BDBM50572 (3S,4S)-5-[(3S,4S)-4,10-dihydroxy-7,9-dimethoxy-3-methyl-3,4-dihydro-1H-benz[g]isochromen-5-yl]-7,9-dimethoxy-3-methyl-3,4-dihydro-1H-benz[g]isochromene-4,10-diol::(3S,4S)-5-[(3S,4S)-4,10-dihydroxy-7,9-dimethoxy-3-methyl-3,4-dihydro-1H-benzo[g][2]benzopyran-5-yl]-7,9-dimethoxy-3-methyl-3,4-dihydro-1H-benzo[g][2]benzopyran-4,10-diol::(3S,4S)-5-[(3S,4S)-4,10-dihydroxy-7,9-dimethoxy-3-methyl-3,4-dihydro-1H-benzo[g]isochromen-5-yl]-7,9-dimethoxy-3-methyl-3,4-dihydro-1H-benzo[g]isochromene-4,10-diol::(3S,4S)-5-[(3S,4S)-7,9-dimethoxy-3-methyl-4,10-bis(oxidanyl)-3,4-dihydro-1H-benzo[g]isochromen-5-yl]-7,9-dimethoxy-3-methyl-3,4-dihydro-1H-benzo[g]isochromene-4,10-diol::MLS000876833::SMR000440565::cid_10257591

SMILES COc1cc(OC)c2c(O)c3CO[C@@H](C)[C@@H](O)c3c(-c3c4[C@H](O)[C@H](C)OCc4c(O)c4c(OC)cc(OC)cc34)c2c1

InChI Key InChIKey=AVAQRWVGWWNBIN-CUAUGLLKSA-N

Data  5 IC50  2 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50572   

TargetInduced myeloid leukemia cell differentiation protein Mcl-1(Homo sapiens (Human))
Emory University

Curated by PubChem BioAssay
LigandPNGBDBM50572((3S,4S)-5-[(3S,4S)-4,10-dihydroxy-7,9-dimethoxy-3-...)
Affinity DataIC50:  2.51E+3nMAssay Description:NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Nikolovska-Coleska, Univer...More data for this Ligand-Target Pair
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