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SMILES: CCn1c(SCCOc2ccc(Cl)cc2)nnc1-c1cccs1

InChI Key: InChIKey=MIMVYAYAKVFXDV-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 2 hits for monomerid = 71727   
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
Voltage-dependent T-type calcium channel subunit alpha-1H


(Homo sapiens (Human))
BDBM71727
PNG
(3-[2-(4-chloranylphenoxy)ethylsulfanyl]-4-ethyl-5-...)
Show SMILES CCn1c(SCCOc2ccc(Cl)cc2)nnc1-c1cccs1
Show InChI InChI=1S/C16H16ClN3OS2/c1-2-20-15(14-4-3-10-22-14)18-19-16(20)23-11-9-21-13-7-5-12(17)6-8-13/h3-8,10H,2,9,11H2,1H3
UniProtKB/SwissProt

antibodypedia
GoogleScholar
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PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a 5.63E+3n/an/an/an/a



Vanderbilt Screening Center for GPCRs, Ion Channels and Transporters

Curated by PubChem BioAssay


Assay Description
Assay Provider: Xinmin Xie Assay Provider Affiliation: Bioscience Division, SRI International, Menlo Park, CA Grant Title: HTS Assay for Cav3 T-Type ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2B856KG
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)
BDBM71727
PNG
(3-[2-(4-chloranylphenoxy)ethylsulfanyl]-4-ethyl-5-...)
Show SMILES CCn1c(SCCOc2ccc(Cl)cc2)nnc1-c1cccs1
Show InChI InChI=1S/C16H16ClN3OS2/c1-2-20-15(14-4-3-10-22-14)18-19-16(20)23-11-9-21-13-7-5-12(17)6-8-13/h3-8,10H,2,9,11H2,1H3
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a>2.60E+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: Confirmation testing of small molecules identifie...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2P55KXK
More data for this
Ligand-Target Pair