3-t...)
Show SMILES CCc1cccc2c(c[nH]c12)-c1csc(NCCOC)n1
Show InChI InChI=1S/C16H19N3OS/c1-3-11-5-4-6-12-13(9-18-15(11)12)14-10-21-16(19-14)17-7-8-20-2/h4-6,9-10,18H,3,7-8H2,1-2H3,(H,17,19)
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
GoogleScholar
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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
LARGE


(Homo sapiens (Human))
BDBM64181
PNG
(4-(7-ethyl-1H-indol-3-yl)-N-(2-methoxyethyl)-1,3-t...)
Show SMILES CCc1cccc2c(c[nH]c12)-c1csc(NCCOC)n1
Show InChI InChI=1S/C16H19N3OS/c1-3-11-5-4-6-12-13(9-18-15(11)12)14-10-21-16(19-14)17-7-8-20-2/h4-6,9-10,18H,3,7-8H2,1-2H3,(H,17,19)
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a 4.75E+3n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2VT1QQ4
More data for this
Ligand-Target Pair
LARGE


(Homo sapiens (Human))
BDBM64181
PNG
(4-(7-ethyl-1H-indol-3-yl)-N-(2-methoxyethyl)-1,3-t...)
Show SMILES CCc1cccc2c(c[nH]c12)-c1csc(NCCOC)n1
Show InChI InChI=1S/C16H19N3OS/c1-3-11-5-4-6-12-13(9-18-15(11)12)14-10-21-16(19-14)17-7-8-20-2/h4-6,9-10,18H,3,7-8H2,1-2H3,(H,17,19)
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a 4.88E+3n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2833QM1
More data for this
Ligand-Target Pair