BDBM79395 (5R)-1-[[(2S)-1-[(2S)-2-[(4R)-2-azanylidene-4-[(2R)-butan-2-yl]-3-[2-(3,4-dichlorophenyl)ethyl]imidazolidin-1-yl]propyl]pyrrolidin-2-yl]methyl]-5-propan-2-yl-4,5-dihydroimidazol-2-amine::(5R)-1-[[(2S)-1-[(2S)-2-[(4R)-4-[(2R)-butan-2-yl]-3-[2-(3,4-dichlorophenyl)ethyl]-2-imino-1-imidazolidinyl]propyl]-2-pyrrolidinyl]methyl]-5-propan-2-yl-4,5-dihydroimidazol-2-amine::(5R)-1-[[(2S)-1-[(2S)-2-[(4R)-4-[(2R)-butan-2-yl]-3-[2-(3,4-dichlorophenyl)ethyl]-2-iminoimidazolidin-1-yl]propyl]pyrrolidin-2-yl]methyl]-5-propan-2-yl-4,5-dihydroimidazol-2-amine::MLS002477285::SMR001399208::[(5R)-1-[[(2S)-1-[(2S)-2-[(4R)-3-[2-(3,4-dichlorophenyl)ethyl]-2-imino-4-[(1R)-1-methylpropyl]imidazolidin-1-yl]propyl]pyrrolidin-2-yl]methyl]-5-isopropyl-2-imidazolin-2-yl]amine::cid_44246587

SMILES CC[C@@H](C)[C@@H]1CN([C@@H](C)CN2CCC[C@H]2CN2[C@@H](CN=C2N)C(C)C)C(=N)N1CCc1ccc(Cl)c(Cl)c1

InChI Key InChIKey=QTOQSFUMTPVZMK-KTLQOYRUSA-N

Data  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 79395   

TargetRNA-editing ligase 1, mitochondrial(Trypanosoma brucei brucei)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM79395((5R)-1-[[(2S)-1-[(2S)-2-[(4R)-2-azanylidene-4-[(2R...)
Affinity DataIC50: >9.66E+4nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute Ass...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetUbiquitin-conjugating enzyme E2 N(Homo sapiens (Human))
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM79395((5R)-1-[[(2S)-1-[(2S)-2-[(4R)-2-azanylidene-4-[(2R...)
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