Brief Information of the Compound and Protein
Compound Name
(4S)-1-[(1S)-1-benzyl-2-[(2R)-2-[[(5S)-5-(4-hydroxybenzyl)-2-thioxo-imidazolidin-1-yl]methyl]pyrrolidino]ethyl]-4-(4-hydroxybenzyl)-3-phenethyl-imidazolidine-2-thione
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PubChem ID
CID: 51359484
Canonical SMILES
Oc1ccc(C[C@H]2CNC(=S)N2C[C@H]2CCCN2C[C@H](Cc2ccccc2)N2C[C@H](Cc3ccc(O)cc3)N(CCc3ccccc3)C2=S)cc1
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Compound Formula C42H49N5O2S2
Compound Structure
Protein Name
Mothers against decapentaplegic homolog 3
Protein Classification
Transcription factor
Uniprot ID
P84022
Gene Name
SMAD3
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000063 Hep-G2 Homo sapiens (Human)  1
1
Potency ~ 5173.5 nM
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