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BDBM82835 4-(5,5-dimethyl-3-morpholin-4-yl-cyclohex-2-en-1-ylidene)-2,6-dimethyl-morpholin-4-ium;iodide::4-(5,5-dimethyl-3-morpholin-4-ylcyclohex-2-en-1-ylidene)-2,6-dimethylmorpholin-4-ium;iodide::4-(5,5-dimethyl-3-morpholino-cyclohex-2-en-1-ylidene)-2,6-dimethyl-morpholin-4-ium;iodide::4-[5,5-dimethyl-3-(4-morpholinyl)-1-cyclohex-2-enylidene]-2,6-dimethylmorpholin-4-ium;iodide::MLS001032833::SMR000363499::cid_16196366

SMILES: [#6]-[#6]-1-[#6]\[#7+](-[#6]-[#6](-[#6])-[#8]-1)=[#6]-1/[#6]C([#6])([#6])[#6]-[#6](=[#6]-1)-[#7]-1-[#6]-[#6]-[#8]-[#6]-[#6]-1

InChI Key: InChIKey=FOHQMBFMAQGJHL-UHFFFAOYSA-N

Data: 1 IC50

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 = 82835   
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
carboxy-terminal domain RNA polymerase II polypeptide A small phosphatase 1 isoform 1


(Homo sapiens (Human))
BDBM82835
PNG
(4-(5,5-dimethyl-3-morpholin-4-yl-cyclohex-2-en-1-y...)
Show SMILES [#6]-[#6]-1-[#6]\[#7+](-[#6]-[#6](-[#6])-[#8]-1)=[#6]-1/[#6]C([#6])([#6])[#6]-[#6](=[#6]-1)-[#7]-1-[#6]-[#6]-[#8]-[#6]-[#6]-1 |c:15|
Show InChI InChI=1S/C18H31N2O2/c1-14-12-20(13-15(2)22-14)17-9-16(10-18(3,4)11-17)19-5-7-21-8-6-19/h9,14-15H,5-8,10-13H2,1-4H3/q+1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.83E+3n/an/an/an/an/an/a



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 (2011)


BindingDB Entry DOI: 10.7270/Q2V986KM
More data for this
Ligand-Target Pair