BDBM78578 (E)-3-[3-[(2-bromanyl-4-chloranyl-phenoxy)methyl]-4-methoxy-phenyl]-N-(1,3,5-trimethylpyrazol-4-yl)prop-2-enamide::(E)-3-[3-[(2-bromo-4-chloro-phenoxy)methyl]-4-methoxy-phenyl]-N-(1,3,5-trimethylpyrazol-4-yl)acrylamide::(E)-3-[3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyphenyl]-N-(1,3,5-trimethyl-4-pyrazolyl)-2-propenamide::(E)-3-[3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyphenyl]-N-(1,3,5-trimethylpyrazol-4-yl)prop-2-enamide::3-{3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyphenyl}-N-(1,3,5-trimethyl-1H-pyrazol-4-yl)acrylamide::MLS000548222::SMR000115070::cid_5430631

SMILES COc1ccc(\C=C\C(=O)Nc2c(C)nn(C)c2C)cc1COc1ccc(Cl)cc1Br

InChI Key InChIKey=YXDWLYAHXWHFOK-UHFFFAOYSA-N

Data  3 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 3 hits for monomerid = 78578   

TargetBcl-2-related protein A1(Mouse)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM78578(3-{3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyph...)
Affinity DataIC50: 3.32E+3nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego CA...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/3/2011
Entry Details
PCBioAssay
TargetUbiquitin-conjugating enzyme E2 N(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM78578(3-{3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyph...)
Affinity DataIC50: 1.56E+4nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego CA...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/2/2011
Entry Details
PCBioAssay
TargetUbiquitin-conjugating enzyme E2 N(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM78578(3-{3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyph...)
Affinity DataIC50: 1.74E+4nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego CA...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/2/2011
Entry Details
PCBioAssay