BDBM44531 5-[(1-cyclohexyl-2,5-dimethyl-1H-pyrrol-3-yl)methylene]-1,3-dimethyl-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione::5-[(1-cyclohexyl-2,5-dimethyl-3-pyrrolyl)methylidene]-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione::5-[(1-cyclohexyl-2,5-dimethyl-pyrrol-3-yl)methylene]-1,3-dimethyl-2-thioxo-hexahydropyrimidine-4,6-quinone::5-[(1-cyclohexyl-2,5-dimethyl-pyrrol-3-yl)methylidene]-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione::5-[(1-cyclohexyl-2,5-dimethylpyrrol-3-yl)methylidene]-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione::MLS000573011::SMR000194712::cid_1347165

SMILES [#6]-[#7]-1-[#6](=S)-[#7](-[#6])-[#6](=O)\[#6](=[#6]/c2cc(-[#6])n(-[#6]-3-[#6]-[#6]-[#6]-[#6]-[#6]-3)c2-[#6])-[#6]-1=O

InChI Key InChIKey=WXGPATLNQUUVPE-UHFFFAOYSA-N

Data  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 44531   

TargetEphrin type-A receptor 4(Mus musculus)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM44531(5-[(1-cyclohexyl-2,5-dimethyl-1H-pyrrol-3-yl)methy...)
Affinity DataIC50: >5.00E+4nMAssay Description:Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetEphrin type-A receptor 4(Mus musculus)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM44531(5-[(1-cyclohexyl-2,5-dimethyl-1H-pyrrol-3-yl)methy...)
Affinity DataIC50:  5.14E+3nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay