BindingDB logo
myBDB logout

null

SMILES: CCn1cc(C(=O)NCCC2=CCCCC2)c(=O)c2cc(ccc12)S(=O)(=O)N(C)C

InChI Key: InChIKey=HJTABMAEVMBUTK-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 1 hit for monomerid = 37585   
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
Huntingtin


(Homo sapiens (Human))
BDBM37585
PNG
(MLS000117493 | N-[2-(1-cyclohexenyl)ethyl]-6-(dime...)
Show SMILES CCn1cc(C(=O)NCCC2=CCCCC2)c(=O)c2cc(ccc12)S(=O)(=O)N(C)C |t:10|
Show InChI InChI=1S/C22H29N3O4S/c1-4-25-15-19(22(27)23-13-12-16-8-6-5-7-9-16)21(26)18-14-17(10-11-20(18)25)30(28,29)24(2)3/h8,10-11,14-15H,4-7,9,12-13H2,1-3H3,(H,23,27)
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>8.00E+3n/an/an/an/an/an/a



Columbia University Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
The mutation underlying Huntington's disease is an expansion of a polyglutamine tract in the N-terminus of the protein huntingtin (htt). Under no...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2SQ8XSH
More data for this
Ligand-Target Pair