BDBM78821 MLS000770435::N-[2-(diethylamino)ethyl]-4-[[(E)-3-(3-ethoxy-4-isobutoxy-phenyl)acryloyl]amino]benzamide::N-[2-(diethylamino)ethyl]-4-[[(E)-3-[3-ethoxy-4-(2-methylpropoxy)phenyl]-1-oxoprop-2-enyl]amino]benzamide::N-[2-(diethylamino)ethyl]-4-[[(E)-3-[3-ethoxy-4-(2-methylpropoxy)phenyl]prop-2-enoyl]amino]benzamide::SMR000343743::cid_5965108

SMILES CCOc1cc(\C=C\C(=O)Nc2ccc(cc2)C(=O)NCCN(CC)CC)ccc1OCC(C)C

InChI Key InChIKey=XTKCDFBHEUHUSB-MHWRWJLKSA-N

Data  3 IC50  1 EC50

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 78821   

TargetUbiquitin-conjugating enzyme E2 N(Homo sapiens (Human))
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM78821(MLS000770435 | N-[2-(diethylamino)ethyl]-4-[[(E)-3...)
Affinity DataIC50: >2.00E+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 DepthDetails PCBioAssay
TargetApoptotic protease-activating factor 1(Homo sapiens (Human))
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM78821(MLS000770435 | N-[2-(diethylamino)ethyl]-4-[[(E)-3...)
Affinity DataIC50:  2.85E+4nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBIMR, San Diego, C...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetApoptotic protease-activating factor 1(Homo sapiens (Human))
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM78821(MLS000770435 | N-[2-(diethylamino)ethyl]-4-[[(E)-3...)
Affinity DataEC50: >1.00E+5nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBIMR, San Diego, C...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetCaspase-9(Homo sapiens (Human))
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM78821(MLS000770435 | N-[2-(diethylamino)ethyl]-4-[[(E)-3...)
Affinity DataIC50:  7.47E+4nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBIMR, San Diego, C...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay